| 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 | 36.7 | Very low | 26.9 | Very low | 238 Ų | 238 | 139.5 Ų | 139.5 | 100% | 1.172 | 81% | 0.814 | S | S | * | * | 0 | 83.2 | 0 | -72.8 | 168.3 | 175.6 | 0 | 0 | 105.9 | |||||
| 2 | A | 25.7 | Very low | 26.8 | Very low | 97 Ų | 97 | 141.7 Ų | 141.7 | 80% | 0.802 | 82% | 0.82 | S | S | * | * | 54.8 | 124.3 | 80.7 | 0 | 0 | 0 | 0 | 0 | 110 | |||||
| 3 | S | 24.6 | Very low | 26.5 | Very low | 107 Ų | 107 | 135.8 Ų | 135.8 | 75% | 0.748 | 81% | 0.809 | S | S | * | * | cis | 173 | 134.2 | 11.9 | 37.5 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 4 | V | 27.2 | Very low | 26.7 | Very low | 146 Ų | 146 | 136.8 Ų | 136.8 | 89% | 0.885 | 82% | 0.817 | S | S | * | * | trans | -145.4 | 132.2 | 153.9 | -175.6 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 5 | P | 32.8 | Very low | 26.9 | Very low | 118 Ų | 118 | 134.3 Ų | 134.3 | 77% | 0.766 | 82% | 0.817 | S | S | * | * | trans | -107 | 176.3 | -163.3 | 22.9 | -0.9 | 0 | 0 | 0 | 114.5 | ||||
| 6 | T | 25.9 | Very low | 27 | Very low | 131 Ų | 131 | 128.9 Ų | 128.9 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | trans | -68.2 | 152.4 | 176 | 41.2 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 7 | A | 28.3 | Very low | 27.1 | Very low | 93 Ų | 93 | 129.3 Ų | 129.3 | 77% | 0.769 | 80% | 0.798 | S | S | * | * | trans | 30.7 | 129.4 | 142.8 | 0 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 8 | E | 25.7 | Very low | 27.1 | Very low | 188 Ų | 188 | 124.6 Ų | 124.6 | 88% | 0.879 | 78% | 0.78 | S | S | * | * | 168.3 | 118 | 125 | -92.1 | -178.9 | 168.7 | 0 | 0 | 109.7 | |||||
| 9 | S | 22.6 | Very low | 27.1 | Very low | 96 Ų | 96 | 123.2 Ų | 123.2 | 67% | 0.671 | 77% | 0.77 | S | S | * | * | 61 | 127.5 | 105.8 | -178.9 | 0 | 0 | 0 | 0 | 115.8 | |||||
| 10 | W | 22.9 | Very low | 27.2 | Very low | 217 Ų | 217 | 124.7 Ų | 124.7 | 82% | 0.822 | 77% | 0.767 | S | S | * | * | 167.5 | 106.2 | 127.8 | -91.8 | 88.3 | 0 | 0 | 0 | 111 | |||||
| 11 | T | 23.2 | Very low | 27.3 | Very low | 103 Ų | 103 | 121.9 Ų | 121.9 | 63% | 0.632 | 76% | 0.757 | S | S | * | * | trans | 54 | 126.3 | 133 | 62.6 | 0 | 0 | 0 | 0 | 123.8 | ||||
| 12 | D | 25.7 | Very low | 27 | Very low | 166 Ų | 166 | 116.6 Ų | 116.6 | 89% | 0.888 | 73% | 0.729 | S | S | * | * | trans | 51.8 | 120 | 136.5 | -76 | -26 | 0 | 0 | 0 | 121.8 | ||||
| 13 | G | 23.6 | Very low | 27.2 | Very low | 66 Ų | 66 | 116.7 Ų | 116.7 | 68% | 0.68 | 72% | 0.716 | S | S | * | * | trans | -164.9 | 83.5 | 164.1 | 0 | 0 | 0 | 0 | 0 | 110.1 | A15 | G13-A15 PolarHBondContact O-N 3.19Š| ||
| 14 | T | 29.6 | Very low | 27.5 | Very low | 149 Ų | 149 | 114.8 Ų | 114.8 | 91% | 0.914 | 70% | 0.697 | S | S | * | * | trans | -40.4 | 96.9 | 166.9 | 42.9 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 15 | A | 28.6 | Very low | 27.7 | Very low | 99 Ų | 99 | 109.6 Ų | 109.6 | 82% | 0.818 | 67% | 0.668 | S | S | * | * | trans | -110.1 | 77.7 | 170.6 | 0 | 0 | 0 | 0 | 0 | 110 | G13 | G13-A15 PolarHBondContact O-N 3.19Š| ||
| 16 | G | 28.9 | Very low | 27.6 | Very low | 48 Ų | 48 | 105 Ų | 105 | 50% | 0.495 | 64% | 0.64 | S | S | . | * | trans | 49 | 82.3 | 137.2 | 0 | 0 | 0 | 0 | 0 | 118.6 | G18 T19 | G16-G18 PolarHBondContact O-N 3.14Å; G16-T19 PolarHBondContact O-N 3.15Å; G16-T19 PolarHBondContact O-OG1 2.88Å | ||
| 17 | V | 29.3 | Very low | 28 | Very low | 136 Ų | 136 | 99.6 Ų | 99.6 | 82% | 0.824 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.8 | -6.8 | 158.5 | 174.9 | 0 | 0 | 0 | 0 | 113.4 | ||
| 18 | G | 26.3 | Very low | 28.4 | Very low | 45 Ų | 45 | 96.3 Ų | 96.3 | 46% | 0.464 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -74 | -33.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 115.9 | G16 Q20 E22 | G16-G18 PolarHBondContact O-N 3.14Å; G18-Q20 PolarHBondContact O-N 3.18Å; G18-E22 PolarHBondContact O-N 2.97Å |
| 19 | T | 27.6 | Very low | 29.2 | Very low | 97 Ų | 97 | 88.1 Ų | 88.1 | 60% | 0.595 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -77.8 | -22.4 | -173.1 | 43.5 | 0 | 0 | 0 | 0 | 113.9 | G16 N23 | G16-T19 PolarHBondContact O-N 3.15Å; G16-T19 PolarHBondContact O-OG1 2.88Å; T19-N23 WeakPolarHBondContact O-CB 3.43Å; T19-N23 PolarHBondContact O-N 3.49Å; T19-N23 PolarHBondContact O-ND2 2.82Å; T19-N23 VanDerWaalsContact O-ND2 3.11Å |
| 20 | Q | 29.5 | Very low | 30.1 | Very low | 154 Ų | 154 | 84.2 Ų | 84.2 | 72% | 0.72 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -78.5 | -34.3 | 174.8 | -111.3 | 175.2 | -3.9 | 0 | 0 | 112.6 | G18 L24 | G18-Q20 PolarHBondContact O-N 3.18Å; Q20-L24 WeakPolarHBondContact O-CD1 3.35Å; Q20-L24 PolarHBondContact O-N 2.99Å |
| 21 | A | 29.1 | Very low | 30.9 | Very low | 66 Ų | 66 | 74.7 Ų | 74.7 | 55% | 0.545 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -73.8 | -34.2 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | L24 | A21-L24 PolarHBondContact O-N 3.04Å |
| 22 | E | 29.6 | Very low | 31.9 | Very low | 127 Ų | 127 | 70 Ų | 70 | 59% | 0.593 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -71.6 | -39.2 | 176.5 | -70.9 | -176.7 | 147.2 | 0 | 0 | 112 | G18 L24 S25 | G18-E22 PolarHBondContact O-N 2.97Å; E22-L24 VanDerWaalsContact C-N 3.3Å; E22-L24 PolarHBondContact O-N 3.39Å; E22-S25 PolarHBondContact O-N 2.83Å; E22-S25 PolarHBondContact O-OG 3.19Å |
| 23 | N | 29.9 | Very low | 32.6 | Very low | 98 Ų | 98 | 63.3 Ų | 63.3 | 52% | 0.524 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -68.7 | -25.7 | 174.4 | -78.8 | -28.6 | 0 | 0 | 0 | 113.6 | T19 | T19-N23 WeakPolarHBondContact O-CB 3.43Å; T19-N23 PolarHBondContact O-N 3.49Å; T19-N23 PolarHBondContact O-ND2 2.82Å; T19-N23 VanDerWaalsContact O-ND2 3.11Å |
| 24 | L | 30.9 | Very low | 33.3 | Very low | 68 Ų | 68 | 60.8 Ų | 60.8 | 36% | 0.356 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -69.5 | -33.2 | 174.3 | -108.3 | 89.9 | 0 | 0 | 0 | 112 | Q20 A21 E22 A26 L28 | Q20-L24 WeakPolarHBondContact O-CD1 3.35Å; Q20-L24 PolarHBondContact O-N 2.99Å; A21-L24 PolarHBondContact O-N 3.04Å; E22-L24 VanDerWaalsContact C-N 3.3Å; E22-L24 PolarHBondContact O-N 3.39Å; L24-A26 PolarHBondContact O-N 3.45Å; L24-L28 WeakPolarHBondContact O-CD1 3.34Å; L24-L28 WeakPolarHBondContact O-CG 3.49Å |
| 25 | S | 31.3 | Very low | 33.7 | Very low | 37 Ų | 37 | 53.8 Ų | 53.8 | 26% | 0.259 | 34% | 0.342 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.3 | -23.4 | -171.2 | 71.1 | 0 | 0 | 0 | 0 | 114.9 | E22 | E22-S25 PolarHBondContact O-N 2.83Å; E22-S25 PolarHBondContact O-OG 3.19Å |
| 26 | A | 31.1 | Very low | 34.1 | Very low | 22 Ų | 22 | 50.6 Ų | 50.6 | 18% | 0.182 | 31% | 0.311 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -110.9 | 3.4 | -170.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | L24 P228 H231 | L24-A26 PolarHBondContact O-N 3.45Å; A26-P228 HydrophobicContact CB-CB 3.22Å; A26-P228 HydrophobicContact CB-CG 4.01Å; A26-H231 PolarHBondContact O-ND1 3.45Å |
| 27 | A | 33.9 | Very low | 34.4 | Very low | 17 Ų | 17 | 49.6 Ų | 49.6 | 14% | 0.14 | 29% | 0.294 | C | S | . | . | S | Bend | trans | -113.2 | 11.8 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||
| 28 | L | 36.8 | Very low | 34.6 | Very low | 24 Ų | 24 | 44.7 Ų | 44.7 | 13% | 0.126 | 27% | 0.268 | C | S | . | . | trans | -100.5 | 132.5 | -169.6 | -62.9 | 161.2 | 0 | 0 | 0 | 110.9 | L24 E32 L36 | L24-L28 WeakPolarHBondContact O-CD1 3.34Å; L24-L28 WeakPolarHBondContact O-CG 3.49Å; L28-E32 WeakPolarHBondContact CA-OE2 3.05Å; L28-E32 HydrophobicContact CB-CB 4.19Å; L28-E32 HydrophobicContact CD2-CB 4.29Å; L28-E32 HydrophobicContact CD2-CG 3.79Å; L28-E32 VanDerWaalsContact CD2-OE2 3.23Å; L28-E32 WeakPolarHBondContact CD2-OE2 3.41Å; L28-L36 HydrophobicContact CD1-CD1 3.2Å; L28-L36 HydrophobicContact CD2-CD1 3.29Å; L28-L36 HydrophobicContact CG-CD1 3.82Å | ||
| 29 | G | 42.5 | Very low | 35 | Very low | 15 Ų | 15 | 44.2 Ų | 44.2 | 16% | 0.155 | 26% | 0.263 | C | S | . | . | trans | -62.6 | 157.7 | 164.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | T31 E32 W33 | G29-T31 VanDerWaalsContact C-N 3.29Å; G29-T31 PolarHBondContact O-N 3.44Å; G29-E32 PolarHBondContact N-OE2 3.15Å; G29-E32 WeakPolarHBondContact O-CA 3.29Å; G29-E32 WeakPolarHBondContact O-CB 3.38Å; G29-E32 PolarHBondContact O-N 2.97Å; G29-W33 PolarHBondContact O-N 2.95Å; G29-W33 VanDerWaalsContact O-N 3.13Å | ||
| 30 | V | 41.7 | Very low | 35.2 | Very low | 15 Ų | 15 | 45.2 Ų | 45.2 | 9% | 0.091 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -71.7 | -28.2 | -171 | -161.3 | 0 | 0 | 0 | 0 | 113.6 | E32 W33 L34 Y305 F306 Y325 | V30-E32 PolarHBondContact O-N 3.29Å; V30-W33 PolarHBondContact O-N 2.82Å; V30-L34 WeakPolarHBondContact O-CG 2.62Å; V30-L34 PolarHBondContact O-N 3.36Å; V30-Y305 HydrophobicContact CG1-CE1 3.81Å; V30-Y305 HydrophobicContact CG2-CE1 4.33Å; V30-F306 HydrophobicContact CB-CZ 4.41Å; V30-F306 HydrophobicContact CG2-CD1 4.22Å; V30-F306 HydrophobicContact CG2-CE1 3.17Å; V30-F306 HydrophobicContact CG2-CE2 3.96Å; V30-F306 HydrophobicContact CG2-CZ 3.02Å; V30-Y325 HydrophobicContact CB-CD2 3.91Å; V30-Y325 HydrophobicContact CB-CE1 4.03Å; V30-Y325 HydrophobicContact CB-CE2 3.32Å; V30-Y325 HydrophobicContact CB-CG 4.42Å; V30-Y325 HydrophobicContact CG1-CD1 3.61Å; V30-Y325 HydrophobicContact CG1-CD2 3.1Å; V30-Y325 HydrophobicContact CG1-CE1 3.61Å; V30-Y325 HydrophobicContact CG1-CE2 3.08Å; V30-Y325 HydrophobicContact CG1-CG 3.33Å; V30-Y325 HydrophobicContact CG2-CD2 4.29Å; V30-Y325 HydrophobicContact CG2-CE2 3.73Å |
| 31 | T | 39.6 | Very low | 35.3 | Very low | 17 Ų | 17 | 44.7 Ų | 44.7 | 10% | 0.104 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -55 | -32.3 | 165 | 39 | 0 | 0 | 0 | 0 | 112.3 | G29 A35 N129 Y132 | G29-T31 VanDerWaalsContact C-N 3.29Å; G29-T31 PolarHBondContact O-N 3.44Å; T31-A35 PolarHBondContact O-N 2.97Å; T31-N129 WeakPolarHBondContact CG2-OD1 3.33Å; T31-Y132 HydrophobicContact CG2-CD1 3.66Å; T31-Y132 HydrophobicContact CG2-CE1 3.74Å; T31-Y132 WeakPolarHBondContact O-CE1 3.03Å; T31-Y132 PolarHBondContact O-OH 3.38Å |
| 32 | E | 44.5 | Very low | 35.5 | Very low | 3 Ų | 3 | 45.5 Ų | 45.5 | 1% | 0.014 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -90.6 | -25.3 | -172.5 | -152.9 | 179.6 | -171.3 | 0 | 0 | 113.4 | L28 G29 V30 A35 L36 L219 Y221 | L28-E32 WeakPolarHBondContact CA-OE2 3.05Å; L28-E32 HydrophobicContact CB-CB 4.19Å; L28-E32 HydrophobicContact CD2-CB 4.29Å; L28-E32 HydrophobicContact CD2-CG 3.79Å; L28-E32 VanDerWaalsContact CD2-OE2 3.23Å; L28-E32 WeakPolarHBondContact CD2-OE2 3.41Å; G29-E32 PolarHBondContact N-OE2 3.15Å; G29-E32 WeakPolarHBondContact O-CA 3.29Å; G29-E32 WeakPolarHBondContact O-CB 3.38Å; G29-E32 PolarHBondContact O-N 2.97Å; V30-E32 PolarHBondContact O-N 3.29Å; E32-A35 PolarHBondContact O-N 3.41Å; E32-L36 HydrophobicContact CG-CD1 4.4Å; E32-L36 WeakPolarHBondContact O-CB 3.36Å; E32-L36 WeakPolarHBondContact O-CG 3.45Å; E32-L36 PolarHBondContact O-N 3.14Å; E32-L219 HydrophobicContact CG-CB 4.31Å; E32-L219 HydrophobicContact CG-CD1 4.36Å; E32-Y221 WeakPolarHBondContact OE1-CA 3.47Å; E32-Y221 WeakPolarHBondContact OE1-CB 3.38Å; E32-Y221 WeakPolarHBondContact OE1-CD1 3.43Å; E32-Y221 PolarHBondContact OE1-N 3.45Å; E32-Y221 WeakPolarHBondContact OE2-CA 3.12Å; E32-Y221 WeakPolarHBondContact OE2-CB 3.36Å |
| 33 | W | 40.3 | Very low | 35.7 | Very low | 27 Ų | 27 | 44.4 Ų | 44.4 | 10% | 0.102 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -66.7 | -42.9 | 169.2 | -150.4 | 84.4 | 0 | 0 | 0 | 111.6 | G29 V30 A35 L36 Q37 N316 I321 | G29-W33 PolarHBondContact O-N 2.95Å; G29-W33 VanDerWaalsContact O-N 3.13Å; V30-W33 PolarHBondContact O-N 2.82Å; W33-A35 VanDerWaalsContact C-N 3.29Å; W33-A35 PolarHBondContact O-N 3.04Å; W33-L36 PolarHBondContact O-N 3.36Å; W33-Q37 HydrophobicContact CH2-CG 3.56Å; W33-Q37 HydrophobicContact CZ2-CG 4.37Å; W33-Q37 HydrophobicContact CZ3-CB 4.47Å; W33-Q37 HydrophobicContact CZ3-CG 3.75Å; W33-Q37 PolarHBondContact O-N 2.63Å; W33-N316 HydrophobicContact CD2-CB 4.38Å; W33-N316 HydrophobicContact CH2-CB 4.23Å; W33-N316 WeakPolarHBondContact CH2-O 3.4Å; W33-N316 HydrophobicContact CZ2-CB 3.43Å; W33-N316 VanDerWaalsContact CZ2-CB 3.43Å; W33-N316 WeakPolarHBondContact CZ2-O 3.43Å; W33-N316 VanDerWaalsContact CZ3-O 3.27Å; W33-N316 WeakPolarHBondContact CZ3-O 3.13Å; W33-N316 PolarHBondContact NE1-ND2 2.95Å; W33-N316 PolarHBondContact NE1-OD1 2.92Å; W33-I321 HydrophobicContact CE3-CG2 3.83Å; W33-I321 HydrophobicContact CH2-CG2 3.94Å; W33-I321 HydrophobicContact CZ3-CG2 3.2Å |
| 34 | L | 38.7 | Very low | 35.8 | Very low | 13 Ų | 13 | 43.8 Ų | 43.8 | 7% | 0.068 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -59.5 | -40.7 | 173.5 | -65.9 | -172.2 | 0 | 0 | 0 | 112.4 | V30 Q322 Y325 | V30-L34 WeakPolarHBondContact O-CG 2.62Å; V30-L34 PolarHBondContact O-N 3.36Å; L34-Q322 HydrophobicContact CD2-CB 3.41Å; L34-Q322 VanDerWaalsContact CD2-CB 3.41Å; L34-Q322 HydrophobicContact CD2-CG 3.28Å; L34-Q322 HydrophobicContact CG-CG 4.47Å; L34-Y325 HydrophobicContact CD1-CD1 3.85Å; L34-Y325 HydrophobicContact CD1-CE1 3.99Å; L34-Y325 HydrophobicContact CG-CD1 4.32Å |
| 35 | A | 37.4 | Very low | 35.8 | Very low | 1 Ų | 1 | 48.4 Ų | 48.4 | 1% | 0.008 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -73.2 | -46.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | T31 E32 W33 Q37 A38 Y132 R217 L219 | T31-A35 PolarHBondContact O-N 2.97Å; E32-A35 PolarHBondContact O-N 3.41Å; W33-A35 VanDerWaalsContact C-N 3.29Å; W33-A35 PolarHBondContact O-N 3.04Å; A35-Q37 VanDerWaalsContact C-N 3.26Å; A35-Q37 PolarHBondContact O-N 3.26Å; A35-Q37 VanDerWaalsContact O-N 3.13Å; A35-A38 WeakPolarHBondContact O-CB 3.28Å; A35-A38 PolarHBondContact O-N 3.2Å; A35-Y132 WeakPolarHBondContact CB-OH 3.48Å; A35-R217 PolarHBondContact O-NH1 3.35Å; A35-R217 PolarHBondContact O-NH2 3.25Å; A35-L219 HydrophobicContact CB-CD1 4.37Å; A35-L219 HydrophobicContact CB-CD2 3.23Å; A35-L219 HydrophobicContact CB-CG 4.42Å |
| 36 | L | 38 | Very low | 36 | Very low | 33 Ų | 33 | 50.4 Ų | 50.4 | 17% | 0.173 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -55.8 | -36.9 | -177.7 | -87 | 159.3 | 0 | 0 | 0 | 114.4 | L28 E32 W33 A38 G39 N40 R217 L219 | L28-L36 HydrophobicContact CD1-CD1 3.2Å; L28-L36 HydrophobicContact CD2-CD1 3.29Å; L28-L36 HydrophobicContact CG-CD1 3.82Å; E32-L36 HydrophobicContact CG-CD1 4.4Å; E32-L36 WeakPolarHBondContact O-CB 3.36Å; E32-L36 WeakPolarHBondContact O-CG 3.45Å; E32-L36 PolarHBondContact O-N 3.14Å; W33-L36 PolarHBondContact O-N 3.36Å; L36-A38 VanDerWaalsContact C-N 3.33Å; L36-A38 PolarHBondContact O-N 3.22Å; L36-G39 PolarHBondContact O-N 3.4Å; L36-N40 WeakPolarHBondContact O-CB 3.35Å; L36-N40 PolarHBondContact O-N 2.8Å; L36-R217 PolarHBondContact O-NH2 3.19Å; L36-L219 HydrophobicContact CG-CD1 4.24Å |
| 37 | Q | 34 | Very low | 35.9 | Very low | 26 Ų | 26 | 56.9 Ų | 56.9 | 12% | 0.121 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -60.4 | -36.8 | 173.8 | -112.4 | -174.3 | -17.2 | 0 | 0 | 113.9 | W33 A35 G39 F65 | W33-Q37 HydrophobicContact CH2-CG 3.56Å; W33-Q37 HydrophobicContact CZ2-CG 4.37Å; W33-Q37 HydrophobicContact CZ3-CB 4.47Å; W33-Q37 HydrophobicContact CZ3-CG 3.75Å; W33-Q37 PolarHBondContact O-N 2.63Å; A35-Q37 VanDerWaalsContact C-N 3.26Å; A35-Q37 PolarHBondContact O-N 3.26Å; A35-Q37 VanDerWaalsContact O-N 3.13Å; Q37-G39 PolarHBondContact O-N 3.22Å; Q37-F65 HydrophobicContact CB-CD1 4.33Å; Q37-F65 HydrophobicContact CB-CD2 4.33Å; Q37-F65 HydrophobicContact CB-CE1 3.82Å; Q37-F65 HydrophobicContact CB-CE2 3.8Å; Q37-F65 HydrophobicContact CB-CZ 3.54Å; Q37-F65 HydrophobicContact CG-CE1 3.8Å; Q37-F65 HydrophobicContact CG-CE2 4Å; Q37-F65 HydrophobicContact CG-CZ 3.35Å; Q37-F65 WeakPolarHBondContact O-CD2 3.15Å; Q37-F65 WeakPolarHBondContact O-CE2 3.28Å |
| 38 | A | 34.8 | Very low | 36.2 | Very low | 34 Ų | 34 | 61.4 Ų | 61.4 | 28% | 0.281 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -67.8 | -15.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | A35 L36 | A35-A38 WeakPolarHBondContact O-CB 3.28Å; A35-A38 PolarHBondContact O-N 3.2Å; L36-A38 VanDerWaalsContact C-N 3.33Å; L36-A38 PolarHBondContact O-N 3.22Å |
| 39 | G | 33.1 | Very low | 35.8 | Very low | 35 Ų | 35 | 68.5 Ų | 68.5 | 36% | 0.361 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -122.5 | -9 | -172.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | L36 Q37 R217 | L36-G39 PolarHBondContact O-N 3.4Å; Q37-G39 PolarHBondContact O-N 3.22Å; G39-R217 VanDerWaalsContact CA-NH1 3.34Å |
| 40 | N | 32.6 | Very low | 35.2 | Very low | 117 Ų | 117 | 72 Ų | 72 | 63% | 0.626 | 45% | 0.451 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.3 | 9.8 | -174.4 | -142.2 | 23 | 0 | 0 | 0 | 114 | L36 S42 | L36-N40 WeakPolarHBondContact O-CB 3.35Å; L36-N40 PolarHBondContact O-N 2.8Å; N40-S42 VanDerWaalsContact C-N 3.32Å |
| 41 | F | 32.7 | Very low | 35 | Very low | 144 Ų | 144 | 76.4 Ų | 76.4 | 63% | 0.632 | 48% | 0.482 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.9 | -2.6 | 179.1 | -131.7 | -92.6 | 0 | 0 | 0 | 113.7 | ||
| 42 | S | 32.3 | Very low | 34.3 | Very low | 83 Ų | 83 | 85 Ų | 85 | 58% | 0.58 | 52% | 0.521 | S | S | * | . | S | Bend | trans | -104 | -6.8 | -170.9 | -50.3 | 0 | 0 | 0 | 0 | 115.6 | N40 | N40-S42 VanDerWaalsContact C-N 3.32Š|
| 43 | S | 33.4 | Very low | 33.5 | Very low | 103 Ų | 103 | 89.4 Ų | 89.4 | 72% | 0.72 | 56% | 0.558 | S | S | * | * | S | Bend | trans | -126.5 | 7.3 | -165.2 | -46.9 | 0 | 0 | 0 | 0 | 116 | ||
| 44 | A | 32.1 | Very low | 33.7 | Very low | 85 Ų | 85 | 94.1 Ų | 94.1 | 70% | 0.702 | 59% | 0.592 | S | S | * | * | trans | -117.4 | 84.3 | -177.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 45 | L | 31.7 | Very low | 33.1 | Very low | 165 Ų | 165 | 99.2 Ų | 99.2 | 86% | 0.864 | 63% | 0.629 | S | S | * | * | trans | -178.4 | 78.8 | 147.9 | -94.7 | 161.7 | 0 | 0 | 0 | 108.1 | ||||
| 46 | G | 33.9 | Very low | 33.1 | Very low | 80 Ų | 80 | 108.8 Ų | 108.8 | 83% | 0.825 | 67% | 0.673 | S | S | * | * | trans | -85 | 114.3 | 167.1 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 47 | L | 29.6 | Very low | 32.7 | Very low | 157 Ų | 157 | 111.7 Ų | 111.7 | 82% | 0.822 | 70% | 0.702 | S | S | * | * | trans | -132.9 | 140.1 | 161 | -82.6 | 168.4 | 0 | 0 | 0 | 108.4 | ||||
| 48 | P | 40.5 | Very low | 32.7 | Very low | 112 Ų | 112 | 121.9 Ų | 121.9 | 73% | 0.727 | 74% | 0.739 | S | S | * | * | trans | -96.3 | 140.5 | -173.9 | 35.4 | -29.4 | 0 | 0 | 0 | 111.8 | ||||
| 49 | L | 28 | Very low | 32.6 | Very low | 173 Ų | 173 | 124.6 Ų | 124.6 | 91% | 0.906 | 76% | 0.762 | S | S | * | * | trans | 179.4 | 132.5 | 137.8 | -104.7 | 139.3 | 0 | 0 | 0 | 113.2 | ||||
| 50 | A | 29.5 | Very low | 32.5 | Very low | 90 Ų | 90 | 130 Ų | 130 | 74% | 0.744 | 78% | 0.782 | S | S | * | * | trans | 65.9 | 140.9 | 147.3 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 51 | S | 37.7 | Very low | 32.9 | Very low | 107 Ų | 107 | 130.7 Ų | 130.7 | 75% | 0.748 | 79% | 0.785 | S | S | * | * | trans | -49.9 | 132.5 | 179.6 | 54 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 52 | Q | 26.1 | Very low | 33.1 | Very low | 198 Ų | 198 | 130 Ų | 130 | 93% | 0.925 | 79% | 0.793 | S | S | * | * | trans | 172.8 | 139.4 | 130.8 | -96.5 | 169.3 | 8 | 0 | 0 | 110.2 | ||||
| 53 | A | 27.3 | Very low | 33.7 | Very low | 94 Ų | 94 | 130.7 Ų | 130.7 | 78% | 0.777 | 79% | 0.79 | S | S | * | * | trans | -108.6 | 166.6 | 166.7 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 54 | P | 44.1 | Very low | 34 | Very low | 127 Ų | 127 | 131.2 Ų | 131.2 | 83% | 0.825 | 78% | 0.781 | S | S | * | * | cis | -127.1 | 153.2 | -30.7 | 34.4 | -18.5 | 0 | 0 | 0 | 111.8 | ||||
| 55 | S | 25.6 | Very low | 34.8 | Very low | 119 Ų | 119 | 129.4 Ų | 129.4 | 83% | 0.832 | 76% | 0.758 | S | S | * | * | trans | -148.1 | 129.2 | 155.1 | 57.7 | 0 | 0 | 0 | 0 | 111.9 | A57 | S55-A57 PolarHBondContact O-N 3.29Å; S55-A57 VanDerWaalsContact O-N 3.14Å | ||
| 56 | Q | 38.8 | Very low | 35.6 | Very low | 202 Ų | 202 | 126.6 Ų | 126.6 | 94% | 0.944 | 75% | 0.747 | S | S | * | * | trans | -62.6 | 105.6 | 180 | -71.5 | 171.4 | -26.9 | 0 | 0 | 110.7 | ||||
| 57 | A | 29.5 | Very low | 36.6 | Very low | 94 Ų | 94 | 124.2 Ų | 124.2 | 78% | 0.777 | 72% | 0.715 | S | S | * | * | trans | -110.7 | 99.8 | 159.5 | 0 | 0 | 0 | 0 | 0 | 108.1 | S55 A59 | S55-A57 PolarHBondContact O-N 3.29Å; S55-A57 VanDerWaalsContact O-N 3.14Å; A57-A59 VanDerWaalsContact C-N 3.27Å; A57-A59 PolarHBondContact O-N 3.4Å | ||
| 58 | R | 32.7 | Very low | 38.5 | Very low | 241 Ų | 241 | 119.4 Ų | 119.4 | 91% | 0.909 | 69% | 0.693 | S | S | * | * | trans | -62.1 | 92 | 163.6 | -87.3 | -175.6 | 177.4 | 115.8 | -2.7 | 107.8 | N60 | R58-N60 PolarHBondContact O-N 3.16Š| ||
| 59 | A | 34.2 | Very low | 40.1 | Very low | 91 Ų | 91 | 118.8 Ų | 118.8 | 75% | 0.752 | 69% | 0.691 | S | S | * | * | trans | -69.4 | 108.5 | 165.3 | 0 | 0 | 0 | 0 | 0 | 108.1 | A57 L61 | A57-A59 VanDerWaalsContact C-N 3.27Å; A57-A59 PolarHBondContact O-N 3.4Å; A59-L61 PolarHBondContact O-N 2.93Å | ||
| 60 | N | 31.1 | Very low | 42.6 | Very low | 147 Ų | 147 | 117.8 Ų | 117.8 | 79% | 0.786 | 68% | 0.675 | S | S | * | * | trans | -62 | 97.8 | 167.5 | -83.2 | -26.8 | 0 | 0 | 0 | 109 | R58 T62 | R58-N60 PolarHBondContact O-N 3.16Å; N60-T62 VanDerWaalsContact C-N 3.33Å; N60-T62 PolarHBondContact O-N 2.89Å | ||
| 61 | L | 40.1 | Very low | 45 | Very low | 132 Ų | 132 | 118.1 Ų | 118.1 | 69% | 0.691 | 66% | 0.657 | S | S | * | * | trans | -77.8 | 80.2 | 174.5 | -163.3 | 78.1 | 0 | 0 | 0 | 109.5 | A59 N63 | A59-L61 PolarHBondContact O-N 2.93Å; L61-N63 PolarHBondContact O-N 3.33Å | ||
| 62 | T | 37 | Very low | 46.9 | Very low | 131 Ų | 131 | 115.7 Ų | 115.7 | 80% | 0.804 | 64% | 0.635 | S | S | * | * | trans | -69.5 | 108.5 | 168.9 | 36.7 | 0 | 0 | 0 | 0 | 109.6 | N60 Q64 | N60-T62 VanDerWaalsContact C-N 3.33Å; N60-T62 PolarHBondContact O-N 2.89Å; T62-Q64 PolarHBondContact O-N 2.93Å; T62-Q64 VanDerWaalsContact O-N 3.15Å | ||
| 63 | N | 44.9 | Very low | 49.7 | Very low | 97 Ų | 97 | 109 Ų | 109 | 52% | 0.519 | 62% | 0.615 | S | S | . | * | trans | -49.9 | 113.3 | 174.5 | -85.6 | -60.4 | 0 | 0 | 0 | 111.8 | L61 F65 V66 | L61-N63 PolarHBondContact O-N 3.33Å; N63-F65 PolarHBondContact O-N 3.26Å; N63-F65 VanDerWaalsContact O-N 3.15Å; N63-V66 HydrophobicContact CB-CG2 3.46Å; N63-V66 VanDerWaalsContact CB-CG2 3.46Å; N63-V66 WeakPolarHBondContact O-CG2 3.35Å; N63-V66 PolarHBondContact O-N 3.4Å | ||
| 64 | Q | 40.8 | Very low | 52.6 | Low | 113 Ų | 113 | 109.3 Ų | 109.3 | 53% | 0.528 | 60% | 0.602 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -71.1 | -7 | -176.7 | -170 | 164.5 | -14.1 | 0 | 0 | 114.3 | T62 | T62-Q64 PolarHBondContact O-N 2.93Å; T62-Q64 VanDerWaalsContact O-N 3.15Å |
| 65 | F | 47.8 | Very low | 54.5 | Low | 48 Ų | 48 | 105.8 Ų | 105.8 | 21% | 0.211 | 57% | 0.573 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -105.1 | 9.9 | 175.6 | -67.8 | -79.4 | 0 | 0 | 0 | 113.9 | Q37 N63 Q67 | Q37-F65 HydrophobicContact CB-CD1 4.33Å; Q37-F65 HydrophobicContact CB-CD2 4.33Å; Q37-F65 HydrophobicContact CB-CE1 3.82Å; Q37-F65 HydrophobicContact CB-CE2 3.8Å; Q37-F65 HydrophobicContact CB-CZ 3.54Å; Q37-F65 HydrophobicContact CG-CE1 3.8Å; Q37-F65 HydrophobicContact CG-CE2 4Å; Q37-F65 HydrophobicContact CG-CZ 3.35Å; Q37-F65 WeakPolarHBondContact O-CD2 3.15Å; Q37-F65 WeakPolarHBondContact O-CE2 3.28Å; N63-F65 PolarHBondContact O-N 3.26Å; N63-F65 VanDerWaalsContact O-N 3.15Å; F65-Q67 VanDerWaalsContact C-N 3.3Å; F65-Q67 PolarHBondContact O-N 2.87Å |
| 66 | V | 47.9 | Very low | 57.3 | Low | 105 Ų | 105 | 101.7 Ų | 101.7 | 64% | 0.636 | 54% | 0.544 | S | S | * | . | trans | -67.6 | 95.9 | 171 | 178.7 | 0 | 0 | 0 | 0 | 107.5 | N63 | N63-V66 HydrophobicContact CB-CG2 3.46Å; N63-V66 VanDerWaalsContact CB-CG2 3.46Å; N63-V66 WeakPolarHBondContact O-CG2 3.35Å; N63-V66 PolarHBondContact O-N 3.4Å | ||
| 67 | Q | 55.4 | Low | 59.7 | Low | 31 Ų | 31 | 98.2 Ų | 98.2 | 15% | 0.145 | 53% | 0.531 | C | S | . | . | trans | -56.4 | 134.2 | 166.7 | -79.3 | 177.5 | -77.1 | 0 | 0 | 107.5 | F65 S69 I72 | F65-Q67 VanDerWaalsContact C-N 3.3Å; F65-Q67 PolarHBondContact O-N 2.87Å; Q67-S69 PolarHBondContact O-N 3.09Å; Q67-I72 HydrophobicContact CB-CD1 4.04Å; Q67-I72 HydrophobicContact CB-CG1 3.72Å; Q67-I72 WeakPolarHBondContact O-CD1 3.49Å | ||
| 68 | P | 70.1 | Confident | 62.6 | Low | 55 Ų | 55 | 95 Ų | 95 | 36% | 0.357 | 51% | 0.505 | S | S | . | . | trans | -58.5 | 139.3 | 175.9 | 24.6 | -34.3 | 0 | 0 | 0 | 109.4 | W70 R71 I72 | P68-W70 HydrophobicContact CG-CZ2 4.45Å; P68-W70 PolarHBondContact O-N 2.84Å; P68-R71 HydrophobicContact CG-CB 4.36Å; P68-R71 HydrophobicContact CG-CG 3.87Å; P68-R71 WeakPolarHBondContact O-CB 3.29Å; P68-R71 PolarHBondContact O-N 2.85Å; P68-I72 PolarHBondContact O-N 3.44Å | ||
| 69 | S | 74 | Confident | 65.2 | Low | 100 Ų | 100 | 83.9 Ų | 83.9 | 70% | 0.699 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -54 | -31.7 | -167.8 | -35 | 0 | 0 | 0 | 0 | 113.4 | Q67 R71 I72 A73 | Q67-S69 PolarHBondContact O-N 3.09Å; S69-R71 PolarHBondContact O-N 3.48Å; S69-I72 PolarHBondContact O-N 3.05Å; S69-A73 WeakPolarHBondContact O-CB 3.32Å; S69-A73 PolarHBondContact O-N 3.35Å |
| 70 | W | 80.3 | Confident | 67.9 | Low | 151 Ų | 151 | 81.2 Ų | 81.2 | 57% | 0.572 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -65 | -35.2 | 175.8 | 69.9 | -97.3 | 0 | 0 | 0 | 113.3 | P68 A73 L74 | P68-W70 HydrophobicContact CG-CZ2 4.45Å; P68-W70 PolarHBondContact O-N 2.84Å; W70-A73 PolarHBondContact O-N 3.4Å; W70-L74 HydrophobicContact CE3-CD1 3.55Å; W70-L74 HydrophobicContact CE3-CG 4.43Å; W70-L74 HydrophobicContact CZ3-CD1 3.59Å; W70-L74 WeakPolarHBondContact O-CG 3.28Å; W70-L74 PolarHBondContact O-N 3.32Å |
| 71 | R | 79.6 | Confident | 70.7 | Confident | 97 Ų | 97 | 79.1 Ų | 79.1 | 37% | 0.366 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -69.6 | -39.7 | 175.9 | -71.9 | -176.4 | -174.3 | -128.9 | 0.5 | 111.3 | P68 S69 A73 L74 W75 | P68-R71 HydrophobicContact CG-CB 4.36Å; P68-R71 HydrophobicContact CG-CG 3.87Å; P68-R71 WeakPolarHBondContact O-CB 3.29Å; P68-R71 PolarHBondContact O-N 2.85Å; S69-R71 PolarHBondContact O-N 3.48Å; R71-A73 VanDerWaalsContact C-N 3.34Å; R71-L74 PolarHBondContact O-N 3.4Å; R71-W75 VanDerWaalsContact O-CD1 3.25Å; R71-W75 PolarHBondContact O-N 3.13Å |
| 72 | I | 78.4 | Confident | 73.2 | Confident | 56 Ų | 56 | 72.9 Ų | 72.9 | 29% | 0.287 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -62.7 | -46.1 | 175.7 | -59.7 | 177 | 0 | 0 | 0 | 109.1 | Q67 P68 S69 L74 W75 S76 L134 | Q67-I72 HydrophobicContact CB-CD1 4.04Å; Q67-I72 HydrophobicContact CB-CG1 3.72Å; Q67-I72 WeakPolarHBondContact O-CD1 3.49Å; P68-I72 PolarHBondContact O-N 3.44Å; S69-I72 PolarHBondContact O-N 3.05Å; I72-L74 PolarHBondContact O-N 3.45Å; I72-W75 PolarHBondContact O-N 2.96Å; I72-S76 VanDerWaalsContact O-CB 3.29Å; I72-S76 WeakPolarHBondContact O-CB 3.46Å; I72-S76 PolarHBondContact O-N 2.94Å; I72-S76 PolarHBondContact O-OG 3.28Å; I72-L134 HydrophobicContact CG2-CD2 3.31Å |
| 73 | A | 83.9 | Confident | 75.9 | Confident | 59 Ų | 59 | 67.8 Ų | 67.8 | 49% | 0.488 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -59.7 | -43 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | S69 W70 R71 S76 L77 | S69-A73 WeakPolarHBondContact O-CB 3.32Å; S69-A73 PolarHBondContact O-N 3.35Å; W70-A73 PolarHBondContact O-N 3.4Å; R71-A73 VanDerWaalsContact C-N 3.34Å; A73-S76 WeakPolarHBondContact O-CB 3.41Å; A73-S76 PolarHBondContact O-N 2.97Å; A73-L77 PolarHBondContact O-N 3.36Å |
| 74 | L | 87.7 | Confident | 78.2 | Confident | 99 Ų | 99 | 65 Ų | 65 | 52% | 0.518 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -63.4 | -47.4 | 176.2 | -74.4 | 176.8 | 0 | 0 | 0 | 112.5 | W70 R71 I72 S76 L77 A78 | W70-L74 HydrophobicContact CE3-CD1 3.55Å; W70-L74 HydrophobicContact CE3-CG 4.43Å; W70-L74 HydrophobicContact CZ3-CD1 3.59Å; W70-L74 WeakPolarHBondContact O-CG 3.28Å; W70-L74 PolarHBondContact O-N 3.32Å; R71-L74 PolarHBondContact O-N 3.4Å; I72-L74 PolarHBondContact O-N 3.45Å; L74-S76 VanDerWaalsContact C-N 3.25Å; L74-S76 PolarHBondContact O-N 2.55Å; L74-L77 PolarHBondContact O-N 2.89Å; L74-A78 WeakPolarHBondContact O-CB 3.49Å; L74-A78 PolarHBondContact O-N 3.15Å |
| 75 | W | 84.3 | Confident | 80.7 | Confident | 54 Ų | 54 | 61.9 Ų | 61.9 | 21% | 0.205 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -62.6 | -37.4 | 175.4 | -80.5 | 119.6 | 0 | 0 | 0 | 111.3 | R71 I72 A78 Y79 L326 A327 W330 | R71-W75 VanDerWaalsContact O-CD1 3.25Å; R71-W75 PolarHBondContact O-N 3.13Å; I72-W75 PolarHBondContact O-N 2.96Å; W75-A78 HydrophobicContact CE3-CB 4.49Å; W75-A78 PolarHBondContact O-N 3.24Å; W75-Y79 HydrophobicContact CD2-CE2 4.39Å; W75-Y79 AromaticContact CE3-CD2 3.91Å; W75-Y79 HydrophobicContact CE3-CD2 3.91Å; W75-Y79 AromaticContact CE3-CE2 3.52Å; W75-Y79 HydrophobicContact CE3-CE2 3.52Å; W75-Y79 AromaticContact CZ3-CE2 3.99Å; W75-Y79 HydrophobicContact CZ3-CE2 3.99Å; W75-Y79 WeakPolarHBondContact O-CD2 3.32Å; W75-Y79 PolarHBondContact O-N 3.13Å; W75-L326 HydrophobicContact CD2-CB 4.44Å; W75-L326 HydrophobicContact CH2-CB 4.3Å; W75-L326 HydrophobicContact CZ2-CB 3.98Å; W75-A327 HydrophobicContact CH2-CB 3.85Å; W75-A327 HydrophobicContact CZ2-CB 4.34Å; W75-W330 HydrophobicContact CH2-CB 4.49Å; W75-W330 HydrophobicContact CZ3-CB 3.71Å; W75-W330 AromaticContact CZ3-CG 3.89Å; W75-W330 HydrophobicContact CZ3-CG 3.89Å |
| 76 | S | 84.9 | Confident | 82.9 | Confident | 33 Ų | 33 | 59.6 Ų | 59.6 | 23% | 0.231 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -60.2 | -47.3 | 176.1 | -57.4 | 0 | 0 | 0 | 0 | 112.5 | I72 A73 L74 G80 F130 | I72-S76 VanDerWaalsContact O-CB 3.29Å; I72-S76 WeakPolarHBondContact O-CB 3.46Å; I72-S76 PolarHBondContact O-N 2.94Å; I72-S76 PolarHBondContact O-OG 3.28Å; A73-S76 WeakPolarHBondContact O-CB 3.41Å; A73-S76 PolarHBondContact O-N 2.97Å; L74-S76 VanDerWaalsContact C-N 3.25Å; L74-S76 PolarHBondContact O-N 2.55Å; S76-G80 WeakPolarHBondContact O-CA 3.27Å; S76-G80 PolarHBondContact O-N 2.93Å; S76-F130 VanDerWaalsContact CB-CZ 3.44Å; S76-F130 VanDerWaalsContact OG-CZ 3.28Å; S76-F130 WeakPolarHBondContact OG-CZ 3.29Å |
| 77 | L | 89.4 | Confident | 85.1 | Confident | 129 Ų | 129 | 55.9 Ų | 55.9 | 68% | 0.675 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -63.8 | -43 | 175.7 | -175.5 | 63.9 | 0 | 0 | 0 | 111.3 | A73 L74 L81 | A73-L77 PolarHBondContact O-N 3.36Å; L74-L77 PolarHBondContact O-N 2.89Å; L77-L81 VanDerWaalsContact O-CB 3.3Å; L77-L81 WeakPolarHBondContact O-CB 3.41Å; L77-L81 PolarHBondContact O-N 3.3Å |
| 78 | A | 90.4 | Very high | 87 | Confident | 27 Ų | 27 | 61 Ų | 61 | 22% | 0.223 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -66.3 | -46.1 | -177.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | L74 W75 V82 W330 | L74-A78 WeakPolarHBondContact O-CB 3.49Å; L74-A78 PolarHBondContact O-N 3.15Å; W75-A78 HydrophobicContact CE3-CB 4.49Å; W75-A78 PolarHBondContact O-N 3.24Å; A78-V82 WeakPolarHBondContact O-CG2 3.36Å; A78-V82 PolarHBondContact O-N 2.97Å; A78-W330 PolarHBondContact O-NE1 3.4Å; A78-W330 VanDerWaalsContact O-NE1 3.09Å |
| 79 | Y | 87.6 | Confident | 88.1 | Confident | 7 Ų | 7 | 58.9 Ų | 58.9 | 3% | 0.027 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -71 | -39.3 | 175.7 | -84.5 | -87.1 | 0 | 0 | 0 | 111.7 | W75 L81 V82 V83 T126 F130 L326 F329 W330 | W75-Y79 HydrophobicContact CD2-CE2 4.39Å; W75-Y79 AromaticContact CE3-CD2 3.91Å; W75-Y79 HydrophobicContact CE3-CD2 3.91Å; W75-Y79 AromaticContact CE3-CE2 3.52Å; W75-Y79 HydrophobicContact CE3-CE2 3.52Å; W75-Y79 AromaticContact CZ3-CE2 3.99Å; W75-Y79 HydrophobicContact CZ3-CE2 3.99Å; W75-Y79 WeakPolarHBondContact O-CD2 3.32Å; W75-Y79 PolarHBondContact O-N 3.13Å; Y79-L81 VanDerWaalsContact C-N 3.32Å; Y79-L81 PolarHBondContact O-N 3.36Å; Y79-V82 PolarHBondContact O-N 3.02Å; Y79-V83 WeakPolarHBondContact O-CG2 3.5Å; Y79-V83 PolarHBondContact O-N 3.22Å; Y79-T126 HydrophobicContact CD1-CG2 3.8Å; Y79-T126 HydrophobicContact CE1-CG2 4.42Å; Y79-F130 HydrophobicContact CD2-CD2 4.42Å; Y79-F130 HydrophobicContact CG-CD2 4.2Å; Y79-L326 PolarHBondContact OH-O 3.33Å; Y79-F329 AromaticContact CE1-CD1 3.73Å; Y79-F329 HydrophobicContact CE1-CD1 3.73Å; Y79-F329 AromaticContact CE1-CE1 3.91Å; Y79-F329 HydrophobicContact CE1-CE1 3.91Å; Y79-F329 AromaticContact CZ-CD1 3.89Å; Y79-F329 VanDerWaalsContact OH-CD1 3.23Å; Y79-F329 WeakPolarHBondContact OH-CD1 3.32Å; Y79-W330 AromaticContact CD2-CD1 3.88Å; Y79-W330 HydrophobicContact CE1-CB 4.21Å; Y79-W330 HydrophobicContact CE2-CB 3.88Å; Y79-W330 AromaticContact CE2-CD1 3.9Å; Y79-W330 HydrophobicContact CE2-CG 4.28Å; Y79-W330 WeakPolarHBondContact OH-CA 3.43Å; Y79-W330 WeakPolarHBondContact OH-CB 3.23Å; Y79-W330 PolarHBondContact OH-N 3.45Å |
| 80 | G | 89.6 | Confident | 89.1 | Confident | 35 Ų | 35 | 54.2 Ų | 54.2 | 36% | 0.361 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -59.4 | -42 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | S76 V83 A84 | S76-G80 WeakPolarHBondContact O-CA 3.27Å; S76-G80 PolarHBondContact O-N 2.93Å; G80-V83 PolarHBondContact O-N 2.81Å; G80-A84 WeakPolarHBondContact O-CB 3.32Å; G80-A84 PolarHBondContact O-N 3.39Å |
| 81 | L | 91.6 | Very high | 89.8 | Confident | 103 Ų | 103 | 51.3 Ų | 51.3 | 54% | 0.539 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -62.7 | -45 | 175.1 | -177.9 | 65.3 | 0 | 0 | 0 | 111.8 | L77 Y79 V83 A84 V85 | L77-L81 VanDerWaalsContact O-CB 3.3Å; L77-L81 WeakPolarHBondContact O-CB 3.41Å; L77-L81 PolarHBondContact O-N 3.3Å; Y79-L81 VanDerWaalsContact C-N 3.32Å; Y79-L81 PolarHBondContact O-N 3.36Å; L81-V83 PolarHBondContact O-N 2.88Å; L81-A84 PolarHBondContact O-N 3.48Å; L81-V85 HydrophobicContact CD1-CG2 3.9Å; L81-V85 HydrophobicContact CG-CG2 4.32Å; L81-V85 WeakPolarHBondContact O-CB 3.2Å; L81-V85 VanDerWaalsContact O-CG2 3.32Å; L81-V85 WeakPolarHBondContact O-CG2 3.36Å; L81-V85 PolarHBondContact O-N 2.91Å |
| 82 | V | 91.9 | Very high | 90.5 | Very high | 1 Ų | 1 | 48 Ų | 48 | 1% | 0.006 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -59.1 | -48.9 | 177 | 170.1 | 0 | 0 | 0 | 0 | 110.6 | A78 Y79 A84 A86 W330 M333 M337 | A78-V82 WeakPolarHBondContact O-CG2 3.36Å; A78-V82 PolarHBondContact O-N 2.97Å; Y79-V82 PolarHBondContact O-N 3.02Å; V82-A84 PolarHBondContact O-N 3.47Å; V82-A86 WeakPolarHBondContact O-CB 3.3Å; V82-A86 PolarHBondContact O-N 2.91Å; V82-W330 HydrophobicContact CG2-CZ2 4.27Å; V82-M333 HydrophobicContact CG1-CB 4.3Å; V82-M337 HydrophobicContact CG2-CE 3.96Å; V82-M337 HydrophobicContact CG2-SD 4.19Å |
| 83 | V | 92.5 | Very high | 91.2 | Very high | 23 Ų | 23 | 45.3 Ų | 45.3 | 14% | 0.139 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -60.5 | -47.6 | 179.1 | 174.3 | 0 | 0 | 0 | 0 | 110.9 | Y79 G80 L81 V87 T126 | Y79-V83 WeakPolarHBondContact O-CG2 3.5Å; Y79-V83 PolarHBondContact O-N 3.22Å; G80-V83 PolarHBondContact O-N 2.81Å; L81-V83 PolarHBondContact O-N 2.88Å; V83-V87 HydrophobicContact CG1-CG2 4.21Å; V83-V87 VanDerWaalsContact O-CB 3.31Å; V83-V87 WeakPolarHBondContact O-CB 3.42Å; V83-V87 VanDerWaalsContact O-CG2 3.24Å; V83-V87 WeakPolarHBondContact O-CG2 3.4Å; V83-V87 PolarHBondContact O-N 3.37Å; V83-T126 HydrophobicContact CG2-CG2 3.5Å; V83-T126 VanDerWaalsContact CG2-CG2 3.5Å |
| 84 | A | 93.3 | Very high | 91.6 | Very high | 39 Ų | 39 | 43.8 Ų | 43.8 | 32% | 0.322 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -59.8 | -54.4 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | G80 L81 V82 A86 V87 F88 | G80-A84 WeakPolarHBondContact O-CB 3.32Å; G80-A84 PolarHBondContact O-N 3.39Å; L81-A84 PolarHBondContact O-N 3.48Å; V82-A84 PolarHBondContact O-N 3.47Å; A84-A86 PolarHBondContact O-N 3.48Å; A84-V87 PolarHBondContact O-N 2.91Å; A84-F88 HydrophobicContact CB-CD2 4.33Å; A84-F88 HydrophobicContact CB-CE2 4.47Å; A84-F88 WeakPolarHBondContact O-CB 3.23Å; A84-F88 WeakPolarHBondContact O-CD2 3.27Å; A84-F88 PolarHBondContact O-N 3.29Å |
| 85 | V | 94.2 | Very high | 91.9 | Very high | 47 Ų | 47 | 44.6 Ų | 44.6 | 29% | 0.285 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -65.2 | -41.8 | -177.2 | -180 | 0 | 0 | 0 | 0 | 111.2 | L81 G89 M337 I341 | L81-V85 HydrophobicContact CD1-CG2 3.9Å; L81-V85 HydrophobicContact CG-CG2 4.32Å; L81-V85 WeakPolarHBondContact O-CB 3.2Å; L81-V85 VanDerWaalsContact O-CG2 3.32Å; L81-V85 WeakPolarHBondContact O-CG2 3.36Å; L81-V85 PolarHBondContact O-N 2.91Å; V85-G89 VanDerWaalsContact O-CA 3.29Å; V85-G89 WeakPolarHBondContact O-CA 3.42Å; V85-G89 PolarHBondContact O-N 3.22Å; V85-M337 HydrophobicContact CB-CB 4.04Å; V85-M337 HydrophobicContact CG1-CB 3.78Å; V85-I341 HydrophobicContact CG1-CD1 4.34Å |
| 86 | A | 94.1 | Very high | 92.1 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -65.3 | -46.9 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | V82 A84 N90 A122 T336 M337 | V82-A86 WeakPolarHBondContact O-CB 3.3Å; V82-A86 PolarHBondContact O-N 2.91Å; A84-A86 PolarHBondContact O-N 3.48Å; A86-N90 VanDerWaalsContact O-CB 3.22Å; A86-N90 WeakPolarHBondContact O-CB 3.15Å; A86-N90 PolarHBondContact O-N 3.43Å; A86-N90 VanDerWaalsContact O-N 3.11Å; A86-N90 PolarHBondContact O-ND2 2.93Å; A86-A122 HydrophobicContact CB-CB 3.63Å; A86-T336 VanDerWaalsContact CB-OG1 3.3Å; A86-T336 WeakPolarHBondContact CB-OG1 3.37Å; A86-M337 HydrophobicContact CB-CB 4.28Å |
| 87 | V | 94.9 | Very high | 92.3 | Very high | 28 Ų | 28 | 40.6 Ų | 40.6 | 17% | 0.17 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -68 | -56.5 | -179.4 | 174.6 | 0 | 0 | 0 | 0 | 110.4 | V83 A84 G89 L91 A122 A123 | V83-V87 HydrophobicContact CG1-CG2 4.21Å; V83-V87 VanDerWaalsContact O-CB 3.31Å; V83-V87 WeakPolarHBondContact O-CB 3.42Å; V83-V87 VanDerWaalsContact O-CG2 3.24Å; V83-V87 WeakPolarHBondContact O-CG2 3.4Å; V83-V87 PolarHBondContact O-N 3.37Å; A84-V87 PolarHBondContact O-N 2.91Å; V87-G89 PolarHBondContact O-N 3.09Å; V87-L91 HydrophobicContact CG1-CD1 3.77Å; V87-L91 HydrophobicContact CG1-CG 4.43Å; V87-L91 WeakPolarHBondContact O-CB 3.45Å; V87-L91 WeakPolarHBondContact O-CG 3.38Å; V87-L91 PolarHBondContact O-N 3.42Å; V87-A122 HydrophobicContact CG2-CB 3.96Å; V87-A123 HydrophobicContact CG2-CB 4Å |
| 88 | F | 94.2 | Very high | 92.3 | Very high | 139 Ų | 139 | 38.5 Ų | 38.5 | 61% | 0.61 | 21% | 0.211 | S | C | * | . | H | α-helix | trans | -64.3 | -43.6 | -177.6 | -69.2 | -65.6 | 0 | 0 | 0 | 112 | A84 L91 I92 | A84-F88 HydrophobicContact CB-CD2 4.33Å; A84-F88 HydrophobicContact CB-CE2 4.47Å; A84-F88 WeakPolarHBondContact O-CB 3.23Å; A84-F88 WeakPolarHBondContact O-CD2 3.27Å; A84-F88 PolarHBondContact O-N 3.29Å; F88-L91 PolarHBondContact O-N 3.27Å; F88-I92 WeakPolarHBondContact O-CD1 3.23Å; F88-I92 WeakPolarHBondContact O-CG1 3.5Å; F88-I92 PolarHBondContact O-N 3.13Å |
| 89 | G | 93.6 | Very high | 92.1 | Very high | 10 Ų | 10 | 39.8 Ų | 39.8 | 10% | 0.103 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -61.2 | -48.3 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | V85 V87 I92 V93 P340 | V85-G89 VanDerWaalsContact O-CA 3.29Å; V85-G89 WeakPolarHBondContact O-CA 3.42Å; V85-G89 PolarHBondContact O-N 3.22Å; V87-G89 PolarHBondContact O-N 3.09Å; G89-I92 PolarHBondContact O-N 2.99Å; G89-V93 WeakPolarHBondContact O-CG2 3.14Å; G89-V93 PolarHBondContact O-N 3.44Å; G89-P340 VanDerWaalsContact C-CG 3.43Å |
| 90 | N | 95.3 | Very high | 91.9 | Very high | 1 Ų | 1 | 40.6 Ų | 40.6 | 1% | 0.005 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -72.3 | -33.8 | -179.6 | -74.5 | -65.3 | 0 | 0 | 0 | 112.6 | A86 I92 V93 I94 A115 A119 T336 P340 | A86-N90 VanDerWaalsContact O-CB 3.22Å; A86-N90 WeakPolarHBondContact O-CB 3.15Å; A86-N90 PolarHBondContact O-N 3.43Å; A86-N90 VanDerWaalsContact O-N 3.11Å; A86-N90 PolarHBondContact O-ND2 2.93Å; N90-I92 VanDerWaalsContact C-N 3.33Å; N90-I92 PolarHBondContact O-N 3.4Å; N90-V93 WeakPolarHBondContact O-CB 3.13Å; N90-V93 PolarHBondContact O-N 3.2Å; N90-I94 WeakPolarHBondContact O-CG1 3.18Å; N90-I94 PolarHBondContact O-N 2.96Å; N90-A115 HydrophobicContact CB-CB 3.97Å; N90-A115 WeakPolarHBondContact CB-O 3.49Å; N90-A119 HydrophobicContact CB-CB 3.88Å; N90-T336 PolarHBondContact ND2-O 2.84Å; N90-P340 HydrophobicContact CB-CG 4.39Å; N90-P340 WeakPolarHBondContact OD1-CG 3.45Å |
| 91 | L | 95.2 | Very high | 91.4 | Very high | 90 Ų | 90 | 47.1 Ų | 47.1 | 47% | 0.471 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -62 | -40.4 | 171.5 | -72.2 | 175.8 | 0 | 0 | 0 | 112 | V87 F88 I94 W95 | V87-L91 HydrophobicContact CG1-CD1 3.77Å; V87-L91 HydrophobicContact CG1-CG 4.43Å; V87-L91 WeakPolarHBondContact O-CB 3.45Å; V87-L91 WeakPolarHBondContact O-CG 3.38Å; V87-L91 PolarHBondContact O-N 3.42Å; F88-L91 PolarHBondContact O-N 3.27Å; L91-I94 HydrophobicContact CD2-CD1 4.46Å; L91-I94 PolarHBondContact O-N 3.05Å; L91-W95 WeakPolarHBondContact O-CB 3.43Å; L91-W95 PolarHBondContact O-N 3.26Å |
| 92 | I | 92.9 | Very high | 90.8 | Very high | 28 Ų | 28 | 47.3 Ų | 47.3 | 14% | 0.144 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -63.7 | -41.7 | 174.1 | -67.3 | 163.2 | 0 | 0 | 0 | 110.6 | F88 G89 N90 I94 W95 I96 F354 A357 F358 | F88-I92 WeakPolarHBondContact O-CD1 3.23Å; F88-I92 WeakPolarHBondContact O-CG1 3.5Å; F88-I92 PolarHBondContact O-N 3.13Å; G89-I92 PolarHBondContact O-N 2.99Å; N90-I92 VanDerWaalsContact C-N 3.33Å; N90-I92 PolarHBondContact O-N 3.4Å; I92-I94 PolarHBondContact O-N 2.88Å; I92-W95 PolarHBondContact O-N 3.33Å; I92-I96 HydrophobicContact CG2-CD1 3.66Å; I92-I96 HydrophobicContact CG2-CG1 4.15Å; I92-I96 VanDerWaalsContact O-CG1 3.25Å; I92-I96 WeakPolarHBondContact O-CG1 3.12Å; I92-I96 PolarHBondContact O-N 3.49Å; I92-F354 HydrophobicContact CB-CD1 4.45Å; I92-F354 HydrophobicContact CB-CE1 3.94Å; I92-F354 HydrophobicContact CD1-CE1 4.47Å; I92-F354 HydrophobicContact CG2-CD1 3.54Å; I92-F354 HydrophobicContact CG2-CE1 3.41Å; I92-F354 VanDerWaalsContact CG2-CE1 3.41Å; I92-F354 HydrophobicContact CG2-CG 4.38Å; I92-F354 HydrophobicContact CG2-CZ 4.16Å; I92-A357 HydrophobicContact CG2-CB 3.86Å; I92-F358 HydrophobicContact CD1-CE1 4.31Å; I92-F358 HydrophobicContact CD1-CE2 3.83Å; I92-F358 HydrophobicContact CD1-CZ 3.51Å |
| 93 | V | 93 | Very high | 90.3 | Very high | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -58 | -47.2 | 175.2 | 170.6 | 0 | 0 | 0 | 0 | 111.1 | G89 N90 W95 I96 I97 A115 P340 Y343 F350 F354 | G89-V93 WeakPolarHBondContact O-CG2 3.14Å; G89-V93 PolarHBondContact O-N 3.44Å; N90-V93 WeakPolarHBondContact O-CB 3.13Å; N90-V93 PolarHBondContact O-N 3.2Å; V93-W95 PolarHBondContact O-N 3Å; V93-I96 PolarHBondContact O-N 2.94Å; V93-I97 HydrophobicContact CG1-CD1 3.92Å; V93-I97 WeakPolarHBondContact O-CG1 2.83Å; V93-I97 PolarHBondContact O-N 2.99Å; V93-A115 HydrophobicContact CB-CB 4.24Å; V93-A115 HydrophobicContact CG1-CB 3.97Å; V93-P340 HydrophobicContact CG2-CB 3.98Å; V93-P340 HydrophobicContact CG2-CG 4.16Å; V93-Y343 HydrophobicContact CG1-CD2 4.41Å; V93-Y343 HydrophobicContact CG2-CD2 4.2Å; V93-F350 HydrophobicContact CG1-CE1 4.17Å; V93-F354 HydrophobicContact CG2-CE2 4.35Å; V93-F354 HydrophobicContact CG2-CZ 3.81Å |
| 94 | I | 94.1 | Very high | 89.9 | Confident | 26 Ų | 26 | 51.7 Ų | 51.7 | 13% | 0.133 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -58.7 | -49.2 | 176.4 | -67 | 162 | 0 | 0 | 0 | 110.1 | N90 L91 I92 I96 I97 L98 V112 A115 F116 | N90-I94 WeakPolarHBondContact O-CG1 3.18Å; N90-I94 PolarHBondContact O-N 2.96Å; L91-I94 HydrophobicContact CD2-CD1 4.46Å; L91-I94 PolarHBondContact O-N 3.05Å; I92-I94 PolarHBondContact O-N 2.88Å; I94-I96 PolarHBondContact O-N 3.37Å; I94-I97 PolarHBondContact O-N 2.87Å; I94-L98 HydrophobicContact CG2-CD1 3.6Å; I94-L98 HydrophobicContact CG2-CG 4.18Å; I94-L98 WeakPolarHBondContact O-CB 3.34Å; I94-L98 WeakPolarHBondContact O-CG 3.33Å; I94-L98 PolarHBondContact O-N 2.85Å; I94-V112 HydrophobicContact CG1-CG1 4.44Å; I94-A115 HydrophobicContact CD1-CB 4.16Å; I94-A115 HydrophobicContact CG1-CB 3.74Å; I94-F116 HydrophobicContact CD1-CB 4.25Å |
| 95 | W | 92.3 | Very high | 89.5 | Confident | 117 Ų | 117 | 52.9 Ų | 52.9 | 44% | 0.443 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -59.5 | -47.1 | 179.7 | 177 | 79.5 | 0 | 0 | 0 | 112.4 | L91 I92 V93 I97 L98 A99 R356 A357 | L91-W95 WeakPolarHBondContact O-CB 3.43Å; L91-W95 PolarHBondContact O-N 3.26Å; I92-W95 PolarHBondContact O-N 3.33Å; V93-W95 PolarHBondContact O-N 3Å; W95-I97 VanDerWaalsContact C-N 3.3Å; W95-I97 PolarHBondContact O-N 2.73Å; W95-L98 PolarHBondContact O-N 2.88Å; W95-A99 WeakPolarHBondContact O-CB 3.39Å; W95-A99 PolarHBondContact O-N 2.88Å; W95-R356 HydrophobicContact CH2-CG 4.38Å; W95-A357 HydrophobicContact CE3-CB 4.32Å; W95-A357 HydrophobicContact CZ3-CB 3.87Å |
| 96 | I | 89.2 | Confident | 89.1 | Confident | 0 Ų | 0 | 51.9 Ų | 51.9 | 0% | 0 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -56.7 | -44.5 | 178.7 | -70.3 | 166.7 | 0 | 0 | 0 | 110.7 | I92 V93 I94 H100 F350 F354 | I92-I96 HydrophobicContact CG2-CD1 3.66Å; I92-I96 HydrophobicContact CG2-CG1 4.15Å; I92-I96 VanDerWaalsContact O-CG1 3.25Å; I92-I96 WeakPolarHBondContact O-CG1 3.12Å; I92-I96 PolarHBondContact O-N 3.49Å; V93-I96 PolarHBondContact O-N 2.94Å; I94-I96 PolarHBondContact O-N 3.37Å; I96-H100 WeakPolarHBondContact O-CB 3.46Å; I96-H100 PolarHBondContact O-CD2 3.33Å; I96-H100 VanDerWaalsContact O-CD2 3.24Å; I96-H100 PolarHBondContact O-N 3.48Å; I96-F350 HydrophobicContact CD1-CD1 4.44Å; I96-F350 HydrophobicContact CG2-CD1 4.11Å; I96-F350 HydrophobicContact CG2-CE1 4.29Å; I96-F354 HydrophobicContact CD1-CD1 4.44Å; I96-F354 HydrophobicContact CD1-CD2 3.93Å; I96-F354 HydrophobicContact CD1-CE2 4.09Å; I96-F354 HydrophobicContact CD1-CG 4.1Å; I96-F354 HydrophobicContact CD1-CZ 4.43Å |
| 97 | I | 90.2 | Very high | 88.7 | Confident | 2 Ų | 2 | 52.1 Ų | 52.1 | 1% | 0.01 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -73.1 | -42.4 | -176.9 | -62.1 | 166.4 | 0 | 0 | 0 | 111 | V93 I94 W95 N108 L111 V112 F350 | V93-I97 HydrophobicContact CG1-CD1 3.92Å; V93-I97 WeakPolarHBondContact O-CG1 2.83Å; V93-I97 PolarHBondContact O-N 2.99Å; I94-I97 PolarHBondContact O-N 2.87Å; W95-I97 VanDerWaalsContact C-N 3.3Å; W95-I97 PolarHBondContact O-N 2.73Å; I97-N108 HydrophobicContact CD1-CB 4.33Å; I97-N108 HydrophobicContact CG2-CB 3.98Å; I97-L111 HydrophobicContact CD1-CB 3.92Å; I97-V112 HydrophobicContact CB-CG2 3.71Å; I97-V112 HydrophobicContact CD1-CG2 3.61Å; I97-V112 HydrophobicContact CG1-CG2 4.27Å; I97-V112 HydrophobicContact CG2-CG2 3.55Å; I97-F350 HydrophobicContact CD1-CE1 3.94Å; I97-F350 HydrophobicContact CD1-CZ 3.85Å; I97-F350 HydrophobicContact CG1-CE1 3.81Å; I97-F350 HydrophobicContact CG1-CZ 3.89Å |
| 98 | L | 88.7 | Confident | 88.4 | Confident | 85 Ų | 85 | 51.5 Ų | 51.5 | 45% | 0.445 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -73.6 | -38.4 | -177.5 | -66.7 | -177 | 0 | 0 | 0 | 112.5 | I94 W95 H100 R104 | I94-L98 HydrophobicContact CG2-CD1 3.6Å; I94-L98 HydrophobicContact CG2-CG 4.18Å; I94-L98 WeakPolarHBondContact O-CB 3.34Å; I94-L98 WeakPolarHBondContact O-CG 3.33Å; I94-L98 PolarHBondContact O-N 2.85Å; W95-L98 PolarHBondContact O-N 2.88Å; L98-H100 VanDerWaalsContact C-N 3.34Å; L98-H100 PolarHBondContact O-N 2.94Å; L98-R104 PolarHBondContact O-NE 3.26Å; L98-R104 PolarHBondContact O-NH2 3.35Å |
| 99 | A | 85.1 | Confident | 88.3 | Confident | 55 Ų | 55 | 48 Ų | 48 | 46% | 0.455 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -68.2 | -32.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | W95 | W95-A99 WeakPolarHBondContact O-CB 3.39Å; W95-A99 PolarHBondContact O-N 2.88Å |
| 100 | H | 83.8 | Confident | 88.3 | Confident | 23 Ų | 23 | 47.5 Ų | 47.5 | 11% | 0.106 | 23% | 0.225 | C | C | . | . | trans | -105.4 | 103.8 | -175 | -67.3 | -80.4 | 0 | 0 | 0 | 112.5 | I96 L98 R102 M103 | I96-H100 WeakPolarHBondContact O-CB 3.46Å; I96-H100 PolarHBondContact O-CD2 3.33Å; I96-H100 VanDerWaalsContact O-CD2 3.24Å; I96-H100 PolarHBondContact O-N 3.48Å; L98-H100 VanDerWaalsContact C-N 3.34Å; L98-H100 PolarHBondContact O-N 2.94Å; H100-R102 PolarHBondContact O-N 2.78Å; H100-R102 VanDerWaalsContact O-N 3.08Å; H100-M103 HydrophobicContact CB-CB 4.26Å; H100-M103 HydrophobicContact CB-CG 4.02Å; H100-M103 WeakPolarHBondContact O-CB 3.31Å; H100-M103 PolarHBondContact O-N 2.88Å | ||
| 101 | K | 80.4 | Confident | 88.1 | Confident | 173 Ų | 173 | 47.9 Ų | 47.9 | 75% | 0.752 | 23% | 0.227 | S | C | * | . | G | 310 helix | trans | -51 | -37.3 | 180 | -67 | -175.2 | -179.1 | 179.8 | 0 | 113.7 | M103 R104 | K101-M103 PolarHBondContact O-N 2.88Å; K101-R104 WeakPolarHBondContact O-CB 3.33Å; K101-R104 PolarHBondContact O-N 3.44Å; K101-R104 VanDerWaalsContact O-N 3.14Å |
| 102 | R | 78.5 | Confident | 88.1 | Confident | 106 Ų | 106 | 44.9 Ų | 44.9 | 40% | 0.4 | 21% | 0.213 | S | C | . | . | G | 310 helix | trans | -63.7 | -26.6 | 178.6 | -168.7 | -174.4 | -172.3 | -176.5 | 12.2 | 113.5 | H100 R104 E373 T376 | H100-R102 PolarHBondContact O-N 2.78Å; H100-R102 VanDerWaalsContact O-N 3.08Å; R102-R104 VanDerWaalsContact C-N 3.31Å; R102-E373 PolarHBondContact NH1-O 3.49Å; R102-T376 VanDerWaalsContact NH1-CB 3.27Å; R102-T376 PolarHBondContact NH1-OG1 3.08Å; R102-T376 VanDerWaalsContact NH1-OG1 3.1Å |
| 103 | M | 80.2 | Confident | 88.2 | Confident | 9 Ų | 9 | 44.2 Ų | 44.2 | 4% | 0.044 | 21% | 0.209 | C | C | . | . | G | 310 helix | trans | -86.3 | 0.3 | 179.1 | -65.3 | -69.3 | -76.2 | 0 | 0 | 112.1 | H100 K101 T105 N108 R349 F350 | H100-M103 HydrophobicContact CB-CB 4.26Å; H100-M103 HydrophobicContact CB-CG 4.02Å; H100-M103 WeakPolarHBondContact O-CB 3.31Å; H100-M103 PolarHBondContact O-N 2.88Å; K101-M103 PolarHBondContact O-N 2.88Å; M103-T105 PolarHBondContact O-N 2.9Å; M103-N108 WeakPolarHBondContact O-CB 3.49Å; M103-N108 PolarHBondContact O-ND2 2.99Å; M103-R349 HydrophobicContact CE-CB 4.05Å; M103-R349 HydrophobicContact SD-CB 4.01Å; M103-F350 HydrophobicContact CE-CD2 4.02Å; M103-F350 HydrophobicContact CE-CE1 4.37Å; M103-F350 HydrophobicContact CE-CE2 3.73Å; M103-F350 HydrophobicContact CE-CG 4.47Å; M103-F350 HydrophobicContact CE-CZ 3.92Å |
| 104 | R | 84.1 | Confident | 88.2 | Confident | 108 Ų | 108 | 44.2 Ų | 44.2 | 41% | 0.408 | 21% | 0.209 | S | C | . | . | trans | -83.4 | 57.8 | 179.6 | -59 | 179.9 | -173.7 | 175.3 | -2.1 | 112.1 | L98 K101 R102 Y109 | L98-R104 PolarHBondContact O-NE 3.26Å; L98-R104 PolarHBondContact O-NH2 3.35Å; K101-R104 WeakPolarHBondContact O-CB 3.33Å; K101-R104 PolarHBondContact O-N 3.44Å; K101-R104 VanDerWaalsContact O-N 3.14Å; R102-R104 VanDerWaalsContact C-N 3.31Å; R104-Y109 HydrophobicContact CB-CE2 4.48Å | ||
| 105 | T | 86.3 | Confident | 88.3 | Confident | 64 Ų | 64 | 43 Ų | 43 | 39% | 0.393 | 20% | 0.203 | S | C | . | . | trans | -91.4 | 160.2 | 174.4 | 59.5 | 0 | 0 | 0 | 0 | 111.1 | M103 T107 N108 Y109 | M103-T105 PolarHBondContact O-N 2.9Å; T105-T107 PolarHBondContact O-N 3.13Å; T105-N108 WeakPolarHBondContact O-CA 3.32Å; T105-N108 WeakPolarHBondContact O-CB 3.46Å; T105-N108 PolarHBondContact O-N 2.86Å; T105-N108 VanDerWaalsContact OG1-CG 3.25Å; T105-N108 PolarHBondContact OG1-ND2 3.3Å; T105-Y109 WeakPolarHBondContact O-CD2 3.4Å; T105-Y109 PolarHBondContact O-N 3.24Å | ||
| 106 | V | 84.6 | Confident | 88.4 | Confident | 25 Ų | 25 | 42.5 Ų | 42.5 | 15% | 0.152 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -47.2 | -53.2 | 176.9 | 169.3 | 0 | 0 | 0 | 0 | 112.9 | N108 Y109 F110 L182 T187 | V106-N108 PolarHBondContact O-N 3.48Å; V106-Y109 PolarHBondContact O-N 2.97Å; V106-Y109 VanDerWaalsContact O-N 3.13Å; V106-F110 HydrophobicContact CG1-CE2 4.23Å; V106-F110 PolarHBondContact O-N 2.72Å; V106-L182 HydrophobicContact CG1-CB 4.21Å; V106-L182 WeakPolarHBondContact CG2-O 3.4Å; V106-T187 HydrophobicContact CG1-CG2 4.19Å; V106-T187 VanDerWaalsContact CG1-OG1 3.26Å; V106-T187 WeakPolarHBondContact CG1-OG1 3.36Å |
| 107 | T | 86.2 | Confident | 88.7 | Confident | 6 Ų | 6 | 42.5 Ų | 42.5 | 4% | 0.037 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -58.8 | -34 | 178 | -33.4 | 0 | 0 | 0 | 0 | 112.5 | T105 F110 L111 I166 D169 R170 | T105-T107 PolarHBondContact O-N 3.13Å; T107-F110 PolarHBondContact O-N 3.27Å; T107-L111 WeakPolarHBondContact O-CG 3.02Å; T107-L111 PolarHBondContact O-N 3.15Å; T107-L111 VanDerWaalsContact O-N 3.09Å; T107-I166 HydrophobicContact CG2-CB 4.25Å; T107-I166 HydrophobicContact CG2-CG1 4.01Å; T107-I166 HydrophobicContact CG2-CG2 3.54Å; T107-D169 PolarHBondContact OG1-OD2 3.19Å; T107-R170 PolarHBondContact OG1-NH1 2.68Å; T107-R170 PolarHBondContact OG1-NH2 3.37Å |
| 108 | N | 89.6 | Confident | 88.9 | Confident | 14 Ų | 14 | 42.6 Ų | 42.6 | 8% | 0.075 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -79.4 | -23.6 | -177.2 | -69.1 | -0.2 | 0 | 0 | 0 | 112.1 | I97 M103 T105 V106 F110 L111 V112 | I97-N108 HydrophobicContact CD1-CB 4.33Å; I97-N108 HydrophobicContact CG2-CB 3.98Å; M103-N108 WeakPolarHBondContact O-CB 3.49Å; M103-N108 PolarHBondContact O-ND2 2.99Å; T105-N108 WeakPolarHBondContact O-CA 3.32Å; T105-N108 WeakPolarHBondContact O-CB 3.46Å; T105-N108 PolarHBondContact O-N 2.86Å; T105-N108 VanDerWaalsContact OG1-CG 3.25Å; T105-N108 PolarHBondContact OG1-ND2 3.3Å; V106-N108 PolarHBondContact O-N 3.48Å; N108-F110 VanDerWaalsContact C-N 3.35Å; N108-L111 PolarHBondContact O-N 3.39Å; N108-L111 WeakPolarHBondContact OD1-CD1 3.05Å; N108-V112 WeakPolarHBondContact O-CG2 3.15Å; N108-V112 PolarHBondContact O-N 2.87Å |
| 109 | Y | 91.6 | Very high | 89.2 | Confident | 65 Ų | 65 | 39 Ų | 39 | 26% | 0.255 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -64.2 | -40.6 | 167.4 | -77.7 | -67.6 | 0 | 0 | 0 | 111.6 | R104 T105 V106 L111 V112 N113 | R104-Y109 HydrophobicContact CB-CE2 4.48Å; T105-Y109 WeakPolarHBondContact O-CD2 3.4Å; T105-Y109 PolarHBondContact O-N 3.24Å; V106-Y109 PolarHBondContact O-N 2.97Å; V106-Y109 VanDerWaalsContact O-N 3.13Å; Y109-L111 VanDerWaalsContact C-N 3.35Å; Y109-V112 PolarHBondContact O-N 3.23Å; Y109-N113 PolarHBondContact O-N 3.49Å |
| 110 | F | 92.9 | Very high | 89.6 | Confident | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -65.4 | -36.7 | 171.8 | -70.2 | -64.2 | 0 | 0 | 0 | 112.4 | V106 T107 N108 V112 N113 L114 A165 I166 T187 V190 I191 | V106-F110 HydrophobicContact CG1-CE2 4.23Å; V106-F110 PolarHBondContact O-N 2.72Å; T107-F110 PolarHBondContact O-N 3.27Å; N108-F110 VanDerWaalsContact C-N 3.35Å; F110-V112 VanDerWaalsContact C-N 3.33Å; F110-V112 PolarHBondContact O-N 3.18Å; F110-N113 PolarHBondContact O-N 3.44Å; F110-L114 WeakPolarHBondContact O-CB 3.48Å; F110-L114 PolarHBondContact O-N 3.44Å; F110-A165 HydrophobicContact CD1-CB 3.93Å; F110-A165 HydrophobicContact CD2-CB 4.26Å; F110-A165 HydrophobicContact CE1-CB 3.55Å; F110-A165 HydrophobicContact CE2-CB 3.9Å; F110-A165 HydrophobicContact CG-CB 4.28Å; F110-A165 HydrophobicContact CZ-CB 3.53Å; F110-I166 HydrophobicContact CB-CD1 3.64Å; F110-I166 HydrophobicContact CB-CG1 3.41Å; F110-I166 VanDerWaalsContact CB-CG1 3.41Å; F110-I166 HydrophobicContact CD2-CG1 4.26Å; F110-I166 HydrophobicContact CG-CG1 4.09Å; F110-T187 HydrophobicContact CD2-CG2 4.14Å; F110-T187 HydrophobicContact CE1-CG2 4.31Å; F110-T187 HydrophobicContact CE2-CG2 3.71Å; F110-T187 HydrophobicContact CZ-CG2 3.8Å; F110-V190 HydrophobicContact CE1-CB 4.41Å; F110-V190 HydrophobicContact CE1-CG1 3.87Å; F110-V190 HydrophobicContact CZ-CB 4.27Å; F110-V190 HydrophobicContact CZ-CG1 3.91Å; F110-I191 HydrophobicContact CD1-CD1 4.27Å; F110-I191 HydrophobicContact CD1-CG1 3.9Å; F110-I191 HydrophobicContact CE1-CD1 4.43Å; F110-I191 HydrophobicContact CE1-CG1 3.8Å |
| 111 | L | 91.9 | Very high | 90 | Very high | 10 Ų | 10 | 36 Ų | 36 | 5% | 0.052 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -63.5 | -36.7 | 173.2 | -66.9 | 179.6 | 0 | 0 | 0 | 112.6 | I97 T107 N108 Y109 L114 A115 I166 Y343 F350 | I97-L111 HydrophobicContact CD1-CB 3.92Å; T107-L111 WeakPolarHBondContact O-CG 3.02Å; T107-L111 PolarHBondContact O-N 3.15Å; T107-L111 VanDerWaalsContact O-N 3.09Å; N108-L111 PolarHBondContact O-N 3.39Å; N108-L111 WeakPolarHBondContact OD1-CD1 3.05Å; Y109-L111 VanDerWaalsContact C-N 3.35Å; L111-L114 HydrophobicContact CD2-CD2 4.45Å; L111-A115 VanDerWaalsContact O-CB 3.26Å; L111-A115 WeakPolarHBondContact O-CB 3.32Å; L111-A115 PolarHBondContact O-N 3.26Å; L111-I166 HydrophobicContact CD2-CD1 3.74Å; L111-I166 HydrophobicContact CG-CD1 4.27Å; L111-Y343 HydrophobicContact CD2-CE1 4.03Å; L111-Y343 HydrophobicContact CD2-CE2 3.91Å; L111-Y343 VanDerWaalsContact CD2-CZ 3.49Å; L111-Y343 VanDerWaalsContact CD2-OH 3.3Å; L111-Y343 WeakPolarHBondContact CD2-OH 3.08Å; L111-F350 HydrophobicContact CD1-CE2 4.02Å; L111-F350 HydrophobicContact CD1-CZ 3.82Å |
| 112 | V | 94.3 | Very high | 90.5 | Very high | 27 Ų | 27 | 27.7 Ų | 27.7 | 16% | 0.164 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -65.7 | -44.1 | 172.9 | 171 | 0 | 0 | 0 | 0 | 110.8 | I94 I97 N108 Y109 F110 L114 A115 F116 | I94-V112 HydrophobicContact CG1-CG1 4.44Å; I97-V112 HydrophobicContact CB-CG2 3.71Å; I97-V112 HydrophobicContact CD1-CG2 3.61Å; I97-V112 HydrophobicContact CG1-CG2 4.27Å; I97-V112 HydrophobicContact CG2-CG2 3.55Å; N108-V112 WeakPolarHBondContact O-CG2 3.15Å; N108-V112 PolarHBondContact O-N 2.87Å; Y109-V112 PolarHBondContact O-N 3.23Å; F110-V112 VanDerWaalsContact C-N 3.33Å; F110-V112 PolarHBondContact O-N 3.18Å; V112-L114 PolarHBondContact O-N 2.84Å; V112-A115 PolarHBondContact O-N 2.99Å; V112-F116 WeakPolarHBondContact O-CB 3.45Å; V112-F116 PolarHBondContact O-N 3.32Å |
| 113 | N | 95.1 | Very high | 91.1 | Very high | 13 Ų | 13 | 24.1 Ų | 24.1 | 7% | 0.07 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -61.1 | -45 | 177.4 | -171.1 | 61.7 | 0 | 0 | 0 | 111.8 | Y109 F110 F116 S117 S162 I191 W195 | Y109-N113 PolarHBondContact O-N 3.49Å; F110-N113 PolarHBondContact O-N 3.44Å; N113-F116 PolarHBondContact O-N 3.02Å; N113-S117 WeakPolarHBondContact O-CB 3.32Å; N113-S117 PolarHBondContact O-N 3.28Å; N113-S162 PolarHBondContact ND2-OG 3.4Å; N113-I191 HydrophobicContact CB-CD1 4.25Å; N113-I191 HydrophobicContact CB-CG1 4.4Å; N113-I191 HydrophobicContact CB-CG2 4.37Å; N113-I191 WeakPolarHBondContact OD1-CG2 3.38Å; N113-W195 PolarHBondContact OD1-NE1 3.46Å |
| 114 | L | 93.4 | Very high | 91.6 | Very high | 1 Ų | 1 | 28.4 Ų | 28.4 | 1% | 0.005 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -58.3 | -52.2 | 174.5 | 176.4 | 63.1 | 0 | 0 | 0 | 111.4 | F110 L111 V112 F116 S117 D118 S159 M163 Y343 | F110-L114 WeakPolarHBondContact O-CB 3.48Å; F110-L114 PolarHBondContact O-N 3.44Å; L111-L114 HydrophobicContact CD2-CD2 4.45Å; V112-L114 PolarHBondContact O-N 2.84Å; L114-F116 VanDerWaalsContact C-N 3.31Å; L114-F116 PolarHBondContact O-N 2.82Å; L114-S117 PolarHBondContact O-N 3.42Å; L114-D118 WeakPolarHBondContact O-CB 3.24Å; L114-D118 PolarHBondContact O-N 3.45Å; L114-S159 VanDerWaalsContact CD1-CB 3.43Å; L114-M163 HydrophobicContact CD1-CG 4.25Å; L114-M163 HydrophobicContact CD2-CG 4.02Å; L114-Y343 WeakPolarHBondContact CD2-OH 3.33Å |
| 115 | A | 95.3 | Very high | 91.7 | Very high | 1 Ų | 1 | 23.5 Ų | 23.5 | 1% | 0.008 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -61.9 | -37.8 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | N90 V93 I94 L111 V112 A119 | N90-A115 HydrophobicContact CB-CB 3.97Å; N90-A115 WeakPolarHBondContact CB-O 3.49Å; V93-A115 HydrophobicContact CB-CB 4.24Å; V93-A115 HydrophobicContact CG1-CB 3.97Å; I94-A115 HydrophobicContact CD1-CB 4.16Å; I94-A115 HydrophobicContact CG1-CB 3.74Å; L111-A115 VanDerWaalsContact O-CB 3.26Å; L111-A115 WeakPolarHBondContact O-CB 3.32Å; L111-A115 PolarHBondContact O-N 3.26Å; V112-A115 PolarHBondContact O-N 2.99Å; A115-A119 WeakPolarHBondContact O-CB 3.42Å; A115-A119 PolarHBondContact O-N 3.09Å |
| 116 | F | 95.9 | Very high | 91.6 | Very high | 105 Ų | 105 | 20.4 Ų | 20.4 | 46% | 0.461 | 10% | 0.104 | S | C | . | . | H | α-helix | trans | -65.2 | -45.4 | 176 | 172.7 | -102.3 | 0 | 0 | 0 | 111.9 | I94 V112 N113 L114 S120 W195 | I94-F116 HydrophobicContact CD1-CB 4.25Å; V112-F116 WeakPolarHBondContact O-CB 3.45Å; V112-F116 PolarHBondContact O-N 3.32Å; N113-F116 PolarHBondContact O-N 3.02Å; L114-F116 VanDerWaalsContact C-N 3.31Å; L114-F116 PolarHBondContact O-N 2.82Å; F116-S120 VanDerWaalsContact O-CB 3.27Å; F116-S120 WeakPolarHBondContact O-CB 3.43Å; F116-S120 PolarHBondContact O-N 3.17Å; F116-S120 PolarHBondContact O-OG 2.97Å; F116-W195 HydrophobicContact CD1-CH2 4.33Å; F116-W195 AromaticContact CD1-CZ2 3.84Å; F116-W195 HydrophobicContact CD1-CZ2 3.84Å; F116-W195 AromaticContact CE1-CH2 3.97Å; F116-W195 HydrophobicContact CE1-CH2 3.97Å; F116-W195 AromaticContact CE1-CZ2 3.82Å; F116-W195 HydrophobicContact CE1-CZ2 3.82Å |
| 117 | S | 95.3 | Very high | 91.6 | Very high | 0 Ų | 0 | 23 Ų | 23 | 0% | 0 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -63.4 | -47.4 | 179.1 | -164 | 0 | 0 | 0 | 0 | 111.9 | N113 L114 S120 M121 A155 S159 | N113-S117 WeakPolarHBondContact O-CB 3.32Å; N113-S117 PolarHBondContact O-N 3.28Å; L114-S117 PolarHBondContact O-N 3.42Å; S117-S120 PolarHBondContact O-N 2.92Å; S117-M121 WeakPolarHBondContact O-CB 2.95Å; S117-M121 PolarHBondContact O-N 3.49Å; S117-A155 VanDerWaalsContact OG-C 3.25Å; S117-A155 WeakPolarHBondContact OG-CA 3.5Å; S117-A155 WeakPolarHBondContact OG-CB 3.36Å; S117-A155 PolarHBondContact OG-O 3.2Å; S117-S159 WeakPolarHBondContact CB-OG 3.34Å; S117-S159 PolarHBondContact OG-OG 3.15Å |
| 118 | D | 94.4 | Very high | 91.5 | Very high | 5 Ų | 5 | 23.1 Ų | 23.1 | 3% | 0.027 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -65.6 | -44.7 | 179.1 | -71.9 | -7.8 | 0 | 0 | 0 | 112.3 | L114 M121 A122 S159 T336 N339 | L114-D118 WeakPolarHBondContact O-CB 3.24Å; L114-D118 PolarHBondContact O-N 3.45Å; D118-M121 PolarHBondContact O-N 3.11Å; D118-A122 WeakPolarHBondContact O-CB 3.24Å; D118-A122 PolarHBondContact O-N 3.45Å; D118-S159 WeakPolarHBondContact OD1-CB 3.31Å; D118-S159 PolarHBondContact OD1-OG 3.34Å; D118-T336 HydrophobicContact CB-CG2 4.04Å; D118-N339 PolarHBondContact OD2-ND2 3.33Å |
| 119 | A | 94.7 | Very high | 91.1 | Very high | 8 Ų | 8 | 23.2 Ų | 23.2 | 7% | 0.066 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -62.2 | -44.5 | 177 | 0 | 0 | 0 | 0 | 0 | 111.5 | N90 A115 A122 A123 | N90-A119 HydrophobicContact CB-CB 3.88Å; A115-A119 WeakPolarHBondContact O-CB 3.42Å; A115-A119 PolarHBondContact O-N 3.09Å; A119-A122 PolarHBondContact O-N 3.37Å; A119-A123 VanDerWaalsContact O-CB 3.3Å; A119-A123 WeakPolarHBondContact O-CB 3.35Å; A119-A123 PolarHBondContact O-N 3.48Å |
| 120 | S | 93.6 | Very high | 90.3 | Very high | 13 Ų | 13 | 21.9 Ų | 21.9 | 9% | 0.091 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -65.5 | -41.9 | 179.7 | -56.7 | 0 | 0 | 0 | 0 | 110.9 | F116 S117 A123 F124 F151 | F116-S120 VanDerWaalsContact O-CB 3.27Å; F116-S120 WeakPolarHBondContact O-CB 3.43Å; F116-S120 PolarHBondContact O-N 3.17Å; F116-S120 PolarHBondContact O-OG 2.97Å; S117-S120 PolarHBondContact O-N 2.92Å; S120-A123 PolarHBondContact O-N 2.92Å; S120-F124 WeakPolarHBondContact O-CB 3.43Å; S120-F124 WeakPolarHBondContact O-CD2 3.34Å; S120-F124 PolarHBondContact O-N 3.49Å; S120-F151 VanDerWaalsContact CB-CZ 3.48Å |
| 121 | M | 92.1 | Very high | 89.6 | Confident | 2 Ų | 2 | 24.2 Ų | 24.2 | 1% | 0.01 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -63.6 | -44.6 | 177.2 | -173.2 | 176.1 | 63.7 | 0 | 0 | 111.4 | S117 D118 A123 N125 T126 A155 V156 M333 T336 | S117-M121 WeakPolarHBondContact O-CB 2.95Å; S117-M121 PolarHBondContact O-N 3.49Å; D118-M121 PolarHBondContact O-N 3.11Å; M121-A123 PolarHBondContact O-N 3.49Å; M121-N125 HydrophobicContact CG-CB 4.24Å; M121-N125 WeakPolarHBondContact O-CA 3.07Å; M121-N125 WeakPolarHBondContact O-CB 3.36Å; M121-N125 PolarHBondContact O-N 3.41Å; M121-T126 PolarHBondContact O-N 3.35Å; M121-A155 HydrophobicContact CB-CB 3.8Å; M121-A155 HydrophobicContact CG-CB 4.17Å; M121-A155 HydrophobicContact SD-CB 4.07Å; M121-V156 HydrophobicContact CE-CG2 4.16Å; M121-V156 HydrophobicContact SD-CG2 3.52Å; M121-V156 VanDerWaalsContact SD-CG2 3.52Å; M121-M333 HydrophobicContact CE-CE 3.95Å; M121-M333 HydrophobicContact CG-CE 3.79Å; M121-M333 HydrophobicContact SD-CE 4.01Å; M121-T336 HydrophobicContact CE-CG2 3.17Å |
| 122 | A | 91.9 | Very high | 88.9 | Confident | 0 Ų | 0 | 23.9 Ų | 23.9 | 0% | 0 | 12% | 0.123 | C | C | . | . | I | π-helix | trans | -62.2 | -43.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | A86 V87 D118 A119 T126 L127 | A86-A122 HydrophobicContact CB-CB 3.63Å; V87-A122 HydrophobicContact CG2-CB 3.96Å; D118-A122 WeakPolarHBondContact O-CB 3.24Å; D118-A122 PolarHBondContact O-N 3.45Å; A119-A122 PolarHBondContact O-N 3.37Å; A122-T126 WeakPolarHBondContact O-CB 3.28Å; A122-L127 PolarHBondContact O-N 3.21Å |
| 123 | A | 91.1 | Very high | 87.6 | Confident | 31 Ų | 31 | 24 Ų | 24 | 26% | 0.256 | 13% | 0.127 | S | C | . | . | I | π-helix | trans | -69.9 | -46.6 | -178 | 0 | 0 | 0 | 0 | 0 | 113 | V87 A119 S120 M121 L127 | V87-A123 HydrophobicContact CG2-CB 4Å; A119-A123 VanDerWaalsContact O-CB 3.3Å; A119-A123 WeakPolarHBondContact O-CB 3.35Å; A119-A123 PolarHBondContact O-N 3.48Å; S120-A123 PolarHBondContact O-N 2.92Å; M121-A123 PolarHBondContact O-N 3.49Å; A123-L127 VanDerWaalsContact O-CB 3.24Å; A123-L127 WeakPolarHBondContact O-CB 3.43Å |
| 124 | F | 89.1 | Confident | 86.4 | Confident | 99 Ų | 99 | 26.6 Ų | 26.6 | 43% | 0.434 | 14% | 0.14 | S | C | . | . | I | π-helix | trans | -94.9 | -33.8 | -171.8 | -59.5 | -60.2 | 0 | 0 | 0 | 113.6 | S120 V128 Y144 F147 Q148 F151 | S120-F124 WeakPolarHBondContact O-CB 3.43Å; S120-F124 WeakPolarHBondContact O-CD2 3.34Å; S120-F124 PolarHBondContact O-N 3.49Å; F124-V128 WeakPolarHBondContact O-CG2 2.92Å; F124-Y144 PolarHBondContact O-OH 3.31Å; F124-F147 HydrophobicContact CB-CE1 3.97Å; F124-F147 HydrophobicContact CG-CE1 4.41Å; F124-Q148 PolarHBondContact O-OE1 3.4Å; F124-F151 HydrophobicContact CD2-CE1 4.32Å |
| 125 | N | 87.4 | Confident | 85.3 | Confident | 4 Ų | 4 | 31.8 Ų | 31.8 | 2% | 0.021 | 16% | 0.164 | C | C | . | . | I | π-helix | trans | -94.8 | -56.3 | -176.7 | -176.5 | -99.3 | 0 | 0 | 0 | 112.7 | M121 L127 V128 N129 Q148 P152 | M121-N125 HydrophobicContact CG-CB 4.24Å; M121-N125 WeakPolarHBondContact O-CA 3.07Å; M121-N125 WeakPolarHBondContact O-CB 3.36Å; M121-N125 PolarHBondContact O-N 3.41Å; N125-L127 VanDerWaalsContact C-N 3.34Å; N125-L127 PolarHBondContact O-N 3.14Å; N125-V128 PolarHBondContact O-N 3.1Å; N125-N129 VanDerWaalsContact CG-ND2 3.31Å; N125-N129 PolarHBondContact ND2-ND2 2.95Å; N125-N129 VanDerWaalsContact ND2-ND2 3.17Å; N125-N129 VanDerWaalsContact O-CB 3.29Å; N125-N129 WeakPolarHBondContact O-CB 3.43Å; N125-N129 PolarHBondContact O-N 2.69Å; N125-N129 PolarHBondContact OD1-ND2 2.89Å; N125-Q148 PolarHBondContact ND2-NE2 3.4Å; N125-Q148 PolarHBondContact ND2-O 3.49Å; N125-Q148 PolarHBondContact ND2-OE1 2.91Å; N125-Q148 PolarHBondContact O-NE2 3.42Å; N125-P152 HydrophobicContact CB-CG 4Å; N125-P152 WeakPolarHBondContact ND2-CG 3.29Å |
| 126 | T | 84.1 | Confident | 84.1 | Confident | 0 Ų | 0 | 33.8 Ų | 33.8 | 0% | 0 | 18% | 0.178 | C | C | . | . | I | π-helix | trans | -60.9 | -44.6 | -175.8 | -49.3 | 0 | 0 | 0 | 0 | 111.2 | Y79 V83 M121 A122 V128 N129 F130 M333 | Y79-T126 HydrophobicContact CD1-CG2 3.8Å; Y79-T126 HydrophobicContact CE1-CG2 4.42Å; V83-T126 HydrophobicContact CG2-CG2 3.5Å; V83-T126 VanDerWaalsContact CG2-CG2 3.5Å; M121-T126 PolarHBondContact O-N 3.35Å; A122-T126 WeakPolarHBondContact O-CB 3.28Å; T126-V128 PolarHBondContact O-N 3.39Å; T126-N129 PolarHBondContact O-N 3.29Å; T126-F130 WeakPolarHBondContact O-CB 3.47Å; T126-F130 PolarHBondContact O-N 3.15Å; T126-M333 HydrophobicContact CG2-CB 4.35Å; T126-M333 HydrophobicContact CG2-CG 4.32Å; T126-M333 WeakPolarHBondContact OG1-CE 3.23Å |
| 127 | L | 84.6 | Confident | 83 | Confident | 80 Ų | 80 | 31.6 Ų | 31.6 | 42% | 0.419 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -59.6 | -47.5 | 179 | -178.1 | 61.3 | 0 | 0 | 0 | 111.9 | A122 A123 N125 F130 I131 | A122-L127 PolarHBondContact O-N 3.21Å; A123-L127 VanDerWaalsContact O-CB 3.24Å; A123-L127 WeakPolarHBondContact O-CB 3.43Å; N125-L127 VanDerWaalsContact C-N 3.34Å; N125-L127 PolarHBondContact O-N 3.14Å; L127-F130 PolarHBondContact O-N 2.61Å; L127-I131 HydrophobicContact CD1-CD1 4.48Å; L127-I131 HydrophobicContact CG-CD1 4.31Å; L127-I131 WeakPolarHBondContact O-CG1 3.4Å; L127-I131 PolarHBondContact O-N 3Å |
| 128 | V | 84.2 | Confident | 82.3 | Confident | 8 Ų | 8 | 32.1 Ų | 32.1 | 5% | 0.048 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -72.7 | -39.6 | -178.9 | 172.8 | 0 | 0 | 0 | 0 | 112.2 | F124 N125 T126 F130 I131 Y132 W138 F140 Y144 | F124-V128 WeakPolarHBondContact O-CG2 2.92Å; N125-V128 PolarHBondContact O-N 3.1Å; T126-V128 PolarHBondContact O-N 3.39Å; V128-F130 PolarHBondContact O-N 3.25Å; V128-I131 PolarHBondContact O-N 2.84Å; V128-Y132 WeakPolarHBondContact O-CB 3.32Å; V128-Y132 PolarHBondContact O-N 3.29Å; V128-W138 HydrophobicContact CG1-CH2 4.15Å; V128-W138 HydrophobicContact CG1-CZ3 4.27Å; V128-F140 HydrophobicContact CB-CE2 4.5Å; V128-F140 HydrophobicContact CG1-CD2 3.63Å; V128-F140 HydrophobicContact CG1-CE2 3.49Å; V128-F140 VanDerWaalsContact CG1-CE2 3.49Å; V128-F140 HydrophobicContact CG1-CG 4.25Å; V128-F140 HydrophobicContact CG1-CZ 3.97Å; V128-F140 HydrophobicContact CG2-CE1 4.29Å; V128-F140 HydrophobicContact CG2-CZ 4.21Å; V128-Y144 HydrophobicContact CB-CE1 3.88Å; V128-Y144 HydrophobicContact CG1-CD1 4.18Å; V128-Y144 HydrophobicContact CG1-CE1 3.62Å; V128-Y144 HydrophobicContact CG2-CE1 3.64Å; V128-Y144 WeakPolarHBondContact CG2-OH 3.34Å |
| 129 | N | 80.1 | Confident | 81.7 | Confident | 16 Ų | 16 | 37.5 Ų | 37.5 | 9% | 0.086 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -60.5 | -37.2 | 173.8 | -90 | -31.7 | 0 | 0 | 0 | 111.5 | T31 N125 T126 A133 Q148 F329 | T31-N129 WeakPolarHBondContact CG2-OD1 3.33Å; N125-N129 VanDerWaalsContact CG-ND2 3.31Å; N125-N129 PolarHBondContact ND2-ND2 2.95Å; N125-N129 VanDerWaalsContact ND2-ND2 3.17Å; N125-N129 VanDerWaalsContact O-CB 3.29Å; N125-N129 WeakPolarHBondContact O-CB 3.43Å; N125-N129 PolarHBondContact O-N 2.69Å; N125-N129 PolarHBondContact OD1-ND2 2.89Å; T126-N129 PolarHBondContact O-N 3.29Å; N129-A133 VanDerWaalsContact O-CB 3.27Å; N129-A133 WeakPolarHBondContact O-CB 3.06Å; N129-A133 PolarHBondContact O-N 3.17Å; N129-Q148 PolarHBondContact ND2-NE2 3.17Å; N129-Q148 VanDerWaalsContact ND2-NE2 3.13Å; N129-Q148 PolarHBondContact OD1-NE2 3.13Å; N129-F329 HydrophobicContact CB-CE1 3.93Å; N129-F329 HydrophobicContact CB-CZ 4.16Å; N129-F329 WeakPolarHBondContact ND2-CZ 3.29Å |
| 130 | F | 74.9 | Confident | 81.2 | Confident | 36 Ų | 36 | 40.5 Ų | 40.5 | 16% | 0.158 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -66 | -48.2 | 175.4 | 171.9 | -110 | 0 | 0 | 0 | 112 | S76 Y79 T126 L127 V128 Y132 A133 L134 | S76-F130 VanDerWaalsContact CB-CZ 3.44Å; S76-F130 VanDerWaalsContact OG-CZ 3.28Å; S76-F130 WeakPolarHBondContact OG-CZ 3.29Å; Y79-F130 HydrophobicContact CD2-CD2 4.42Å; Y79-F130 HydrophobicContact CG-CD2 4.2Å; T126-F130 WeakPolarHBondContact O-CB 3.47Å; T126-F130 PolarHBondContact O-N 3.15Å; L127-F130 PolarHBondContact O-N 2.61Å; V128-F130 PolarHBondContact O-N 3.25Å; F130-Y132 VanDerWaalsContact C-N 3.31Å; F130-Y132 PolarHBondContact O-N 2.84Å; F130-A133 PolarHBondContact O-N 3.22Å; F130-A133 VanDerWaalsContact O-N 3.13Å; F130-L134 HydrophobicContact CD1-CD1 4.32Å; F130-L134 HydrophobicContact CD2-CG 4.41Å; F130-L134 HydrophobicContact CE1-CD1 3.56Å; F130-L134 HydrophobicContact CE1-CG 4.21Å; F130-L134 HydrophobicContact CE2-CD1 4.03Å; F130-L134 HydrophobicContact CE2-CD2 3.82Å; F130-L134 HydrophobicContact CE2-CG 3.8Å; F130-L134 HydrophobicContact CZ-CD1 3.37Å; F130-L134 HydrophobicContact CZ-CD2 3.87Å; F130-L134 HydrophobicContact CZ-CG 3.7Å; F130-L134 WeakPolarHBondContact O-CG 3.47Å; F130-L134 PolarHBondContact O-N 3.2Å |
| 131 | I | 78.3 | Confident | 80.9 | Confident | 49 Ų | 49 | 41.6 Ų | 41.6 | 25% | 0.251 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -58.6 | -45.4 | 175.9 | -66.3 | 164.4 | 0 | 0 | 0 | 110.8 | L127 V128 A133 L134 H135 F140 | L127-I131 HydrophobicContact CD1-CD1 4.48Å; L127-I131 HydrophobicContact CG-CD1 4.31Å; L127-I131 WeakPolarHBondContact O-CG1 3.4Å; L127-I131 PolarHBondContact O-N 3Å; V128-I131 PolarHBondContact O-N 2.84Å; I131-A133 VanDerWaalsContact C-N 3.32Å; I131-A133 PolarHBondContact O-N 3.05Å; I131-L134 PolarHBondContact O-N 2.94Å; I131-H135 PolarHBondContact O-CD2 3.47Å; I131-H135 PolarHBondContact O-N 3.45Å; I131-H135 VanDerWaalsContact O-N 3.09Å; I131-F140 HydrophobicContact CB-CZ 4.38Å; I131-F140 HydrophobicContact CD1-CZ 4.17Å; I131-F140 HydrophobicContact CG2-CE2 4.25Å; I131-F140 HydrophobicContact CG2-CZ 4.02Å |
| 132 | Y | 76.6 | Confident | 80.6 | Confident | 4 Ų | 4 | 43.3 Ų | 43.3 | 2% | 0.016 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -63.1 | -38 | 177.4 | 175.2 | -94 | 0 | 0 | 0 | 112 | T31 A35 V128 F130 L134 S136 E137 W138 | T31-Y132 HydrophobicContact CG2-CD1 3.66Å; T31-Y132 HydrophobicContact CG2-CE1 3.74Å; T31-Y132 WeakPolarHBondContact O-CE1 3.03Å; T31-Y132 PolarHBondContact O-OH 3.38Å; A35-Y132 WeakPolarHBondContact CB-OH 3.48Å; V128-Y132 WeakPolarHBondContact O-CB 3.32Å; V128-Y132 PolarHBondContact O-N 3.29Å; F130-Y132 VanDerWaalsContact C-N 3.31Å; F130-Y132 PolarHBondContact O-N 2.84Å; Y132-L134 VanDerWaalsContact C-N 3.34Å; Y132-L134 PolarHBondContact O-N 3.43Å; Y132-S136 VanDerWaalsContact O-CA 3.28Å; Y132-S136 WeakPolarHBondContact O-CA 3.14Å; Y132-S136 PolarHBondContact O-N 2.9Å; Y132-E137 WeakPolarHBondContact CD2-O 3.29Å; Y132-W138 HydrophobicContact CD2-CB 4.21Å; Y132-W138 AromaticContact CD2-CE3 3.64Å; Y132-W138 HydrophobicContact CD2-CE3 3.64Å; Y132-W138 HydrophobicContact CD2-CZ3 4.42Å; Y132-W138 HydrophobicContact CE2-CB 4.01Å; Y132-W138 HydrophobicContact CE2-CE3 4.05Å; Y132-W138 HydrophobicContact CG-CE3 4.18Å |
| 133 | A | 68.3 | Low | 80.5 | Confident | 29 Ų | 29 | 49.6 Ų | 49.6 | 24% | 0.24 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -67 | -31.8 | 175 | 0 | 0 | 0 | 0 | 0 | 113.2 | N129 F130 I131 | N129-A133 VanDerWaalsContact O-CB 3.27Å; N129-A133 WeakPolarHBondContact O-CB 3.06Å; N129-A133 PolarHBondContact O-N 3.17Å; F130-A133 PolarHBondContact O-N 3.22Å; F130-A133 VanDerWaalsContact O-N 3.13Å; I131-A133 VanDerWaalsContact C-N 3.32Å; I131-A133 PolarHBondContact O-N 3.05Å |
| 134 | L | 69.3 | Low | 80.4 | Confident | 67 Ų | 67 | 50.8 Ų | 50.8 | 35% | 0.351 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -71.3 | -47.7 | 176.7 | -71.6 | -179.2 | 0 | 0 | 0 | 112.6 | I72 F130 I131 Y132 | I72-L134 HydrophobicContact CG2-CD2 3.31Å; F130-L134 HydrophobicContact CD1-CD1 4.32Å; F130-L134 HydrophobicContact CD2-CG 4.41Å; F130-L134 HydrophobicContact CE1-CD1 3.56Å; F130-L134 HydrophobicContact CE1-CG 4.21Å; F130-L134 HydrophobicContact CE2-CD1 4.03Å; F130-L134 HydrophobicContact CE2-CD2 3.82Å; F130-L134 HydrophobicContact CE2-CG 3.8Å; F130-L134 HydrophobicContact CZ-CD1 3.37Å; F130-L134 HydrophobicContact CZ-CD2 3.87Å; F130-L134 HydrophobicContact CZ-CG 3.7Å; F130-L134 WeakPolarHBondContact O-CG 3.47Å; F130-L134 PolarHBondContact O-N 3.2Å; I131-L134 PolarHBondContact O-N 2.94Å; Y132-L134 VanDerWaalsContact C-N 3.34Å; Y132-L134 PolarHBondContact O-N 3.43Å |
| 135 | H | 70.4 | Confident | 80.3 | Confident | 110 Ų | 110 | 46.1 Ų | 46.1 | 51% | 0.509 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -92.3 | -15.8 | -172.4 | -72.2 | -87.6 | 0 | 0 | 0 | 113.4 | I131 E137 Y139 | I131-H135 PolarHBondContact O-CD2 3.47Å; I131-H135 PolarHBondContact O-N 3.45Å; I131-H135 VanDerWaalsContact O-N 3.09Å; H135-E137 PolarHBondContact O-N 2.63Å; H135-E137 VanDerWaalsContact O-N 3.13Å; H135-Y139 HydrophobicContact CB-CE2 3.56Å; H135-Y139 AromaticContact CG-CE2 3.79Å |
| 136 | S | 69.2 | Low | 80.3 | Confident | 43 Ų | 43 | 50.7 Ų | 50.7 | 30% | 0.301 | 26% | 0.26 | S | S | . | . | S | Bend | trans | 54.4 | 25.3 | -174.8 | -59 | 0 | 0 | 0 | 0 | 113.7 | Y132 | Y132-S136 VanDerWaalsContact O-CA 3.28Å; Y132-S136 WeakPolarHBondContact O-CA 3.14Å; Y132-S136 PolarHBondContact O-N 2.9Å |
| 137 | E | 73.1 | Confident | 80.6 | Confident | 59 Ų | 59 | 54 Ų | 54 | 28% | 0.276 | 27% | 0.274 | S | S | . | . | S | Bend | trans | -142 | 139.7 | -177.1 | -175.2 | 172.3 | -153.6 | 0 | 0 | 111 | Y132 H135 Y139 | Y132-E137 WeakPolarHBondContact CD2-O 3.29Å; H135-E137 PolarHBondContact O-N 2.63Å; H135-E137 VanDerWaalsContact O-N 3.13Å; E137-Y139 HydrophobicContact CB-CE1 4.05Å; E137-Y139 HydrophobicContact CB-CE2 4.29Å; E137-Y139 VanDerWaalsContact CD-CE1 3.49Å; E137-Y139 HydrophobicContact CG-CD1 4.29Å; E137-Y139 HydrophobicContact CG-CE1 3.66Å; E137-Y139 WeakPolarHBondContact OE2-CE1 3.28Å; E137-Y139 PolarHBondContact OE2-OH 3.41Å |
| 138 | W | 80.3 | Confident | 80.6 | Confident | 11 Ų | 11 | 50.5 Ų | 50.5 | 4% | 0.042 | 26% | 0.256 | C | S | . | . | trans | -92.1 | 105.5 | -177.9 | -173.3 | -93.9 | 0 | 0 | 0 | 112.5 | V128 Y132 F140 G141 Y144 C145 Q148 T218 C220 | V128-W138 HydrophobicContact CG1-CH2 4.15Å; V128-W138 HydrophobicContact CG1-CZ3 4.27Å; Y132-W138 HydrophobicContact CD2-CB 4.21Å; Y132-W138 AromaticContact CD2-CE3 3.64Å; Y132-W138 HydrophobicContact CD2-CE3 3.64Å; Y132-W138 HydrophobicContact CD2-CZ3 4.42Å; Y132-W138 HydrophobicContact CE2-CB 4.01Å; Y132-W138 HydrophobicContact CE2-CE3 4.05Å; Y132-W138 HydrophobicContact CG-CE3 4.18Å; W138-F140 HydrophobicContact CH2-CD2 4.35Å; W138-F140 HydrophobicContact CZ2-CB 3.82Å; W138-F140 HydrophobicContact CZ2-CD2 4.33Å; W138-F140 HydrophobicContact CZ3-CD2 4.48Å; W138-G141 PolarHBondContact NE1-O 3.21Å; W138-Y144 AromaticContact CH2-CD1 3.91Å; W138-Y144 HydrophobicContact CH2-CD1 3.91Å; W138-Y144 AromaticContact CZ2-CD1 3.88Å; W138-Y144 HydrophobicContact CZ2-CD1 3.88Å; W138-C145 HydrophobicContact CZ2-CB 3.78Å; W138-Q148 HydrophobicContact CH2-CB 3.76Å; W138-Q148 HydrophobicContact CH2-CG 3.78Å; W138-Q148 HydrophobicContact CZ3-CG 4.18Å; W138-T218 HydrophobicContact CB-CG2 4.32Å; W138-T218 WeakPolarHBondContact CB-O 3.46Å; W138-T218 PolarHBondContact N-O 3.37Å; W138-C220 HydrophobicContact CD2-CB 3.78Å; W138-C220 HydrophobicContact CE3-CB 3.93Å; W138-C220 HydrophobicContact CG-CB 4.12Å; W138-C220 HydrophobicContact CZ3-CB 4.43Å | ||
| 139 | Y | 82.6 | Confident | 80.7 | Confident | 119 Ų | 119 | 51.4 Ų | 51.4 | 47% | 0.467 | 26% | 0.261 | S | S | . | . | trans | -93.1 | -17.5 | -178.8 | -55.8 | -62.6 | 0 | 0 | 0 | 115.1 | H135 E137 G141 | H135-Y139 HydrophobicContact CB-CE2 3.56Å; H135-Y139 AromaticContact CG-CE2 3.79Å; E137-Y139 HydrophobicContact CB-CE1 4.05Å; E137-Y139 HydrophobicContact CB-CE2 4.29Å; E137-Y139 VanDerWaalsContact CD-CE1 3.49Å; E137-Y139 HydrophobicContact CG-CD1 4.29Å; E137-Y139 HydrophobicContact CG-CE1 3.66Å; E137-Y139 WeakPolarHBondContact OE2-CE1 3.28Å; E137-Y139 PolarHBondContact OE2-OH 3.41Å; Y139-G141 VanDerWaalsContact C-N 3.31Å; Y139-G141 PolarHBondContact O-N 2.02Å | ||
| 140 | F | 83.3 | Confident | 81.1 | Confident | 71 Ų | 71 | 52.2 Ų | 52.2 | 31% | 0.311 | 26% | 0.263 | S | S | . | . | S | Bend | trans | -87.5 | 7.2 | -163.3 | -54.8 | -84.5 | 0 | 0 | 0 | 114.8 | V128 I131 W138 Y144 | V128-F140 HydrophobicContact CB-CE2 4.5Å; V128-F140 HydrophobicContact CG1-CD2 3.63Å; V128-F140 HydrophobicContact CG1-CE2 3.49Å; V128-F140 VanDerWaalsContact CG1-CE2 3.49Å; V128-F140 HydrophobicContact CG1-CG 4.25Å; V128-F140 HydrophobicContact CG1-CZ 3.97Å; V128-F140 HydrophobicContact CG2-CE1 4.29Å; V128-F140 HydrophobicContact CG2-CZ 4.21Å; I131-F140 HydrophobicContact CB-CZ 4.38Å; I131-F140 HydrophobicContact CD1-CZ 4.17Å; I131-F140 HydrophobicContact CG2-CE2 4.25Å; I131-F140 HydrophobicContact CG2-CZ 4.02Å; W138-F140 HydrophobicContact CH2-CD2 4.35Å; W138-F140 HydrophobicContact CZ2-CB 3.82Å; W138-F140 HydrophobicContact CZ2-CD2 4.33Å; W138-F140 HydrophobicContact CZ3-CD2 4.48Å; F140-Y144 HydrophobicContact CB-CD1 3.75Å; F140-Y144 HydrophobicContact CB-CG 3.78Å; F140-Y144 HydrophobicContact CG-CD1 4.15Å; F140-Y144 WeakPolarHBondContact O-CB 3.46Å |
| 141 | G | 87.6 | Confident | 81.8 | Confident | 35 Ų | 35 | 51.4 Ų | 51.4 | 36% | 0.361 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | 71.3 | 178.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | W138 Y139 C145 | W138-G141 PolarHBondContact NE1-O 3.21Å; Y139-G141 VanDerWaalsContact C-N 3.31Å; Y139-G141 PolarHBondContact O-N 2.02Å; G141-C145 PolarHBondContact O-N 3.46Å |
| 142 | A | 86.9 | Confident | 82.3 | Confident | 38 Ų | 38 | 50.3 Ų | 50.3 | 31% | 0.314 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -69.8 | -36.8 | -173.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | C145 R146 I211 | A142-C145 WeakPolarHBondContact O-CB 3.19Å; A142-C145 PolarHBondContact O-N 2.95Å; A142-R146 PolarHBondContact O-N 2.85Å; A142-R146 VanDerWaalsContact O-N 3.15Å; A142-I211 HydrophobicContact CB-CD1 3.98Å; A142-I211 HydrophobicContact CB-CG1 4.2Å; A142-I211 HydrophobicContact CB-CG2 4.33Å |
| 143 | N | 89.5 | Confident | 83 | Confident | 132 Ų | 132 | 51.5 Ų | 51.5 | 71% | 0.706 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -65.5 | -43.6 | -178.3 | -68.2 | -11.3 | 0 | 0 | 0 | 111.3 | C145 R146 F147 | N143-C145 VanDerWaalsContact C-N 3.31Å; N143-C145 PolarHBondContact O-N 3.12Å; N143-R146 PolarHBondContact O-N 2.89Å; N143-F147 PolarHBondContact O-N 3.27Å; N143-F147 VanDerWaalsContact O-N 3.11Å |
| 144 | Y | 88.4 | Confident | 84.1 | Confident | 57 Ų | 57 | 50.1 Ų | 50.1 | 22% | 0.224 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -70.1 | -30.1 | 176.6 | -156.2 | -87.7 | 0 | 0 | 0 | 111.7 | F124 V128 W138 F140 R146 F147 Q148 | F124-Y144 PolarHBondContact O-OH 3.31Å; V128-Y144 HydrophobicContact CB-CE1 3.88Å; V128-Y144 HydrophobicContact CG1-CD1 4.18Å; V128-Y144 HydrophobicContact CG1-CE1 3.62Å; V128-Y144 HydrophobicContact CG2-CE1 3.64Å; V128-Y144 WeakPolarHBondContact CG2-OH 3.34Å; W138-Y144 AromaticContact CH2-CD1 3.91Å; W138-Y144 HydrophobicContact CH2-CD1 3.91Å; W138-Y144 AromaticContact CZ2-CD1 3.88Å; W138-Y144 HydrophobicContact CZ2-CD1 3.88Å; F140-Y144 HydrophobicContact CB-CD1 3.75Å; F140-Y144 HydrophobicContact CB-CG 3.78Å; F140-Y144 HydrophobicContact CG-CD1 4.15Å; F140-Y144 WeakPolarHBondContact O-CB 3.46Å; Y144-R146 VanDerWaalsContact C-N 3.34Å; Y144-R146 PolarHBondContact O-N 3.02Å; Y144-F147 HydrophobicContact CD2-CD1 4.38Å; Y144-F147 HydrophobicContact CE2-CD1 4.01Å; Y144-F147 HydrophobicContact CE2-CE1 4.44Å; Y144-F147 PolarHBondContact O-N 3.08Å; Y144-Q148 HydrophobicContact CD1-CB 4.3Å; Y144-Q148 HydrophobicContact CE1-CB 4.36Å; Y144-Q148 WeakPolarHBondContact O-CB 3.39Å; Y144-Q148 PolarHBondContact O-N 3.23Å |
| 145 | C | 87.1 | Confident | 85.3 | Confident | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -60.5 | -44.7 | 174.2 | 168.5 | 0 | 0 | 0 | 0 | 111.1 | W138 G141 A142 N143 Q148 N149 I211 C220 | W138-C145 HydrophobicContact CZ2-CB 3.78Å; G141-C145 PolarHBondContact O-N 3.46Å; A142-C145 WeakPolarHBondContact O-CB 3.19Å; A142-C145 PolarHBondContact O-N 2.95Å; N143-C145 VanDerWaalsContact C-N 3.31Å; N143-C145 PolarHBondContact O-N 3.12Å; C145-Q148 PolarHBondContact O-N 3.47Å; C145-N149 PolarHBondContact O-N 3.25Å; C145-N149 PolarHBondContact O-ND2 3.06Å; C145-I211 HydrophobicContact CB-CG2 3.89Å; C145-C220 WeakPolarHBondContact CA-SG 3.48Å; C145-C220 HydrophobicContact CB-CB 3.86Å; C145-C220 WeakPolarHBondContact CB-SG 3.35Å; C145-C220 WeakPolarHBondContact SG-CB 3.45Å; C145-C220 CovalentContact SG-SG 2.02Å; C145-C220 PolarHBondContact SG-SG 3.34Å |
| 146 | R | 88.4 | Confident | 86.3 | Confident | 100 Ų | 100 | 42 Ų | 42 | 38% | 0.377 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -61.3 | -46.2 | 173.4 | -62.4 | -177.5 | -174.6 | 166.5 | 6.6 | 112 | A142 N143 Y144 Q148 F150 | A142-R146 PolarHBondContact O-N 2.85Å; A142-R146 VanDerWaalsContact O-N 3.15Å; N143-R146 PolarHBondContact O-N 2.89Å; Y144-R146 VanDerWaalsContact C-N 3.34Å; Y144-R146 PolarHBondContact O-N 3.02Å; R146-Q148 PolarHBondContact O-N 2.92Å; R146-F150 WeakPolarHBondContact O-CB 2.91Å; R146-F150 PolarHBondContact O-N 3.03Å; R146-F150 VanDerWaalsContact O-N 3.13Å |
| 147 | F | 89.1 | Confident | 87.6 | Confident | 70 Ų | 70 | 40.3 Ų | 40.3 | 31% | 0.307 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -62.6 | -41.5 | 178.7 | -179.5 | -100.8 | 0 | 0 | 0 | 112.5 | F124 N143 Y144 N149 F150 F151 | F124-F147 HydrophobicContact CB-CE1 3.97Å; F124-F147 HydrophobicContact CG-CE1 4.41Å; N143-F147 PolarHBondContact O-N 3.27Å; N143-F147 VanDerWaalsContact O-N 3.11Å; Y144-F147 HydrophobicContact CD2-CD1 4.38Å; Y144-F147 HydrophobicContact CE2-CD1 4.01Å; Y144-F147 HydrophobicContact CE2-CE1 4.44Å; Y144-F147 PolarHBondContact O-N 3.08Å; F147-N149 PolarHBondContact O-N 3.29Å; F147-F150 PolarHBondContact O-N 3.25Å; F147-F151 HydrophobicContact CD1-CB 4.46Å; F147-F151 HydrophobicContact CD2-CB 4.34Å; F147-F151 HydrophobicContact CE1-CB 4.1Å; F147-F151 HydrophobicContact CE1-CD1 4.49Å; F147-F151 HydrophobicContact CE1-CG 4.16Å; F147-F151 HydrophobicContact CE2-CB 3.97Å; F147-F151 AromaticContact CE2-CD2 3.72Å; F147-F151 HydrophobicContact CE2-CD2 3.72Å; F147-F151 HydrophobicContact CE2-CE2 4.49Å; F147-F151 AromaticContact CE2-CG 3.96Å; F147-F151 HydrophobicContact CE2-CG 3.96Å; F147-F151 HydrophobicContact CZ-CB 3.84Å; F147-F151 HydrophobicContact CZ-CD1 4.15Å; F147-F151 AromaticContact CZ-CD2 3.65Å; F147-F151 HydrophobicContact CZ-CD2 3.65Å; F147-F151 HydrophobicContact CZ-CE2 4.26Å; F147-F151 AromaticContact CZ-CG 3.6Å; F147-F151 HydrophobicContact CZ-CG 3.6Å; F147-F151 VanDerWaalsContact O-CB 3.24Å; F147-F151 WeakPolarHBondContact O-CB 3.42Å; F147-F151 PolarHBondContact O-N 3.1Å |
| 148 | Q | 85.4 | Confident | 88.6 | Confident | 6 Ų | 6 | 37.5 Ų | 37.5 | 3% | 0.028 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -63.8 | -36.3 | -177.4 | -178.1 | 70.6 | -2 | 0 | 0 | 112.9 | F124 N125 N129 W138 Y144 C145 R146 P152 | F124-Q148 PolarHBondContact O-OE1 3.4Å; N125-Q148 PolarHBondContact ND2-NE2 3.4Å; N125-Q148 PolarHBondContact ND2-O 3.49Å; N125-Q148 PolarHBondContact ND2-OE1 2.91Å; N125-Q148 PolarHBondContact O-NE2 3.42Å; N129-Q148 PolarHBondContact ND2-NE2 3.17Å; N129-Q148 VanDerWaalsContact ND2-NE2 3.13Å; N129-Q148 PolarHBondContact OD1-NE2 3.13Å; W138-Q148 HydrophobicContact CH2-CB 3.76Å; W138-Q148 HydrophobicContact CH2-CG 3.78Å; W138-Q148 HydrophobicContact CZ3-CG 4.18Å; Y144-Q148 HydrophobicContact CD1-CB 4.3Å; Y144-Q148 HydrophobicContact CE1-CB 4.36Å; Y144-Q148 WeakPolarHBondContact O-CB 3.39Å; Y144-Q148 PolarHBondContact O-N 3.23Å; C145-Q148 PolarHBondContact O-N 3.47Å; R146-Q148 PolarHBondContact O-N 2.92Å; Q148-P152 WeakPolarHBondContact O-CD 3.34Å; Q148-P152 WeakPolarHBondContact O-CG 3.26Å |
| 149 | N | 85.6 | Confident | 89.3 | Confident | 28 Ų | 28 | 37.2 Ų | 37.2 | 15% | 0.15 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -83.7 | -28.4 | 177 | -69.3 | -47.4 | 0 | 0 | 0 | 112.7 | C145 F147 S209 C220 V222 | C145-N149 PolarHBondContact O-N 3.25Å; C145-N149 PolarHBondContact O-ND2 3.06Å; F147-N149 PolarHBondContact O-N 3.29Å; N149-S209 WeakPolarHBondContact CB-OG 3.32Å; N149-S209 PolarHBondContact ND2-OG 3.17Å; N149-C220 PolarHBondContact ND2-SG 3.11Å; N149-C220 VanDerWaalsContact ND2-SG 3.41Å; N149-V222 HydrophobicContact CB-CG2 4.21Å |
| 150 | F | 88.8 | Confident | 89.9 | Confident | 32 Ų | 32 | 31.5 Ų | 31.5 | 14% | 0.14 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -76.6 | -53.5 | 179.6 | 169.2 | -103.1 | 0 | 0 | 0 | 112.9 | R146 F147 P152 I153 T154 F199 A202 C206 | R146-F150 WeakPolarHBondContact O-CB 2.91Å; R146-F150 PolarHBondContact O-N 3.03Å; R146-F150 VanDerWaalsContact O-N 3.13Å; F147-F150 PolarHBondContact O-N 3.25Å; F150-P152 VanDerWaalsContact C-CD 3.47Å; F150-I153 PolarHBondContact O-N 2.96Å; F150-T154 PolarHBondContact O-N 2.64Å; F150-T154 PolarHBondContact O-OG1 3.42Å; F150-F199 AromaticContact CE1-CD1 3.73Å; F150-F199 HydrophobicContact CE1-CD1 3.73Å; F150-F199 AromaticContact CE1-CE1 3.72Å; F150-F199 HydrophobicContact CE1-CE1 3.72Å; F150-F199 HydrophobicContact CE2-CD1 4.05Å; F150-F199 HydrophobicContact CZ-CB 4.44Å; F150-F199 AromaticContact CZ-CD1 3.16Å; F150-F199 HydrophobicContact CZ-CD1 3.16Å; F150-F199 AromaticContact CZ-CE1 3.64Å; F150-F199 HydrophobicContact CZ-CE1 3.64Å; F150-F199 HydrophobicContact CZ-CG 4.17Å; F150-A202 HydrophobicContact CD2-CB 3.39Å; F150-A202 WeakPolarHBondContact CD2-O 3.23Å; F150-A202 HydrophobicContact CE2-CB 3.65Å; F150-A202 HydrophobicContact CG-CB 4.19Å; F150-A202 WeakPolarHBondContact O-CB 3.04Å; F150-C206 HydrophobicContact CB-CB 4.04Å; F150-C206 HydrophobicContact CD2-CB 3.85Å; F150-C206 HydrophobicContact CG-CB 4.22Å |
| 151 | F | 90.5 | Very high | 90.4 | Very high | 20 Ų | 20 | 30 Ų | 30 | 9% | 0.088 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -62.4 | -38.1 | -166.3 | -169.7 | -104.6 | 0 | 0 | 0 | 114.9 | S120 F124 F147 I153 T154 A155 | S120-F151 VanDerWaalsContact CB-CZ 3.48Å; F124-F151 HydrophobicContact CD2-CE1 4.32Å; F147-F151 HydrophobicContact CD1-CB 4.46Å; F147-F151 HydrophobicContact CD2-CB 4.34Å; F147-F151 HydrophobicContact CE1-CB 4.1Å; F147-F151 HydrophobicContact CE1-CD1 4.49Å; F147-F151 HydrophobicContact CE1-CG 4.16Å; F147-F151 HydrophobicContact CE2-CB 3.97Å; F147-F151 AromaticContact CE2-CD2 3.72Å; F147-F151 HydrophobicContact CE2-CD2 3.72Å; F147-F151 HydrophobicContact CE2-CE2 4.49Å; F147-F151 AromaticContact CE2-CG 3.96Å; F147-F151 HydrophobicContact CE2-CG 3.96Å; F147-F151 HydrophobicContact CZ-CB 3.84Å; F147-F151 HydrophobicContact CZ-CD1 4.15Å; F147-F151 AromaticContact CZ-CD2 3.65Å; F147-F151 HydrophobicContact CZ-CD2 3.65Å; F147-F151 HydrophobicContact CZ-CE2 4.26Å; F147-F151 AromaticContact CZ-CG 3.6Å; F147-F151 HydrophobicContact CZ-CG 3.6Å; F147-F151 VanDerWaalsContact O-CB 3.24Å; F147-F151 WeakPolarHBondContact O-CB 3.42Å; F147-F151 PolarHBondContact O-N 3.1Å; F151-I153 VanDerWaalsContact C-N 3.34Å; F151-I153 PolarHBondContact O-N 3.23Å; F151-T154 PolarHBondContact O-N 2.81Å; F151-A155 HydrophobicContact CE1-CB 4.25Å; F151-A155 WeakPolarHBondContact O-CB 3.2Å; F151-A155 PolarHBondContact O-N 2.94Å |
| 152 | P | 88.4 | Confident | 90.7 | Very high | 25 Ų | 25 | 28.4 Ų | 28.4 | 16% | 0.162 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -62.1 | -41.5 | 179.1 | -25.6 | 37.7 | 0 | 0 | 0 | 112.4 | N125 Q148 F150 T154 A155 V156 | N125-P152 HydrophobicContact CB-CG 4Å; N125-P152 WeakPolarHBondContact ND2-CG 3.29Å; Q148-P152 WeakPolarHBondContact O-CD 3.34Å; Q148-P152 WeakPolarHBondContact O-CG 3.26Å; F150-P152 VanDerWaalsContact C-CD 3.47Å; P152-T154 VanDerWaalsContact C-N 3.33Å; P152-T154 PolarHBondContact O-N 3.02Å; P152-A155 PolarHBondContact O-N 3.33Å; P152-V156 WeakPolarHBondContact O-CB 3.43Å; P152-V156 WeakPolarHBondContact O-CG2 3.09Å; P152-V156 PolarHBondContact O-N 3.45Å |
| 153 | I | 90.1 | Very high | 91 | Very high | 30 Ų | 30 | 27.1 Ų | 27.1 | 15% | 0.154 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -63.7 | -45.3 | 179.4 | -60.4 | 172.7 | 0 | 0 | 0 | 109.3 | F150 F151 A155 F157 L201 A202 Q205 Y234 | F150-I153 PolarHBondContact O-N 2.96Å; F151-I153 VanDerWaalsContact C-N 3.34Å; F151-I153 PolarHBondContact O-N 3.23Å; I153-A155 PolarHBondContact O-N 2.9Å; I153-F157 VanDerWaalsContact O-CB 3.24Å; I153-F157 WeakPolarHBondContact O-CB 3.41Å; I153-F157 PolarHBondContact O-N 3.11Å; I153-L201 HydrophobicContact CG2-CD2 4.28Å; I153-L201 HydrophobicContact CG2-CG 4.28Å; I153-A202 HydrophobicContact CB-CB 3.98Å; I153-A202 HydrophobicContact CG2-CB 4.02Å; I153-Q205 HydrophobicContact CD1-CB 4.17Å; I153-Q205 HydrophobicContact CD1-CG 3.61Å; I153-Y234 HydrophobicContact CD1-CE1 4.35Å |
| 154 | T | 93.1 | Very high | 91.2 | Very high | 0 Ų | 0 | 21.3 Ų | 21.3 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -60.1 | -47.3 | 175.9 | -55.5 | 0 | 0 | 0 | 0 | 111.6 | F150 F151 P152 F157 A158 W195 A198 F199 A202 | F150-T154 PolarHBondContact O-N 2.64Å; F150-T154 PolarHBondContact O-OG1 3.42Å; F151-T154 PolarHBondContact O-N 2.81Å; P152-T154 VanDerWaalsContact C-N 3.33Å; P152-T154 PolarHBondContact O-N 3.02Å; T154-F157 PolarHBondContact O-N 2.86Å; T154-A158 WeakPolarHBondContact O-CB 3.29Å; T154-A158 PolarHBondContact O-N 3.4Å; T154-W195 HydrophobicContact CG2-CE3 3.75Å; T154-W195 HydrophobicContact CG2-CZ3 3.61Å; T154-A198 HydrophobicContact CG2-CB 3.66Å; T154-A198 PolarHBondContact OG1-O 3.44Å; T154-F199 HydrophobicContact CG2-CD1 3.54Å; T154-F199 HydrophobicContact CG2-CE1 3.61Å; T154-F199 HydrophobicContact CG2-CG 4.33Å; T154-F199 HydrophobicContact CG2-CZ 4.36Å; T154-A202 WeakPolarHBondContact OG1-CB 3.14Å |
| 155 | A | 93.4 | Very high | 91.4 | Very high | 0 Ų | 0 | 19.4 Ų | 19.4 | 0% | 0 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -66.6 | -46.3 | -175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | S117 M121 F151 P152 I153 F157 A158 S159 | S117-A155 VanDerWaalsContact OG-C 3.25Å; S117-A155 WeakPolarHBondContact OG-CA 3.5Å; S117-A155 WeakPolarHBondContact OG-CB 3.36Å; S117-A155 PolarHBondContact OG-O 3.2Å; M121-A155 HydrophobicContact CB-CB 3.8Å; M121-A155 HydrophobicContact CG-CB 4.17Å; M121-A155 HydrophobicContact SD-CB 4.07Å; F151-A155 HydrophobicContact CE1-CB 4.25Å; F151-A155 WeakPolarHBondContact O-CB 3.2Å; F151-A155 PolarHBondContact O-N 2.94Å; P152-A155 PolarHBondContact O-N 3.33Å; I153-A155 PolarHBondContact O-N 2.9Å; A155-F157 PolarHBondContact O-N 3.31Å; A155-A158 PolarHBondContact O-N 2.85Å; A155-S159 WeakPolarHBondContact O-CB 3.16Å; A155-S159 PolarHBondContact O-N 3.45Å; A155-S159 PolarHBondContact O-OG 3.44Å; A155-S159 VanDerWaalsContact O-OG 3.08Å |
| 156 | V | 92.4 | Very high | 91.6 | Very high | 6 Ų | 6 | 20 Ų | 20 | 4% | 0.036 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -64.3 | -42.5 | 178.4 | -178.6 | 0 | 0 | 0 | 0 | 110.7 | M121 P152 A158 S159 I160 V242 F295 W299 | M121-V156 HydrophobicContact CE-CG2 4.16Å; M121-V156 HydrophobicContact SD-CG2 3.52Å; M121-V156 VanDerWaalsContact SD-CG2 3.52Å; P152-V156 WeakPolarHBondContact O-CB 3.43Å; P152-V156 WeakPolarHBondContact O-CG2 3.09Å; P152-V156 PolarHBondContact O-N 3.45Å; V156-A158 PolarHBondContact O-N 3Å; V156-S159 PolarHBondContact O-N 2.79Å; V156-I160 WeakPolarHBondContact O-CG2 3.42Å; V156-I160 PolarHBondContact O-N 3.04Å; V156-V242 HydrophobicContact CB-CG1 4.13Å; V156-V242 HydrophobicContact CG1-CG1 3.39Å; V156-F295 HydrophobicContact CG1-CE2 4.47Å; V156-F295 HydrophobicContact CG1-CZ 4.32Å; V156-W299 HydrophobicContact CB-CH2 4.27Å; V156-W299 HydrophobicContact CB-CZ2 4.36Å; V156-W299 HydrophobicContact CG1-CH2 3.96Å; V156-W299 HydrophobicContact CG1-CZ2 3.84Å; V156-W299 HydrophobicContact CG1-CZ3 4.31Å; V156-W299 HydrophobicContact CG2-CH2 3.25Å; V156-W299 HydrophobicContact CG2-CZ2 3.46Å; V156-W299 VanDerWaalsContact CG2-CZ2 3.46Å; V156-W299 HydrophobicContact CG2-CZ3 4.15Å |
| 157 | F | 94.9 | Very high | 91.6 | Very high | 8 Ų | 8 | 15.3 Ų | 15.3 | 4% | 0.035 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -58.7 | -48.5 | 174.3 | -172.3 | -76.1 | 0 | 0 | 0 | 110.8 | I153 T154 A155 S159 I160 Y161 I194 L197 A198 L201 V242 | I153-F157 VanDerWaalsContact O-CB 3.24Å; I153-F157 WeakPolarHBondContact O-CB 3.41Å; I153-F157 PolarHBondContact O-N 3.11Å; T154-F157 PolarHBondContact O-N 2.86Å; A155-F157 PolarHBondContact O-N 3.31Å; F157-S159 VanDerWaalsContact C-N 3.31Å; F157-S159 PolarHBondContact O-N 2.86Å; F157-I160 WeakPolarHBondContact O-CG2 3.4Å; F157-I160 PolarHBondContact O-N 2.96Å; F157-Y161 AromaticContact CD1-CD2 3.65Å; F157-Y161 HydrophobicContact CD1-CD2 3.65Å; F157-Y161 HydrophobicContact CD1-CE2 4.05Å; F157-Y161 HydrophobicContact CD1-CG 4.28Å; F157-Y161 AromaticContact CD2-CD2 3.98Å; F157-Y161 HydrophobicContact CD2-CD2 3.98Å; F157-Y161 AromaticContact CD2-CE2 3.61Å; F157-Y161 HydrophobicContact CD2-CE2 3.61Å; F157-Y161 HydrophobicContact CE1-CD1 4.44Å; F157-Y161 AromaticContact CE1-CD2 3.51Å; F157-Y161 HydrophobicContact CE1-CD2 3.51Å; F157-Y161 AromaticContact CE1-CE2 3.7Å; F157-Y161 HydrophobicContact CE1-CE2 3.7Å; F157-Y161 AromaticContact CE1-CG 3.91Å; F157-Y161 HydrophobicContact CE1-CG 3.91Å; F157-Y161 AromaticContact CE2-CD2 3.85Å; F157-Y161 HydrophobicContact CE2-CD2 3.85Å; F157-Y161 AromaticContact CE2-CE2 3.2Å; F157-Y161 HydrophobicContact CE2-CE2 3.2Å; F157-Y161 AromaticContact CE2-CZ 3.71Å; F157-Y161 AromaticContact CG-CD2 3.89Å; F157-Y161 HydrophobicContact CG-CD2 3.89Å; F157-Y161 HydrophobicContact CG-CE2 4.03Å; F157-Y161 HydrophobicContact CZ-CD1 4.45Å; F157-Y161 AromaticContact CZ-CD2 3.62Å; F157-Y161 HydrophobicContact CZ-CD2 3.62Å; F157-Y161 HydrophobicContact CZ-CE1 4.14Å; F157-Y161 AromaticContact CZ-CE2 3.25Å; F157-Y161 HydrophobicContact CZ-CE2 3.25Å; F157-Y161 HydrophobicContact CZ-CG 4.2Å; F157-Y161 AromaticContact CZ-CZ 3.53Å; F157-Y161 WeakPolarHBondContact O-CB 3.36Å; F157-Y161 VanDerWaalsContact O-CD2 3.31Å; F157-Y161 WeakPolarHBondContact O-CD2 3.36Å; F157-Y161 PolarHBondContact O-N 3.49Å; F157-I194 HydrophobicContact CD1-CG2 4.26Å; F157-I194 HydrophobicContact CE1-CG2 4.37Å; F157-L197 HydrophobicContact CE1-CB 3.87Å; F157-L197 HydrophobicContact CZ-CB 3.9Å; F157-A198 HydrophobicContact CB-CB 3.96Å; F157-A198 HydrophobicContact CD1-CB 3.53Å; F157-A198 HydrophobicContact CE1-CB 4.28Å; F157-A198 HydrophobicContact CG-CB 3.94Å; F157-L201 HydrophobicContact CD2-CD2 3.56Å; F157-L201 HydrophobicContact CE2-CD2 3.93Å; F157-V242 HydrophobicContact CB-CG2 4.35Å; F157-V242 HydrophobicContact CD2-CG2 3.92Å |
| 158 | A | 95.6 | Very high | 91.7 | Very high | 0 Ų | 0 | 14.5 Ų | 14.5 | 0% | 0 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -61.6 | -39.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | T154 A155 V156 S162 I194 W195 | T154-A158 WeakPolarHBondContact O-CB 3.29Å; T154-A158 PolarHBondContact O-N 3.4Å; A155-A158 PolarHBondContact O-N 2.85Å; V156-A158 PolarHBondContact O-N 3Å; A158-S162 VanDerWaalsContact O-CB 3.3Å; A158-S162 WeakPolarHBondContact O-CB 3.48Å; A158-S162 PolarHBondContact O-N 2.96Å; A158-S162 VanDerWaalsContact O-N 3.1Å; A158-S162 PolarHBondContact O-OG 2.77Å; A158-I194 HydrophobicContact CB-CG2 4.11Å; A158-W195 HydrophobicContact CB-CD2 4.48Å; A158-W195 HydrophobicContact CB-CZ2 4.14Å |
| 159 | S | 94.1 | Very high | 91.8 | Very high | 4 Ų | 4 | 14.2 Ų | 14.2 | 3% | 0.028 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -65.1 | -52.3 | 177.5 | -67.1 | 0 | 0 | 0 | 0 | 111.8 | L114 S117 D118 A155 V156 F157 Y161 S162 M163 | L114-S159 VanDerWaalsContact CD1-CB 3.43Å; S117-S159 WeakPolarHBondContact CB-OG 3.34Å; S117-S159 PolarHBondContact OG-OG 3.15Å; D118-S159 WeakPolarHBondContact OD1-CB 3.31Å; D118-S159 PolarHBondContact OD1-OG 3.34Å; A155-S159 WeakPolarHBondContact O-CB 3.16Å; A155-S159 PolarHBondContact O-N 3.45Å; A155-S159 PolarHBondContact O-OG 3.44Å; A155-S159 VanDerWaalsContact O-OG 3.08Å; V156-S159 PolarHBondContact O-N 2.79Å; F157-S159 VanDerWaalsContact C-N 3.31Å; F157-S159 PolarHBondContact O-N 2.86Å; S159-Y161 PolarHBondContact O-N 3.32Å; S159-S162 WeakPolarHBondContact O-CB 3.49Å; S159-S162 PolarHBondContact O-N 3.41Å; S159-M163 PolarHBondContact O-N 2.92Å |
| 160 | I | 94.6 | Very high | 91.8 | Very high | 0 Ų | 0 | 15.4 Ų | 15.4 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -70 | -36.5 | -174.6 | -165.4 | 55.5 | 0 | 0 | 0 | 113.1 | V156 F157 S162 M163 T164 V242 P246 M250 F295 | V156-I160 WeakPolarHBondContact O-CG2 3.42Å; V156-I160 PolarHBondContact O-N 3.04Å; F157-I160 WeakPolarHBondContact O-CG2 3.4Å; F157-I160 PolarHBondContact O-N 2.96Å; I160-S162 VanDerWaalsContact C-N 3.34Å; I160-M163 HydrophobicContact CD1-CE 4.44Å; I160-M163 HydrophobicContact CD1-SD 4.34Å; I160-M163 WeakPolarHBondContact O-CB 3.2Å; I160-M163 PolarHBondContact O-N 3.29Å; I160-T164 PolarHBondContact O-N 3.49Å; I160-T164 PolarHBondContact O-OG1 2.93Å; I160-V242 HydrophobicContact CG2-CG1 4.46Å; I160-P246 HydrophobicContact CD1-CB 4.5Å; I160-P246 HydrophobicContact CG1-CB 3.65Å; I160-P246 HydrophobicContact CG1-CG 3.59Å; I160-P246 HydrophobicContact CG2-CB 4.49Å; I160-P246 HydrophobicContact CG2-CG 4.13Å; I160-M250 HydrophobicContact CD1-CE 3.38Å; I160-M250 HydrophobicContact CD1-SD 4.45Å; I160-M250 HydrophobicContact CG1-CE 4.31Å; I160-F295 HydrophobicContact CB-CE1 4.43Å; I160-F295 HydrophobicContact CB-CE2 4.32Å; I160-F295 HydrophobicContact CB-CZ 3.9Å; I160-F295 HydrophobicContact CD1-CD1 3.49Å; I160-F295 VanDerWaalsContact CD1-CD1 3.49Å; I160-F295 HydrophobicContact CD1-CD2 4.11Å; I160-F295 HydrophobicContact CD1-CE1 3.29Å; I160-F295 HydrophobicContact CD1-CE2 3.93Å; I160-F295 HydrophobicContact CD1-CG 3.91Å; I160-F295 HydrophobicContact CD1-CZ 3.53Å; I160-F295 HydrophobicContact CG1-CD1 4.43Å; I160-F295 HydrophobicContact CG1-CE1 3.75Å; I160-F295 HydrophobicContact CG1-CE2 4.41Å; I160-F295 HydrophobicContact CG1-CZ 3.74Å |
| 161 | Y | 95.4 | Very high | 91.7 | Very high | 40 Ų | 40 | 16.8 Ų | 16.8 | 16% | 0.157 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -72.3 | -29.3 | 174.6 | -82.4 | -96.6 | 0 | 0 | 0 | 112.1 | F157 S159 T164 A165 L241 F245 | F157-Y161 AromaticContact CD1-CD2 3.65Å; F157-Y161 HydrophobicContact CD1-CD2 3.65Å; F157-Y161 HydrophobicContact CD1-CE2 4.05Å; F157-Y161 HydrophobicContact CD1-CG 4.28Å; F157-Y161 AromaticContact CD2-CD2 3.98Å; F157-Y161 HydrophobicContact CD2-CD2 3.98Å; F157-Y161 AromaticContact CD2-CE2 3.61Å; F157-Y161 HydrophobicContact CD2-CE2 3.61Å; F157-Y161 HydrophobicContact CE1-CD1 4.44Å; F157-Y161 AromaticContact CE1-CD2 3.51Å; F157-Y161 HydrophobicContact CE1-CD2 3.51Å; F157-Y161 AromaticContact CE1-CE2 3.7Å; F157-Y161 HydrophobicContact CE1-CE2 3.7Å; F157-Y161 AromaticContact CE1-CG 3.91Å; F157-Y161 HydrophobicContact CE1-CG 3.91Å; F157-Y161 AromaticContact CE2-CD2 3.85Å; F157-Y161 HydrophobicContact CE2-CD2 3.85Å; F157-Y161 AromaticContact CE2-CE2 3.2Å; F157-Y161 HydrophobicContact CE2-CE2 3.2Å; F157-Y161 AromaticContact CE2-CZ 3.71Å; F157-Y161 AromaticContact CG-CD2 3.89Å; F157-Y161 HydrophobicContact CG-CD2 3.89Å; F157-Y161 HydrophobicContact CG-CE2 4.03Å; F157-Y161 HydrophobicContact CZ-CD1 4.45Å; F157-Y161 AromaticContact CZ-CD2 3.62Å; F157-Y161 HydrophobicContact CZ-CD2 3.62Å; F157-Y161 HydrophobicContact CZ-CE1 4.14Å; F157-Y161 AromaticContact CZ-CE2 3.25Å; F157-Y161 HydrophobicContact CZ-CE2 3.25Å; F157-Y161 HydrophobicContact CZ-CG 4.2Å; F157-Y161 AromaticContact CZ-CZ 3.53Å; F157-Y161 WeakPolarHBondContact O-CB 3.36Å; F157-Y161 VanDerWaalsContact O-CD2 3.31Å; F157-Y161 WeakPolarHBondContact O-CD2 3.36Å; F157-Y161 PolarHBondContact O-N 3.49Å; S159-Y161 PolarHBondContact O-N 3.32Å; Y161-T164 PolarHBondContact O-N 3.41Å; Y161-A165 WeakPolarHBondContact O-CB 3.22Å; Y161-A165 PolarHBondContact O-N 3.39Å; Y161-L241 WeakPolarHBondContact CE2-O 3.3Å; Y161-L241 PolarHBondContact OH-O 3.41Å; Y161-F245 HydrophobicContact CE1-CE1 4.45Å |
| 162 | S | 94.3 | Very high | 91.5 | Very high | 0 Ų | 0 | 18 Ų | 18 | 0% | 0 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -64.8 | -43.8 | 169.2 | -60.6 | 0 | 0 | 0 | 0 | 111.3 | N113 A158 S159 I160 T164 A165 I166 | N113-S162 PolarHBondContact ND2-OG 3.4Å; A158-S162 VanDerWaalsContact O-CB 3.3Å; A158-S162 WeakPolarHBondContact O-CB 3.48Å; A158-S162 PolarHBondContact O-N 2.96Å; A158-S162 VanDerWaalsContact O-N 3.1Å; A158-S162 PolarHBondContact O-OG 2.77Å; S159-S162 WeakPolarHBondContact O-CB 3.49Å; S159-S162 PolarHBondContact O-N 3.41Å; I160-S162 VanDerWaalsContact C-N 3.34Å; S162-T164 VanDerWaalsContact C-N 3.31Å; S162-T164 PolarHBondContact O-N 2.76Å; S162-A165 PolarHBondContact O-N 3.41Å; S162-I166 WeakPolarHBondContact O-CD1 3.3Å; S162-I166 WeakPolarHBondContact O-CG1 3.39Å; S162-I166 PolarHBondContact O-N 2.91Å |
| 163 | M | 91.6 | Very high | 91.3 | Very high | 11 Ų | 11 | 18 Ų | 18 | 5% | 0.054 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -60.7 | -40.5 | 173.7 | -72 | 179.3 | 50.1 | 0 | 0 | 112.2 | L114 S159 I160 I166 A167 M250 V291 V292 F295 | L114-M163 HydrophobicContact CD1-CG 4.25Å; L114-M163 HydrophobicContact CD2-CG 4.02Å; S159-M163 PolarHBondContact O-N 2.92Å; I160-M163 HydrophobicContact CD1-CE 4.44Å; I160-M163 HydrophobicContact CD1-SD 4.34Å; I160-M163 WeakPolarHBondContact O-CB 3.2Å; I160-M163 PolarHBondContact O-N 3.29Å; M163-I166 PolarHBondContact O-N 3.41Å; M163-A167 PolarHBondContact O-N 3.21Å; M163-M250 HydrophobicContact CB-SD 3.89Å; M163-M250 HydrophobicContact CE-CE 4.47Å; M163-M250 HydrophobicContact CE-SD 4.24Å; M163-V291 HydrophobicContact CE-CB 4.26Å; M163-V291 HydrophobicContact CE-CG1 3.4Å; M163-V291 HydrophobicContact SD-CG1 3.96Å; M163-V292 HydrophobicContact CE-CG2 4.3Å; M163-F295 HydrophobicContact CE-CB 4.22Å |
| 164 | T | 94 | Very high | 91 | Very high | 10 Ų | 10 | 18 Ų | 18 | 6% | 0.061 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -64.2 | -44.2 | 176.3 | -55.3 | 0 | 0 | 0 | 0 | 111.3 | I160 Y161 S162 I166 A167 V168 P246 I249 M250 | I160-T164 PolarHBondContact O-N 3.49Å; I160-T164 PolarHBondContact O-OG1 2.93Å; Y161-T164 PolarHBondContact O-N 3.41Å; S162-T164 VanDerWaalsContact C-N 3.31Å; S162-T164 PolarHBondContact O-N 2.76Å; T164-I166 VanDerWaalsContact C-N 3.3Å; T164-I166 PolarHBondContact O-N 3.24Å; T164-A167 VanDerWaalsContact O-CB 3.27Å; T164-A167 WeakPolarHBondContact O-CB 3.41Å; T164-A167 PolarHBondContact O-N 3.25Å; T164-A167 VanDerWaalsContact O-N 3.11Å; T164-V168 WeakPolarHBondContact O-CG2 3.16Å; T164-V168 PolarHBondContact O-N 3.47Å; T164-P246 WeakPolarHBondContact OG1-CB 3.44Å; T164-I249 HydrophobicContact CG2-CB 3.98Å; T164-I249 HydrophobicContact CG2-CD1 4.33Å; T164-I249 HydrophobicContact CG2-CG2 3.55Å; T164-M250 HydrophobicContact CG2-CG 4.38Å |
| 165 | A | 92.9 | Very high | 90.5 | Very high | 17 Ų | 17 | 20.2 Ų | 20.2 | 14% | 0.14 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -62.9 | -37.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | F110 Y161 S162 A167 V168 D169 | F110-A165 HydrophobicContact CD1-CB 3.93Å; F110-A165 HydrophobicContact CD2-CB 4.26Å; F110-A165 HydrophobicContact CE1-CB 3.55Å; F110-A165 HydrophobicContact CE2-CB 3.9Å; F110-A165 HydrophobicContact CG-CB 4.28Å; F110-A165 HydrophobicContact CZ-CB 3.53Å; Y161-A165 WeakPolarHBondContact O-CB 3.22Å; Y161-A165 PolarHBondContact O-N 3.39Å; S162-A165 PolarHBondContact O-N 3.41Å; A165-A167 VanDerWaalsContact C-N 3.33Å; A165-V168 PolarHBondContact O-N 3.48Å; A165-D169 WeakPolarHBondContact O-CB 3.48Å; A165-D169 PolarHBondContact O-N 3.4Å |
| 166 | I | 90.7 | Very high | 89.9 | Confident | 13 Ų | 13 | 22.4 Ų | 22.4 | 7% | 0.067 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -64.5 | -38.3 | 173.4 | -66.4 | 160.9 | 0 | 0 | 0 | 110.9 | T107 F110 L111 S162 M163 T164 R170 M288 | T107-I166 HydrophobicContact CG2-CB 4.25Å; T107-I166 HydrophobicContact CG2-CG1 4.01Å; T107-I166 HydrophobicContact CG2-CG2 3.54Å; F110-I166 HydrophobicContact CB-CD1 3.64Å; F110-I166 HydrophobicContact CB-CG1 3.41Å; F110-I166 VanDerWaalsContact CB-CG1 3.41Å; F110-I166 HydrophobicContact CD2-CG1 4.26Å; F110-I166 HydrophobicContact CG-CG1 4.09Å; L111-I166 HydrophobicContact CD2-CD1 3.74Å; L111-I166 HydrophobicContact CG-CD1 4.27Å; S162-I166 WeakPolarHBondContact O-CD1 3.3Å; S162-I166 WeakPolarHBondContact O-CG1 3.39Å; S162-I166 PolarHBondContact O-N 2.91Å; M163-I166 PolarHBondContact O-N 3.41Å; T164-I166 VanDerWaalsContact C-N 3.3Å; T164-I166 PolarHBondContact O-N 3.24Å; I166-R170 VanDerWaalsContact O-CG 3.29Å; I166-R170 WeakPolarHBondContact O-CG 3.2Å; I166-R170 PolarHBondContact O-N 3.07Å; I166-M288 HydrophobicContact CB-CE 4.36Å; I166-M288 HydrophobicContact CG2-CE 3.31Å; I166-M288 WeakPolarHBondContact O-CE 3.41Å |
| 167 | A | 89.5 | Confident | 89.4 | Confident | 1 Ų | 1 | 26.8 Ų | 26.8 | 1% | 0.008 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -61.1 | -48.6 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | M163 T164 A165 R170 Y171 M250 Y254 | M163-A167 PolarHBondContact O-N 3.21Å; T164-A167 VanDerWaalsContact O-CB 3.27Å; T164-A167 WeakPolarHBondContact O-CB 3.41Å; T164-A167 PolarHBondContact O-N 3.25Å; T164-A167 VanDerWaalsContact O-N 3.11Å; A165-A167 VanDerWaalsContact C-N 3.33Å; A167-R170 PolarHBondContact O-N 3.21Å; A167-Y171 PolarHBondContact O-N 2.94Å; A167-M250 HydrophobicContact CB-CG 4.06Å; A167-Y254 VanDerWaalsContact CA-OH 3.29Å; A167-Y254 WeakPolarHBondContact CA-OH 3.35Å; A167-Y254 HydrophobicContact CB-CE1 4.09Å; A167-Y254 HydrophobicContact CB-CE2 3.63Å; A167-Y254 WeakPolarHBondContact CB-OH 3.43Å |
| 168 | V | 89.9 | Confident | 88.6 | Confident | 53 Ų | 53 | 34.7 Ų | 34.7 | 32% | 0.321 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -64.7 | -43.3 | 179.3 | 175.3 | 0 | 0 | 0 | 0 | 111.7 | T164 A165 R170 Y171 M172 I249 | T164-V168 WeakPolarHBondContact O-CG2 3.16Å; T164-V168 PolarHBondContact O-N 3.47Å; A165-V168 PolarHBondContact O-N 3.48Å; V168-R170 PolarHBondContact O-N 2.93Å; V168-Y171 WeakPolarHBondContact O-CB 3.4Å; V168-Y171 PolarHBondContact O-N 3.42Å; V168-M172 HydrophobicContact CG1-CG 4.5Å; V168-M172 HydrophobicContact CG1-SD 4.4Å; V168-M172 WeakPolarHBondContact O-CG 3.48Å; V168-M172 PolarHBondContact O-N 3.15Å; V168-I249 HydrophobicContact CG2-CG2 4.43Å |
| 169 | D | 88.1 | Confident | 87.9 | Confident | 1 Ų | 1 | 40 Ų | 40 | 1% | 0.005 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -58 | -35.3 | 175.3 | 173.1 | 65.8 | 0 | 0 | 0 | 111.9 | T107 A165 A173 R181 | T107-D169 PolarHBondContact OG1-OD2 3.19Å; A165-D169 WeakPolarHBondContact O-CB 3.48Å; A165-D169 PolarHBondContact O-N 3.4Å; D169-A173 WeakPolarHBondContact O-CB 3.19Å; D169-A173 PolarHBondContact O-N 3.02Å; D169-A173 VanDerWaalsContact O-N 3.08Å; D169-R181 IonicContact OD1-CZ 3.69Å; D169-R181 IonicContact OD1-NE 3.53Å; D169-R181 PolarHBondContact OD1-NE 3.19Å; D169-R181 IonicContact OD1-NH2 2.88Å; D169-R181 PolarHBondContact OD1-NH2 2.82Å; D169-R181 IonicContact OD2-NH2 3.41Å; D169-R181 PolarHBondContact OD2-NH2 3.44Å |
| 170 | R | 85.5 | Confident | 87 | Confident | 53 Ų | 53 | 45.4 Ų | 45.4 | 20% | 0.2 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -79 | -38 | 178.8 | -71.2 | -79.3 | 178.4 | -111.2 | -6.7 | 112.8 | T107 I166 A167 V168 A173 I174 M288 | T107-R170 PolarHBondContact OG1-NH1 2.68Å; T107-R170 PolarHBondContact OG1-NH2 3.37Å; I166-R170 VanDerWaalsContact O-CG 3.29Å; I166-R170 WeakPolarHBondContact O-CG 3.2Å; I166-R170 PolarHBondContact O-N 3.07Å; A167-R170 PolarHBondContact O-N 3.21Å; V168-R170 PolarHBondContact O-N 2.93Å; R170-A173 PolarHBondContact O-N 2.94Å; R170-I174 WeakPolarHBondContact O-CB 3.49Å; R170-I174 WeakPolarHBondContact O-CD1 3.27Å; R170-I174 VanDerWaalsContact O-CG1 3.29Å; R170-I174 WeakPolarHBondContact O-CG1 3.39Å; R170-I174 PolarHBondContact O-N 3.24Å; R170-I174 VanDerWaalsContact O-N 3.13Å; R170-M288 HydrophobicContact CB-CE 3.91Å; R170-M288 HydrophobicContact CB-SD 4.11Å; R170-M288 HydrophobicContact CG-CE 3.47Å; R170-M288 VanDerWaalsContact CG-CE 3.47Å; R170-M288 HydrophobicContact CG-SD 3.59Å; R170-M288 VanDerWaalsContact CG-SD 3.59Å |
| 171 | Y | 87.1 | Confident | 86.4 | Confident | 61 Ų | 61 | 51.1 Ų | 51.1 | 24% | 0.239 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -54.1 | -53.7 | 168.7 | 171.4 | -89.3 | 0 | 0 | 0 | 110.6 | A167 V168 A173 I174 I175 I256 V257 | A167-Y171 PolarHBondContact O-N 2.94Å; V168-Y171 WeakPolarHBondContact O-CB 3.4Å; V168-Y171 PolarHBondContact O-N 3.42Å; Y171-A173 VanDerWaalsContact C-N 3.32Å; Y171-A173 PolarHBondContact O-N 3.01Å; Y171-I174 PolarHBondContact O-N 3.23Å; Y171-I174 VanDerWaalsContact O-N 3.15Å; Y171-I175 HydrophobicContact CD2-CG1 3.84Å; Y171-I175 HydrophobicContact CE2-CB 4.24Å; Y171-I175 HydrophobicContact CE2-CG1 3.7Å; Y171-I175 HydrophobicContact CE2-CG2 4.42Å; Y171-I175 HydrophobicContact CG-CG1 4.44Å; Y171-I175 WeakPolarHBondContact O-CB 3.37Å; Y171-I175 PolarHBondContact O-N 3.49Å; Y171-I256 HydrophobicContact CD2-CG2 4.49Å; Y171-I256 HydrophobicContact CE2-CB 4.29Å; Y171-I256 HydrophobicContact CE2-CD1 4.22Å; Y171-I256 HydrophobicContact CE2-CG2 3.85Å; Y171-V257 HydrophobicContact CD2-CG2 4Å |
| 172 | M | 86.3 | Confident | 85.7 | Confident | 45 Ų | 45 | 51.8 Ų | 51.8 | 22% | 0.222 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -59 | -42.8 | 178.9 | -68.8 | -178 | 73.5 | 0 | 0 | 111.9 | V168 I174 D176 | V168-M172 HydrophobicContact CG1-CG 4.5Å; V168-M172 HydrophobicContact CG1-SD 4.4Å; V168-M172 WeakPolarHBondContact O-CG 3.48Å; V168-M172 PolarHBondContact O-N 3.15Å; M172-I174 VanDerWaalsContact C-N 3.26Å; M172-I174 PolarHBondContact O-N 3.31Å; M172-D176 CarbonylContact O-C 3.57Å; M172-D176 WeakPolarHBondContact O-CA 3.02Å; M172-D176 PolarHBondContact O-N 3.49Å; M172-D176 VanDerWaalsContact O-N 3.13Å; M172-D176 VanDerWaalsContact O-O 3.14Å |
| 173 | A | 83.8 | Confident | 85.3 | Confident | 26 Ų | 26 | 55.1 Ų | 55.1 | 22% | 0.215 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -68.9 | -19.1 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | D169 R170 Y171 | D169-A173 WeakPolarHBondContact O-CB 3.19Å; D169-A173 PolarHBondContact O-N 3.02Å; D169-A173 VanDerWaalsContact O-N 3.08Å; R170-A173 PolarHBondContact O-N 2.94Å; Y171-A173 VanDerWaalsContact C-N 3.32Å; Y171-A173 PolarHBondContact O-N 3.01Å |
| 174 | I | 83 | Confident | 85 | Confident | 30 Ų | 30 | 56.6 Ų | 56.6 | 15% | 0.154 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -103.9 | -45.9 | -176.2 | -65.5 | 166.7 | 0 | 0 | 0 | 111 | R170 Y171 M172 V257 L261 V285 | R170-I174 WeakPolarHBondContact O-CB 3.49Å; R170-I174 WeakPolarHBondContact O-CD1 3.27Å; R170-I174 VanDerWaalsContact O-CG1 3.29Å; R170-I174 WeakPolarHBondContact O-CG1 3.39Å; R170-I174 PolarHBondContact O-N 3.24Å; R170-I174 VanDerWaalsContact O-N 3.13Å; Y171-I174 PolarHBondContact O-N 3.23Å; Y171-I174 VanDerWaalsContact O-N 3.15Å; M172-I174 VanDerWaalsContact C-N 3.26Å; M172-I174 PolarHBondContact O-N 3.31Å; I174-V257 HydrophobicContact CD1-CG1 3.54Å; I174-V257 HydrophobicContact CG2-CG1 4.44Å; I174-L261 HydrophobicContact CD1-CD1 4.25Å; I174-L261 HydrophobicContact CG2-CD2 4.32Å; I174-L261 HydrophobicContact CG2-CG 4.26Å; I174-V285 HydrophobicContact CD1-CG2 3.77Å |
| 175 | I | 83.3 | Confident | 84.7 | Confident | 46 Ų | 46 | 60.6 Ų | 60.6 | 24% | 0.236 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -86 | -43.1 | -174.2 | -56.2 | -57.6 | 0 | 0 | 0 | 111.5 | Y171 P177 I256 V257 T260 | Y171-I175 HydrophobicContact CD2-CG1 3.84Å; Y171-I175 HydrophobicContact CE2-CB 4.24Å; Y171-I175 HydrophobicContact CE2-CG1 3.7Å; Y171-I175 HydrophobicContact CE2-CG2 4.42Å; Y171-I175 HydrophobicContact CG-CG1 4.44Å; Y171-I175 WeakPolarHBondContact O-CB 3.37Å; Y171-I175 PolarHBondContact O-N 3.49Å; I175-P177 WeakPolarHBondContact O-CD 3.31Å; I175-I256 HydrophobicContact CD1-CG2 4.29Å; I175-I256 HydrophobicContact CG1-CG2 4.49Å; I175-V257 HydrophobicContact CG1-CG2 4.47Å; I175-T260 HydrophobicContact CD1-CG2 3.69Å; I175-T260 VanDerWaalsContact CD1-OG1 3.23Å; I175-T260 WeakPolarHBondContact CD1-OG1 3.36Å |
| 176 | D | 81 | Confident | 84.6 | Confident | 46 Ų | 46 | 61.4 Ų | 61.4 | 25% | 0.246 | 34% | 0.34 | C | S | . | . | trans | -119.1 | 62.6 | -174.1 | -76.6 | -46.9 | 0 | 0 | 0 | 111.8 | M172 L178 K179 | M172-D176 CarbonylContact O-C 3.57Å; M172-D176 WeakPolarHBondContact O-CA 3.02Å; M172-D176 PolarHBondContact O-N 3.49Å; M172-D176 VanDerWaalsContact O-N 3.13Å; M172-D176 VanDerWaalsContact O-O 3.14Å; D176-L178 PolarHBondContact O-N 2.78Å; D176-L178 VanDerWaalsContact O-N 3.08Å; D176-K179 HydrophobicContact CB-CB 4.13Å; D176-K179 HydrophobicContact CB-CD 3.78Å; D176-K179 HydrophobicContact CB-CG 3.98Å; D176-K179 PolarHBondContact O-N 3.4Å; D176-K179 VanDerWaalsContact O-N 3.07Å; D176-K179 IonicContact OD1-NZ 3.25Å; D176-K179 PolarHBondContact OD1-NZ 3.37Å; D176-K179 IonicContact OD2-NZ 2.79Å; D176-K179 PolarHBondContact OD2-NZ 2.9Å | ||
| 177 | P | 81.5 | Confident | 84.6 | Confident | 98 Ų | 98 | 60.8 Ų | 60.8 | 64% | 0.636 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.8 | -20 | -172.7 | 27.2 | -36 | 0 | 0 | 0 | 114.4 | I175 | I175-P177 WeakPolarHBondContact O-CD 3.31Š|
| 178 | L | 78.4 | Confident | 84.7 | Confident | 173 Ų | 173 | 66.9 Ų | 66.9 | 91% | 0.906 | 36% | 0.363 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.4 | -15.4 | 179.3 | -61.4 | 176.7 | 0 | 0 | 0 | 113.1 | D176 | D176-L178 PolarHBondContact O-N 2.78Å; D176-L178 VanDerWaalsContact O-N 3.08Å |
| 179 | K | 80.3 | Confident | 84.9 | Confident | 113 Ų | 113 | 69.8 Ų | 69.8 | 49% | 0.491 | 38% | 0.376 | S | S | . | . | S | Bend | trans | -77.4 | 138.4 | 176.3 | -68.7 | -176.4 | -169.1 | 158 | 0 | 109.7 | D176 R181 | D176-K179 HydrophobicContact CB-CB 4.13Å; D176-K179 HydrophobicContact CB-CD 3.78Å; D176-K179 HydrophobicContact CB-CG 3.98Å; D176-K179 PolarHBondContact O-N 3.4Å; D176-K179 VanDerWaalsContact O-N 3.07Å; D176-K179 IonicContact OD1-NZ 3.25Å; D176-K179 PolarHBondContact OD1-NZ 3.37Å; D176-K179 IonicContact OD2-NZ 2.79Å; D176-K179 PolarHBondContact OD2-NZ 2.9Å; K179-R181 PolarHBondContact O-N 2.64Å |
| 180 | P | 75.7 | Confident | 85.2 | Confident | 117 Ų | 117 | 71.9 Ų | 71.9 | 76% | 0.76 | 39% | 0.388 | S | S | * | . | P | Polyproline II helix | trans | -60.7 | 130.7 | 178.6 | 23 | -31.1 | 0 | 0 | 0 | 110.4 | ||
| 181 | R | 81.9 | Confident | 85.7 | Confident | 119 Ų | 119 | 70.7 Ų | 70.7 | 45% | 0.449 | 39% | 0.385 | S | S | . | . | P | Polyproline II helix | trans | -73.6 | 160.8 | 175.7 | -64.3 | -178.3 | 65.7 | 168.3 | -0.2 | 110.6 | D169 K179 S183 | D169-R181 IonicContact OD1-CZ 3.69Å; D169-R181 IonicContact OD1-NE 3.53Å; D169-R181 PolarHBondContact OD1-NE 3.19Å; D169-R181 IonicContact OD1-NH2 2.88Å; D169-R181 PolarHBondContact OD1-NH2 2.82Å; D169-R181 IonicContact OD2-NH2 3.41Å; D169-R181 PolarHBondContact OD2-NH2 3.44Å; K179-R181 PolarHBondContact O-N 2.64Å; R181-S183 PolarHBondContact O-N 2.91Å |
| 182 | L | 80.6 | Confident | 86.1 | Confident | 55 Ų | 55 | 69.2 Ų | 69.2 | 29% | 0.288 | 39% | 0.389 | S | S | . | . | P | Polyproline II helix | trans | -52.3 | 126 | 172.7 | -67.4 | 173.1 | 0 | 0 | 0 | 110.3 | V106 A186 | V106-L182 HydrophobicContact CG1-CB 4.21Å; V106-L182 WeakPolarHBondContact CG2-O 3.4Å; L182-A186 HydrophobicContact CD2-CB 4.43Å |
| 183 | S | 86.6 | Confident | 86.5 | Confident | 69 Ų | 69 | 69.5 Ų | 69.5 | 48% | 0.483 | 40% | 0.396 | S | S | . | . | P | Polyproline II helix | trans | -68 | 159.7 | 172.4 | 175.1 | 0 | 0 | 0 | 0 | 110.9 | R181 T185 A186 T187 | R181-S183 PolarHBondContact O-N 2.91Å; S183-T185 PolarHBondContact O-N 3.26Å; S183-T185 PolarHBondContact OG-N 3.21Å; S183-A186 PolarHBondContact O-N 3.48Å; S183-T187 WeakPolarHBondContact O-CB 3.01Å; S183-T187 PolarHBondContact O-N 3.32Å; S183-T187 PolarHBondContact O-OG1 3.46Å |
| 184 | A | 84.2 | Confident | 87.1 | Confident | 43 Ų | 43 | 68.7 Ų | 68.7 | 36% | 0.355 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -57.7 | -36 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | K188 | A184-K188 WeakPolarHBondContact O-CG 3.2Å; A184-K188 PolarHBondContact O-N 2.96Å |
| 185 | T | 88.9 | Confident | 87.8 | Confident | 93 Ų | 93 | 69.1 Ų | 69.1 | 57% | 0.571 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -68 | -47.5 | 175.5 | -51.7 | 0 | 0 | 0 | 0 | 111.1 | S183 T187 K188 I189 | S183-T185 PolarHBondContact O-N 3.26Å; S183-T185 PolarHBondContact OG-N 3.21Å; T185-T187 VanDerWaalsContact C-N 3.27Å; T185-T187 PolarHBondContact O-N 2.94Å; T185-K188 PolarHBondContact O-N 3.32Å; T185-K188 VanDerWaalsContact O-N 3.16Å; T185-I189 HydrophobicContact CG2-CD1 4.25Å; T185-I189 WeakPolarHBondContact O-CG1 3.13Å; T185-I189 PolarHBondContact O-N 3.38Å |
| 186 | A | 90.6 | Very high | 88.5 | Confident | 34 Ų | 34 | 72 Ų | 72 | 28% | 0.281 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -58.6 | -40.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | L182 S183 K188 I189 V190 | L182-A186 HydrophobicContact CD2-CB 4.43Å; S183-A186 PolarHBondContact O-N 3.48Å; A186-K188 PolarHBondContact O-N 3.4Å; A186-I189 PolarHBondContact O-N 2.9Å; A186-V190 WeakPolarHBondContact O-CG2 3.37Å; A186-V190 PolarHBondContact O-N 3.37Å |
| 187 | T | 90.6 | Very high | 89.2 | Confident | 0 Ų | 0 | 74.2 Ų | 74.2 | 0% | 0 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -59.6 | -44.1 | 176.6 | -54.8 | 0 | 0 | 0 | 0 | 112.1 | V106 F110 S183 T185 I189 V190 I191 | V106-T187 HydrophobicContact CG1-CG2 4.19Å; V106-T187 VanDerWaalsContact CG1-OG1 3.26Å; V106-T187 WeakPolarHBondContact CG1-OG1 3.36Å; F110-T187 HydrophobicContact CD2-CG2 4.14Å; F110-T187 HydrophobicContact CE1-CG2 4.31Å; F110-T187 HydrophobicContact CE2-CG2 3.71Å; F110-T187 HydrophobicContact CZ-CG2 3.8Å; S183-T187 WeakPolarHBondContact O-CB 3.01Å; S183-T187 PolarHBondContact O-N 3.32Å; S183-T187 PolarHBondContact O-OG1 3.46Å; T185-T187 VanDerWaalsContact C-N 3.27Å; T185-T187 PolarHBondContact O-N 2.94Å; T187-I189 VanDerWaalsContact C-N 3.35Å; T187-V190 PolarHBondContact O-N 3.12Å; T187-I191 HydrophobicContact CG2-CD1 4.19Å; T187-I191 WeakPolarHBondContact O-CG1 3.33Å; T187-I191 PolarHBondContact O-N 2.98Å |
| 188 | K | 90.6 | Very high | 89.8 | Confident | 129 Ų | 129 | 69.6 Ų | 69.6 | 56% | 0.561 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -64.9 | -39.2 | 176.5 | -69.2 | 174 | -175.2 | 179.2 | 0 | 112 | A184 T185 A186 I191 G192 | A184-K188 WeakPolarHBondContact O-CG 3.2Å; A184-K188 PolarHBondContact O-N 2.96Å; T185-K188 PolarHBondContact O-N 3.32Å; T185-K188 VanDerWaalsContact O-N 3.16Å; A186-K188 PolarHBondContact O-N 3.4Å; K188-I191 PolarHBondContact O-N 3.47Å; K188-G192 PolarHBondContact O-N 3.43Å |
| 189 | I | 94.6 | Very high | 90.6 | Very high | 115 Ų | 115 | 65.5 Ų | 65.5 | 59% | 0.59 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -63.3 | -45.1 | 175.2 | -65.4 | 167.6 | 0 | 0 | 0 | 110.2 | T185 A186 T187 I191 G192 S193 | T185-I189 HydrophobicContact CG2-CD1 4.25Å; T185-I189 WeakPolarHBondContact O-CG1 3.13Å; T185-I189 PolarHBondContact O-N 3.38Å; A186-I189 PolarHBondContact O-N 2.9Å; T187-I189 VanDerWaalsContact C-N 3.35Å; I189-I191 PolarHBondContact O-N 3.44Å; I189-G192 PolarHBondContact O-N 3.46Å; I189-S193 PolarHBondContact O-N 3.32Å |
| 190 | V | 95 | Very high | 91.3 | Very high | 44 Ų | 44 | 65.6 Ų | 65.6 | 27% | 0.267 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -59 | -47.6 | 176.2 | 173.3 | 0 | 0 | 0 | 0 | 110.4 | F110 A186 T187 G192 S193 I194 | F110-V190 HydrophobicContact CE1-CB 4.41Å; F110-V190 HydrophobicContact CE1-CG1 3.87Å; F110-V190 HydrophobicContact CZ-CB 4.27Å; F110-V190 HydrophobicContact CZ-CG1 3.91Å; A186-V190 WeakPolarHBondContact O-CG2 3.37Å; A186-V190 PolarHBondContact O-N 3.37Å; T187-V190 PolarHBondContact O-N 3.12Å; V190-G192 VanDerWaalsContact C-N 3.35Å; V190-G192 PolarHBondContact O-N 3.03Å; V190-S193 PolarHBondContact O-N 3.44Å; V190-S193 PolarHBondContact O-OG 3.4Å; V190-I194 HydrophobicContact CG1-CD1 3.92Å; V190-I194 HydrophobicContact CG1-CG1 4.46Å; V190-I194 VanDerWaalsContact O-CG1 3.31Å; V190-I194 WeakPolarHBondContact O-CG1 3.47Å; V190-I194 PolarHBondContact O-N 3.01Å |
| 191 | I | 95 | Very high | 92.1 | Very high | 28 Ų | 28 | 61 Ų | 61 | 14% | 0.144 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -57.9 | -46.9 | 175.3 | -68.5 | 166.2 | 0 | 0 | 0 | 111 | F110 N113 T187 K188 I189 S193 I194 W195 | F110-I191 HydrophobicContact CD1-CD1 4.27Å; F110-I191 HydrophobicContact CD1-CG1 3.9Å; F110-I191 HydrophobicContact CE1-CD1 4.43Å; F110-I191 HydrophobicContact CE1-CG1 3.8Å; N113-I191 HydrophobicContact CB-CD1 4.25Å; N113-I191 HydrophobicContact CB-CG1 4.4Å; N113-I191 HydrophobicContact CB-CG2 4.37Å; N113-I191 WeakPolarHBondContact OD1-CG2 3.38Å; T187-I191 HydrophobicContact CG2-CD1 4.19Å; T187-I191 WeakPolarHBondContact O-CG1 3.33Å; T187-I191 PolarHBondContact O-N 2.98Å; K188-I191 PolarHBondContact O-N 3.47Å; I189-I191 PolarHBondContact O-N 3.44Å; I191-S193 VanDerWaalsContact C-N 3.33Å; I191-S193 PolarHBondContact O-N 3.45Å; I191-I194 WeakPolarHBondContact O-CB 3.23Å; I191-I194 PolarHBondContact O-N 3.41Å; I191-W195 VanDerWaalsContact O-CD1 3.3Å; I191-W195 PolarHBondContact O-N 2.89Å; I191-W195 VanDerWaalsContact O-N 3.12Å |
| 192 | G | 95.3 | Very high | 92.5 | Very high | 31 Ų | 31 | 55.4 Ų | 55.4 | 32% | 0.32 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -57.3 | -44.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | K188 I189 V190 I194 W195 I196 | K188-G192 PolarHBondContact O-N 3.43Å; I189-G192 PolarHBondContact O-N 3.46Å; V190-G192 VanDerWaalsContact C-N 3.35Å; V190-G192 PolarHBondContact O-N 3.03Å; G192-I194 PolarHBondContact O-N 3.29Å; G192-W195 PolarHBondContact O-N 3.32Å; G192-I196 WeakPolarHBondContact O-CG1 3.27Å; G192-I196 PolarHBondContact O-N 3.02Å |
| 193 | S | 96.4 | Very high | 93 | Very high | 51 Ų | 51 | 58 Ų | 58 | 36% | 0.357 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -64.2 | -38.8 | 177.5 | 71.1 | 0 | 0 | 0 | 0 | 112.8 | I189 V190 I191 W195 I196 L197 | I189-S193 PolarHBondContact O-N 3.32Å; V190-S193 PolarHBondContact O-N 3.44Å; V190-S193 PolarHBondContact O-OG 3.4Å; I191-S193 VanDerWaalsContact C-N 3.33Å; I191-S193 PolarHBondContact O-N 3.45Å; S193-W195 VanDerWaalsContact C-N 3.34Å; S193-W195 PolarHBondContact O-N 3.26Å; S193-I196 PolarHBondContact O-N 2.95Å; S193-L197 WeakPolarHBondContact O-CB 3.37Å; S193-L197 VanDerWaalsContact O-CG 3.31Å; S193-L197 WeakPolarHBondContact O-CG 3.45Å; S193-L197 PolarHBondContact O-N 3.35Å |
| 194 | I | 96.5 | Very high | 93.2 | Very high | 9 Ų | 9 | 56.3 Ų | 56.3 | 5% | 0.046 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -59.2 | -46.8 | 175.7 | -71.3 | 167.5 | 0 | 0 | 0 | 110.2 | F157 A158 V190 I191 G192 L197 A198 | F157-I194 HydrophobicContact CD1-CG2 4.26Å; F157-I194 HydrophobicContact CE1-CG2 4.37Å; A158-I194 HydrophobicContact CB-CG2 4.11Å; V190-I194 HydrophobicContact CG1-CD1 3.92Å; V190-I194 HydrophobicContact CG1-CG1 4.46Å; V190-I194 VanDerWaalsContact O-CG1 3.31Å; V190-I194 WeakPolarHBondContact O-CG1 3.47Å; V190-I194 PolarHBondContact O-N 3.01Å; I191-I194 WeakPolarHBondContact O-CB 3.23Å; I191-I194 PolarHBondContact O-N 3.41Å; G192-I194 PolarHBondContact O-N 3.29Å; I194-L197 PolarHBondContact O-N 2.97Å; I194-A198 WeakPolarHBondContact O-CB 3.47Å; I194-A198 PolarHBondContact O-N 3.04Å |
| 195 | W | 96.9 | Very high | 93.2 | Very high | 39 Ų | 39 | 55 Ų | 55 | 15% | 0.148 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -65 | -42 | 178.3 | -81.8 | 97.5 | 0 | 0 | 0 | 112.7 | N113 F116 T154 A158 I191 G192 S193 A198 F199 | N113-W195 PolarHBondContact OD1-NE1 3.46Å; F116-W195 HydrophobicContact CD1-CH2 4.33Å; F116-W195 AromaticContact CD1-CZ2 3.84Å; F116-W195 HydrophobicContact CD1-CZ2 3.84Å; F116-W195 AromaticContact CE1-CH2 3.97Å; F116-W195 HydrophobicContact CE1-CH2 3.97Å; F116-W195 AromaticContact CE1-CZ2 3.82Å; F116-W195 HydrophobicContact CE1-CZ2 3.82Å; T154-W195 HydrophobicContact CG2-CE3 3.75Å; T154-W195 HydrophobicContact CG2-CZ3 3.61Å; A158-W195 HydrophobicContact CB-CD2 4.48Å; A158-W195 HydrophobicContact CB-CZ2 4.14Å; I191-W195 VanDerWaalsContact O-CD1 3.3Å; I191-W195 PolarHBondContact O-N 2.89Å; I191-W195 VanDerWaalsContact O-N 3.12Å; G192-W195 PolarHBondContact O-N 3.32Å; S193-W195 VanDerWaalsContact C-N 3.34Å; S193-W195 PolarHBondContact O-N 3.26Å; W195-A198 WeakPolarHBondContact O-CB 3.42Å; W195-A198 PolarHBondContact O-N 3.47Å; W195-F199 HydrophobicContact CB-CE2 4.37Å; W195-F199 HydrophobicContact CE3-CE1 4.29Å; W195-F199 AromaticContact CE3-CE2 3.94Å; W195-F199 HydrophobicContact CE3-CE2 3.94Å; W195-F199 AromaticContact CE3-CZ 3.74Å; W195-F199 HydrophobicContact CE3-CZ 3.74Å; W195-F199 HydrophobicContact CZ3-CE1 4.46Å; W195-F199 HydrophobicContact CZ3-CZ 4.14Å; W195-F199 WeakPolarHBondContact O-CB 3.41Å; W195-F199 WeakPolarHBondContact O-CD2 3.25Å; W195-F199 WeakPolarHBondContact O-CG 3.41Å; W195-F199 PolarHBondContact O-N 3.5Å |
| 196 | I | 96.9 | Very high | 93.1 | Very high | 107 Ų | 107 | 52.2 Ų | 52.2 | 55% | 0.549 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -60.1 | -48.8 | 176.7 | -68 | 165.2 | 0 | 0 | 0 | 110.4 | G192 S193 A198 F199 L200 | G192-I196 WeakPolarHBondContact O-CG1 3.27Å; G192-I196 PolarHBondContact O-N 3.02Å; S193-I196 PolarHBondContact O-N 2.95Å; I196-A198 VanDerWaalsContact C-N 3.34Å; I196-A198 PolarHBondContact O-N 3.44Å; I196-F199 PolarHBondContact O-N 3.31Å; I196-L200 HydrophobicContact CG2-CD1 4.05Å; I196-L200 VanDerWaalsContact O-CG 3.31Å; I196-L200 WeakPolarHBondContact O-CG 3.16Å; I196-L200 PolarHBondContact O-N 3.36Å |
| 197 | L | 96 | Very high | 93 | Very high | 92 Ų | 92 | 54.8 Ų | 54.8 | 48% | 0.482 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -63.2 | -40 | 177.7 | -68.4 | 172.4 | 0 | 0 | 0 | 112 | F157 S193 I194 F199 L200 L201 | F157-L197 HydrophobicContact CE1-CB 3.87Å; F157-L197 HydrophobicContact CZ-CB 3.9Å; S193-L197 WeakPolarHBondContact O-CB 3.37Å; S193-L197 VanDerWaalsContact O-CG 3.31Å; S193-L197 WeakPolarHBondContact O-CG 3.45Å; S193-L197 PolarHBondContact O-N 3.35Å; I194-L197 PolarHBondContact O-N 2.97Å; L197-F199 VanDerWaalsContact C-N 3.34Å; L197-F199 PolarHBondContact O-N 3.01Å; L197-L200 PolarHBondContact O-N 3.47Å; L197-L201 WeakPolarHBondContact O-CB 3.41Å; L197-L201 PolarHBondContact O-N 2.92Å |
| 198 | A | 95.2 | Very high | 92.8 | Very high | 0 Ų | 0 | 58.3 Ų | 58.3 | 0% | 0 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -61.8 | -40.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | T154 F157 I194 W195 I196 A202 | T154-A198 HydrophobicContact CG2-CB 3.66Å; T154-A198 PolarHBondContact OG1-O 3.44Å; F157-A198 HydrophobicContact CB-CB 3.96Å; F157-A198 HydrophobicContact CD1-CB 3.53Å; F157-A198 HydrophobicContact CE1-CB 4.28Å; F157-A198 HydrophobicContact CG-CB 3.94Å; I194-A198 WeakPolarHBondContact O-CB 3.47Å; I194-A198 PolarHBondContact O-N 3.04Å; W195-A198 WeakPolarHBondContact O-CB 3.42Å; W195-A198 PolarHBondContact O-N 3.47Å; I196-A198 VanDerWaalsContact C-N 3.34Å; I196-A198 PolarHBondContact O-N 3.44Å; A198-A202 VanDerWaalsContact O-CB 3.31Å; A198-A202 WeakPolarHBondContact O-CB 3.48Å; A198-A202 PolarHBondContact O-N 2.92Å |
| 199 | F | 94.9 | Very high | 92.5 | Very high | 87 Ų | 87 | 52.2 Ų | 52.2 | 38% | 0.382 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -68.7 | -43.2 | 175.9 | -72.8 | -44.6 | 0 | 0 | 0 | 112.1 | F150 T154 W195 I196 L197 L201 A202 F203 | F150-F199 AromaticContact CE1-CD1 3.73Å; F150-F199 HydrophobicContact CE1-CD1 3.73Å; F150-F199 AromaticContact CE1-CE1 3.72Å; F150-F199 HydrophobicContact CE1-CE1 3.72Å; F150-F199 HydrophobicContact CE2-CD1 4.05Å; F150-F199 HydrophobicContact CZ-CB 4.44Å; F150-F199 AromaticContact CZ-CD1 3.16Å; F150-F199 HydrophobicContact CZ-CD1 3.16Å; F150-F199 AromaticContact CZ-CE1 3.64Å; F150-F199 HydrophobicContact CZ-CE1 3.64Å; F150-F199 HydrophobicContact CZ-CG 4.17Å; T154-F199 HydrophobicContact CG2-CD1 3.54Å; T154-F199 HydrophobicContact CG2-CE1 3.61Å; T154-F199 HydrophobicContact CG2-CG 4.33Å; T154-F199 HydrophobicContact CG2-CZ 4.36Å; W195-F199 HydrophobicContact CB-CE2 4.37Å; W195-F199 HydrophobicContact CE3-CE1 4.29Å; W195-F199 AromaticContact CE3-CE2 3.94Å; W195-F199 HydrophobicContact CE3-CE2 3.94Å; W195-F199 AromaticContact CE3-CZ 3.74Å; W195-F199 HydrophobicContact CE3-CZ 3.74Å; W195-F199 HydrophobicContact CZ3-CE1 4.46Å; W195-F199 HydrophobicContact CZ3-CZ 4.14Å; W195-F199 WeakPolarHBondContact O-CB 3.41Å; W195-F199 WeakPolarHBondContact O-CD2 3.25Å; W195-F199 WeakPolarHBondContact O-CG 3.41Å; W195-F199 PolarHBondContact O-N 3.5Å; I196-F199 PolarHBondContact O-N 3.31Å; L197-F199 VanDerWaalsContact C-N 3.34Å; L197-F199 PolarHBondContact O-N 3.01Å; F199-L201 VanDerWaalsContact C-N 3.32Å; F199-L201 PolarHBondContact O-N 3.34Å; F199-A202 PolarHBondContact O-N 3.17Å; F199-F203 WeakPolarHBondContact O-CB 3.43Å; F199-F203 PolarHBondContact O-N 2.8Å |
| 200 | L | 95 | Very high | 91.9 | Very high | 115 Ų | 115 | 51.4 Ų | 51.4 | 60% | 0.602 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -59.6 | -43.4 | 175.9 | -71.3 | 171 | 0 | 0 | 0 | 111.5 | I196 L197 F203 | I196-L200 HydrophobicContact CG2-CD1 4.05Å; I196-L200 VanDerWaalsContact O-CG 3.31Å; I196-L200 WeakPolarHBondContact O-CG 3.16Å; I196-L200 PolarHBondContact O-N 3.36Å; L197-L200 PolarHBondContact O-N 3.47Å; L200-F203 PolarHBondContact O-N 2.99Å |
| 201 | L | 92.4 | Very high | 91.3 | Very high | 22 Ų | 22 | 52.4 Ų | 52.4 | 12% | 0.115 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -65.7 | -40.1 | 177.8 | -176.3 | 63.9 | 0 | 0 | 0 | 112.2 | I153 F157 L197 F199 P204 Y234 I237 V238 L241 V242 | I153-L201 HydrophobicContact CG2-CD2 4.28Å; I153-L201 HydrophobicContact CG2-CG 4.28Å; F157-L201 HydrophobicContact CD2-CD2 3.56Å; F157-L201 HydrophobicContact CE2-CD2 3.93Å; L197-L201 WeakPolarHBondContact O-CB 3.41Å; L197-L201 PolarHBondContact O-N 2.92Å; F199-L201 VanDerWaalsContact C-N 3.32Å; F199-L201 PolarHBondContact O-N 3.34Å; L201-P204 WeakPolarHBondContact O-CD 3.29Å; L201-Y234 WeakPolarHBondContact O-CE2 3.43Å; L201-Y234 PolarHBondContact O-OH 3.49Å; L201-I237 HydrophobicContact CD1-CG2 4.37Å; L201-V238 HydrophobicContact CD1-CG2 4.16Å; L201-V238 HydrophobicContact CG-CG2 4.34Å; L201-L241 HydrophobicContact CD1-CD1 3.99Å; L201-L241 HydrophobicContact CD2-CB 4.43Å; L201-L241 HydrophobicContact CD2-CD1 4.48Å; L201-V242 HydrophobicContact CD2-CG2 3.79Å |
| 202 | A | 91.1 | Very high | 90.6 | Very high | 0 Ų | 0 | 54.5 Ų | 54.5 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -79.8 | -18.9 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | F150 I153 T154 A198 F199 Q205 C206 | F150-A202 HydrophobicContact CD2-CB 3.39Å; F150-A202 WeakPolarHBondContact CD2-O 3.23Å; F150-A202 HydrophobicContact CE2-CB 3.65Å; F150-A202 HydrophobicContact CG-CB 4.19Å; F150-A202 WeakPolarHBondContact O-CB 3.04Å; I153-A202 HydrophobicContact CB-CB 3.98Å; I153-A202 HydrophobicContact CG2-CB 4.02Å; T154-A202 WeakPolarHBondContact OG1-CB 3.14Å; A198-A202 VanDerWaalsContact O-CB 3.31Å; A198-A202 WeakPolarHBondContact O-CB 3.48Å; A198-A202 PolarHBondContact O-N 2.92Å; F199-A202 PolarHBondContact O-N 3.17Å; A202-Q205 WeakPolarHBondContact O-CB 3.26Å; A202-Q205 PolarHBondContact O-N 3.21Å; A202-Q205 VanDerWaalsContact O-N 3.11Å; A202-C206 PolarHBondContact O-N 3.05Å |
| 203 | F | 90.9 | Very high | 89.9 | Confident | 111 Ų | 111 | 58.3 Ų | 58.3 | 49% | 0.487 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -55.1 | -43.1 | -173.1 | -176.4 | -109.2 | 0 | 0 | 0 | 114.9 | F199 L200 Q205 C206 L207 | F199-F203 WeakPolarHBondContact O-CB 3.43Å; F199-F203 PolarHBondContact O-N 2.8Å; L200-F203 PolarHBondContact O-N 2.99Å; F203-Q205 VanDerWaalsContact C-N 3.27Å; F203-Q205 PolarHBondContact O-N 3.22Å; F203-C206 VanDerWaalsContact O-CB 3.31Å; F203-C206 WeakPolarHBondContact O-CB 3.38Å; F203-C206 PolarHBondContact O-N 3.06Å; F203-L207 HydrophobicContact CD1-CD1 3.88Å; F203-L207 HydrophobicContact CD1-CG 4.23Å; F203-L207 HydrophobicContact CE1-CD1 3.36Å; F203-L207 HydrophobicContact CE1-CD2 4.21Å; F203-L207 HydrophobicContact CE1-CG 3.83Å; F203-L207 HydrophobicContact CE2-CD2 4.25Å; F203-L207 HydrophobicContact CE2-CG 4.34Å; F203-L207 HydrophobicContact CZ-CD1 3.84Å; F203-L207 HydrophobicContact CZ-CD2 3.79Å; F203-L207 HydrophobicContact CZ-CG 3.88Å; F203-L207 PolarHBondContact O-N 2.97Å; F203-L207 VanDerWaalsContact O-N 3.13Å |
| 204 | P | 89.3 | Confident | 88.9 | Confident | 33 Ų | 33 | 59.1 Ų | 59.1 | 21% | 0.214 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -57.4 | -38.3 | 177.2 | -26.7 | 36.9 | 0 | 0 | 0 | 113.3 | L201 C206 L207 Y208 W224 Y234 | L201-P204 WeakPolarHBondContact O-CD 3.29Å; P204-C206 VanDerWaalsContact C-N 3.3Å; P204-C206 PolarHBondContact O-N 3.21Å; P204-L207 PolarHBondContact O-N 3.08Å; P204-Y208 HydrophobicContact CB-CD2 4.38Å; P204-Y208 HydrophobicContact CB-CE2 4.32Å; P204-Y208 WeakPolarHBondContact O-CD2 3.43Å; P204-Y208 PolarHBondContact O-N 3.01Å; P204-W224 HydrophobicContact CB-CH2 3.74Å; P204-W224 HydrophobicContact CB-CZ3 4.39Å; P204-Y234 HydrophobicContact CB-CD2 4.36Å; P204-Y234 HydrophobicContact CB-CE2 4.02Å; P204-Y234 HydrophobicContact CG-CD2 4.45Å; P204-Y234 HydrophobicContact CG-CE2 3.94Å |
| 205 | Q | 85 | Confident | 87.7 | Confident | 16 Ų | 16 | 65 Ų | 65 | 8% | 0.075 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -66 | -34.5 | 178.2 | -71.7 | -84.4 | -21.8 | 0 | 0 | 112 | I153 A202 F203 S209 Y234 | I153-Q205 HydrophobicContact CD1-CB 4.17Å; I153-Q205 HydrophobicContact CD1-CG 3.61Å; A202-Q205 WeakPolarHBondContact O-CB 3.26Å; A202-Q205 PolarHBondContact O-N 3.21Å; A202-Q205 VanDerWaalsContact O-N 3.11Å; F203-Q205 VanDerWaalsContact C-N 3.27Å; F203-Q205 PolarHBondContact O-N 3.22Å; Q205-S209 WeakPolarHBondContact O-CB 3.19Å; Q205-S209 PolarHBondContact O-N 2.95Å; Q205-S209 PolarHBondContact O-OG 2.93Å; Q205-Y234 HydrophobicContact CG-CD1 4.32Å; Q205-Y234 HydrophobicContact CG-CE1 3.37Å; Q205-Y234 WeakPolarHBondContact CG-OH 3.48Å |
| 206 | C | 87.8 | Confident | 86.5 | Confident | 34 Ų | 34 | 67 Ų | 67 | 23% | 0.23 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -65.3 | -43.5 | 173.6 | -172.5 | 0 | 0 | 0 | 0 | 111.9 | F150 A202 F203 P204 | F150-C206 HydrophobicContact CB-CB 4.04Å; F150-C206 HydrophobicContact CD2-CB 3.85Å; F150-C206 HydrophobicContact CG-CB 4.22Å; A202-C206 PolarHBondContact O-N 3.05Å; F203-C206 VanDerWaalsContact O-CB 3.31Å; F203-C206 WeakPolarHBondContact O-CB 3.38Å; F203-C206 PolarHBondContact O-N 3.06Å; P204-C206 VanDerWaalsContact C-N 3.3Å; P204-C206 PolarHBondContact O-N 3.21Å |
| 207 | L | 87.8 | Confident | 85.5 | Confident | 88 Ų | 88 | 63.4 Ų | 63.4 | 46% | 0.461 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -66.6 | -43.5 | -178.6 | -71.3 | -177.5 | 0 | 0 | 0 | 112.9 | F203 P204 S209 | F203-L207 HydrophobicContact CD1-CD1 3.88Å; F203-L207 HydrophobicContact CD1-CG 4.23Å; F203-L207 HydrophobicContact CE1-CD1 3.36Å; F203-L207 HydrophobicContact CE1-CD2 4.21Å; F203-L207 HydrophobicContact CE1-CG 3.83Å; F203-L207 HydrophobicContact CE2-CD2 4.25Å; F203-L207 HydrophobicContact CE2-CG 4.34Å; F203-L207 HydrophobicContact CZ-CD1 3.84Å; F203-L207 HydrophobicContact CZ-CD2 3.79Å; F203-L207 HydrophobicContact CZ-CG 3.88Å; F203-L207 PolarHBondContact O-N 2.97Å; F203-L207 VanDerWaalsContact O-N 3.13Å; P204-L207 PolarHBondContact O-N 3.08Å; L207-S209 VanDerWaalsContact C-N 3.35Å |
| 208 | Y | 86.1 | Confident | 84.6 | Confident | 74 Ų | 74 | 60.6 Ų | 60.6 | 29% | 0.29 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -87.1 | -4.6 | -175 | -62.7 | -53.2 | 0 | 0 | 0 | 113.5 | P204 K210 V222 Q223 W224 P225 | P204-Y208 HydrophobicContact CB-CD2 4.38Å; P204-Y208 HydrophobicContact CB-CE2 4.32Å; P204-Y208 WeakPolarHBondContact O-CD2 3.43Å; P204-Y208 PolarHBondContact O-N 3.01Å; Y208-K210 PolarHBondContact O-N 2.71Å; Y208-V222 CarbonylContact O-C 3.49Å; Y208-V222 WeakPolarHBondContact O-CA 3.16Å; Y208-Q223 WeakPolarHBondContact CB-O 3.4Å; Y208-Q223 WeakPolarHBondContact CD1-O 3.27Å; Y208-Q223 PolarHBondContact O-N 3.06Å; Y208-W224 AromaticContact CD2-CD2 4Å; Y208-W224 HydrophobicContact CD2-CD2 4Å; Y208-W224 AromaticContact CD2-CE3 3.67Å; Y208-W224 HydrophobicContact CD2-CE3 3.67Å; Y208-W224 AromaticContact CD2-CH2 3.9Å; Y208-W224 HydrophobicContact CD2-CH2 3.9Å; Y208-W224 HydrophobicContact CD2-CZ2 4.18Å; Y208-W224 AromaticContact CD2-CZ3 3.63Å; Y208-W224 HydrophobicContact CD2-CZ3 3.63Å; Y208-W224 HydrophobicContact CE2-CD2 4.46Å; Y208-W224 AromaticContact CE2-CE3 3.69Å; Y208-W224 HydrophobicContact CE2-CE3 3.69Å; Y208-W224 HydrophobicContact CE2-CH2 4.09Å; Y208-W224 AromaticContact CE2-CZ3 3.47Å; Y208-W224 HydrophobicContact CE2-CZ3 3.47Å; Y208-W224 VanDerWaalsContact CE2-CZ3 3.47Å; Y208-P225 VanDerWaalsContact CE1-CD 3.44Å; Y208-P225 HydrophobicContact CE1-CG 3.71Å |
| 209 | S | 83.7 | Confident | 83.7 | Confident | 1 Ų | 1 | 60.6 Ų | 60.6 | 1% | 0.007 | 33% | 0.331 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.9 | 121.7 | 174.6 | -74.8 | 0 | 0 | 0 | 0 | 112.5 | N149 Q205 L207 Y221 | N149-S209 WeakPolarHBondContact CB-OG 3.32Å; N149-S209 PolarHBondContact ND2-OG 3.17Å; Q205-S209 WeakPolarHBondContact O-CB 3.19Å; Q205-S209 PolarHBondContact O-N 2.95Å; Q205-S209 PolarHBondContact O-OG 2.93Å; L207-S209 VanDerWaalsContact C-N 3.35Å; S209-Y221 CarbonylContact C-O 3.52Å; S209-Y221 VanDerWaalsContact CA-O 3.27Å; S209-Y221 WeakPolarHBondContact CA-O 3.18Å |
| 210 | K | 82 | Confident | 83.1 | Confident | 98 Ų | 98 | 56.6 Ų | 56.6 | 43% | 0.426 | 31% | 0.313 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.5 | 159.2 | -178.7 | -64.1 | -66.6 | -176.6 | 172.6 | 0 | 110.8 | Y208 C220 Y221 | Y208-K210 PolarHBondContact O-N 2.71Å; K210-C220 WeakPolarHBondContact O-CA 3.4Å; K210-Y221 HydrophobicContact CB-CD1 4.22Å; K210-Y221 HydrophobicContact CB-CE1 3.88Å; K210-Y221 PolarHBondContact N-O 3.25Å; K210-Y221 VanDerWaalsContact O-CD1 3.29Å; K210-Y221 WeakPolarHBondContact O-CD1 3.21Å; K210-Y221 PolarHBondContact O-N 3Å; K210-Y221 VanDerWaalsContact O-O 3.1Å |
| 211 | I | 82.9 | Confident | 82.1 | Confident | 65 Ų | 65 | 53.2 Ų | 53.2 | 33% | 0.333 | 29% | 0.293 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.5 | 141.4 | 172 | 58.5 | 168.7 | 0 | 0 | 0 | 110.4 | A142 C145 T218 L219 | A142-I211 HydrophobicContact CB-CD1 3.98Å; A142-I211 HydrophobicContact CB-CG1 4.2Å; A142-I211 HydrophobicContact CB-CG2 4.33Å; C145-I211 HydrophobicContact CB-CG2 3.89Å; I211-T218 HydrophobicContact CB-CG2 4.49Å; I211-L219 CarbonylContact C-O 3.46Å; I211-L219 WeakPolarHBondContact CA-O 3.39Å |
| 212 | K | 79.6 | Confident | 81.5 | Confident | 72 Ų | 72 | 52.4 Ų | 52.4 | 31% | 0.313 | 29% | 0.289 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.6 | 120.8 | 172.4 | -158.4 | 170.6 | -177.6 | 177.3 | 0 | 109.2 | M214 L219 Y221 | K212-M214 HydrophobicContact CD-CG 4.47Å; K212-M214 HydrophobicContact CD-SD 3.93Å; K212-M214 VanDerWaalsContact CE-SD 3.58Å; K212-M214 HydrophobicContact CG-CG 4.31Å; K212-M214 HydrophobicContact CG-SD 4.09Å; K212-L219 PolarHBondContact N-O 3.31Å; K212-L219 PolarHBondContact O-N 3.03Å; K212-Y221 HydrophobicContact CB-CD1 4.1Å; K212-Y221 HydrophobicContact CB-CE1 3.53Å; K212-Y221 HydrophobicContact CD-CE1 4.46Å; K212-Y221 HydrophobicContact CG-CE1 4.32Å |
| 213 | V | 82.4 | Confident | 81 | Confident | 110 Ų | 110 | 57.2 Ų | 57.2 | 67% | 0.667 | 31% | 0.311 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -90.3 | 114.1 | 172.4 | -174.8 | 0 | 0 | 0 | 0 | 107.5 | T218 | V213-T218 HydrophobicContact CG2-CG2 4.34Å |
| 214 | M | 75.3 | Confident | 80.5 | Confident | 68 Ų | 68 | 53.1 Ų | 53.1 | 34% | 0.335 | 29% | 0.293 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.7 | 152.3 | 174.2 | -63.7 | -66.7 | -66.9 | 0 | 0 | 108.5 | K212 G216 R217 | K212-M214 HydrophobicContact CD-CG 4.47Å; K212-M214 HydrophobicContact CD-SD 3.93Å; K212-M214 VanDerWaalsContact CE-SD 3.58Å; K212-M214 HydrophobicContact CG-CG 4.31Å; K212-M214 HydrophobicContact CG-SD 4.09Å; M214-G216 PolarHBondContact O-N 3.44Å; M214-R217 HydrophobicContact CB-CG 4.1Å; M214-R217 PolarHBondContact N-O 3.01Å; M214-R217 PolarHBondContact O-N 3.32Å |
| 215 | P | 70.9 | Confident | 79.9 | Confident | 133 Ų | 133 | 55.5 Ų | 55.5 | 86% | 0.864 | 31% | 0.308 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.6 | 111.9 | 174.9 | 21.2 | -29.6 | 0 | 0 | 0 | 109.8 | ||
| 216 | G | 70.8 | Confident | 79.4 | Confident | 80 Ų | 80 | 61.8 Ų | 61.8 | 83% | 0.825 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 95.9 | -1.9 | -179.3 | 0 | 0 | 0 | 0 | 0 | 117 | M214 | M214-G216 PolarHBondContact O-N 3.44Š|
| 217 | R | 76.2 | Confident | 78.8 | Confident | 33 Ų | 33 | 61.2 Ų | 61.2 | 13% | 0.125 | 34% | 0.338 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -166.5 | 152.2 | 173.7 | 65.4 | -170.5 | -176.4 | -168.2 | 3.8 | 114.4 | A35 L36 G39 M214 L219 | A35-R217 PolarHBondContact O-NH1 3.35Å; A35-R217 PolarHBondContact O-NH2 3.25Å; L36-R217 PolarHBondContact O-NH2 3.19Å; G39-R217 VanDerWaalsContact CA-NH1 3.34Å; M214-R217 HydrophobicContact CB-CG 4.1Å; M214-R217 PolarHBondContact N-O 3.01Å; M214-R217 PolarHBondContact O-N 3.32Å; R217-L219 HydrophobicContact CG-CD2 4.21Å; R217-L219 HydrophobicContact CG-CG 4.4Å |
| 218 | T | 77.3 | Confident | 78 | Confident | 32 Ų | 32 | 58.7 Ų | 58.7 | 20% | 0.196 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.1 | 134.2 | 169 | -56.2 | 0 | 0 | 0 | 0 | 111.1 | W138 I211 V213 | W138-T218 HydrophobicContact CB-CG2 4.32Å; W138-T218 WeakPolarHBondContact CB-O 3.46Å; W138-T218 PolarHBondContact N-O 3.37Å; I211-T218 HydrophobicContact CB-CG2 4.49Å; V213-T218 HydrophobicContact CG2-CG2 4.34Å |
| 219 | L | 76.8 | Confident | 77.6 | Confident | 1 Ų | 1 | 63.5 Ų | 63.5 | 1% | 0.005 | 35% | 0.349 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.7 | 155 | -178.1 | -55.2 | -176.3 | 0 | 0 | 0 | 111.9 | E32 A35 L36 I211 K212 R217 | E32-L219 HydrophobicContact CG-CB 4.31Å; E32-L219 HydrophobicContact CG-CD1 4.36Å; A35-L219 HydrophobicContact CB-CD1 4.37Å; A35-L219 HydrophobicContact CB-CD2 3.23Å; A35-L219 HydrophobicContact CB-CG 4.42Å; L36-L219 HydrophobicContact CG-CD1 4.24Å; I211-L219 CarbonylContact C-O 3.46Å; I211-L219 WeakPolarHBondContact CA-O 3.39Å; K212-L219 PolarHBondContact N-O 3.31Å; K212-L219 PolarHBondContact O-N 3.03Å; R217-L219 HydrophobicContact CG-CD2 4.21Å; R217-L219 HydrophobicContact CG-CG 4.4Å |
| 220 | C | 81.7 | Confident | 77.4 | Confident | 2 Ų | 2 | 65.7 Ų | 65.7 | 1% | 0.014 | 36% | 0.359 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.6 | 114.2 | 173.2 | 171.1 | 0 | 0 | 0 | 0 | 109.4 | W138 C145 N149 K210 | W138-C220 HydrophobicContact CD2-CB 3.78Å; W138-C220 HydrophobicContact CE3-CB 3.93Å; W138-C220 HydrophobicContact CG-CB 4.12Å; W138-C220 HydrophobicContact CZ3-CB 4.43Å; C145-C220 WeakPolarHBondContact CA-SG 3.48Å; C145-C220 HydrophobicContact CB-CB 3.86Å; C145-C220 WeakPolarHBondContact CB-SG 3.35Å; C145-C220 WeakPolarHBondContact SG-CB 3.45Å; C145-C220 CovalentContact SG-SG 2.02Å; C145-C220 PolarHBondContact SG-SG 3.34Å; N149-C220 PolarHBondContact ND2-SG 3.11Å; N149-C220 VanDerWaalsContact ND2-SG 3.41Å; K210-C220 WeakPolarHBondContact O-CA 3.4Å |
| 221 | Y | 74.9 | Confident | 77.3 | Confident | 45 Ų | 45 | 62.4 Ų | 62.4 | 18% | 0.176 | 35% | 0.345 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.9 | 164 | 175.8 | 34.8 | -31.1 | 0 | 0 | 0 | 111.8 | E32 S209 K210 K212 Q223 | E32-Y221 WeakPolarHBondContact OE1-CA 3.47Å; E32-Y221 WeakPolarHBondContact OE1-CB 3.38Å; E32-Y221 WeakPolarHBondContact OE1-CD1 3.43Å; E32-Y221 PolarHBondContact OE1-N 3.45Å; E32-Y221 WeakPolarHBondContact OE2-CA 3.12Å; E32-Y221 WeakPolarHBondContact OE2-CB 3.36Å; S209-Y221 CarbonylContact C-O 3.52Å; S209-Y221 VanDerWaalsContact CA-O 3.27Å; S209-Y221 WeakPolarHBondContact CA-O 3.18Å; K210-Y221 HydrophobicContact CB-CD1 4.22Å; K210-Y221 HydrophobicContact CB-CE1 3.88Å; K210-Y221 PolarHBondContact N-O 3.25Å; K210-Y221 VanDerWaalsContact O-CD1 3.29Å; K210-Y221 WeakPolarHBondContact O-CD1 3.21Å; K210-Y221 PolarHBondContact O-N 3Å; K210-Y221 VanDerWaalsContact O-O 3.1Å; K212-Y221 HydrophobicContact CB-CD1 4.1Å; K212-Y221 HydrophobicContact CB-CE1 3.53Å; K212-Y221 HydrophobicContact CD-CE1 4.46Å; K212-Y221 HydrophobicContact CG-CE1 4.32Å; Y221-Q223 HydrophobicContact CD2-CB 3.76Å; Y221-Q223 HydrophobicContact CD2-CG 4.42Å; Y221-Q223 HydrophobicContact CE2-CB 3.68Å; Y221-Q223 HydrophobicContact CE2-CG 4Å; Y221-Q223 PolarHBondContact OH-OE1 2.74Å |
| 222 | V | 79.5 | Confident | 77.2 | Confident | 4 Ų | 4 | 63 Ų | 63 | 2% | 0.024 | 35% | 0.346 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.7 | 104.2 | 157.4 | -169.7 | 0 | 0 | 0 | 0 | 111.1 | N149 Y208 W224 | N149-V222 HydrophobicContact CB-CG2 4.21Å; Y208-V222 CarbonylContact O-C 3.49Å; Y208-V222 WeakPolarHBondContact O-CA 3.16Å; V222-W224 PolarHBondContact O-N 2.62Å |
| 223 | Q | 80.8 | Confident | 77.5 | Confident | 101 Ų | 101 | 63.5 Ų | 63.5 | 47% | 0.472 | 36% | 0.355 | S | S | . | . | trans | -89.6 | 103.7 | -179.8 | -171.8 | 179.8 | -7.6 | 0 | 0 | 111.5 | Y208 Y221 | Y208-Q223 WeakPolarHBondContact CB-O 3.4Å; Y208-Q223 WeakPolarHBondContact CD1-O 3.27Å; Y208-Q223 PolarHBondContact O-N 3.06Å; Y221-Q223 HydrophobicContact CD2-CB 3.76Å; Y221-Q223 HydrophobicContact CD2-CG 4.42Å; Y221-Q223 HydrophobicContact CE2-CB 3.68Å; Y221-Q223 HydrophobicContact CE2-CG 4Å; Y221-Q223 PolarHBondContact OH-OE1 2.74Å | ||
| 224 | W | 79.5 | Confident | 77.8 | Confident | 25 Ų | 25 | 59.2 Ų | 59.2 | 10% | 0.095 | 33% | 0.327 | C | S | . | . | trans | -80.2 | 136.8 | 176 | -71.3 | 83.2 | 0 | 0 | 0 | 112.3 | P204 Y208 V222 G227 Q230 H231 Y234 | P204-W224 HydrophobicContact CB-CH2 3.74Å; P204-W224 HydrophobicContact CB-CZ3 4.39Å; Y208-W224 AromaticContact CD2-CD2 4Å; Y208-W224 HydrophobicContact CD2-CD2 4Å; Y208-W224 AromaticContact CD2-CE3 3.67Å; Y208-W224 HydrophobicContact CD2-CE3 3.67Å; Y208-W224 AromaticContact CD2-CH2 3.9Å; Y208-W224 HydrophobicContact CD2-CH2 3.9Å; Y208-W224 HydrophobicContact CD2-CZ2 4.18Å; Y208-W224 AromaticContact CD2-CZ3 3.63Å; Y208-W224 HydrophobicContact CD2-CZ3 3.63Å; Y208-W224 HydrophobicContact CE2-CD2 4.46Å; Y208-W224 AromaticContact CE2-CE3 3.69Å; Y208-W224 HydrophobicContact CE2-CE3 3.69Å; Y208-W224 HydrophobicContact CE2-CH2 4.09Å; Y208-W224 AromaticContact CE2-CZ3 3.47Å; Y208-W224 HydrophobicContact CE2-CZ3 3.47Å; Y208-W224 VanDerWaalsContact CE2-CZ3 3.47Å; V222-W224 PolarHBondContact O-N 2.62Å; W224-G227 PolarHBondContact O-N 3.08Å; W224-Q230 HydrophobicContact CB-CB 4.5Å; W224-Q230 HydrophobicContact CD2-CB 4.48Å; W224-Q230 HydrophobicContact CE3-CB 3.98Å; W224-H231 HydrophobicContact CB-CB 4.49Å; W224-H231 VanDerWaalsContact CD1-CB 3.48Å; W224-H231 AromaticContact CD1-CD2 3.67Å; W224-H231 AromaticContact CD1-CG 3.78Å; W224-H231 HydrophobicContact CD2-CB 4.39Å; W224-H231 HydrophobicContact CG-CB 3.86Å; W224-H231 AromaticContact NE1-CD2 3.21Å; W224-H231 PolarHBondContact NE1-CD2 3.45Å; W224-H231 AromaticContact NE1-CG 3.77Å; W224-Y234 HydrophobicContact CH2-CD1 4.12Å; W224-Y234 AromaticContact CH2-CD2 3.75Å; W224-Y234 HydrophobicContact CH2-CD2 3.75Å; W224-Y234 HydrophobicContact CH2-CE2 4.45Å; W224-Y234 AromaticContact CH2-CG 3.55Å; W224-Y234 HydrophobicContact CH2-CG 3.55Å; W224-Y234 AromaticContact CZ2-CD1 3.76Å; W224-Y234 HydrophobicContact CZ2-CD1 3.76Å; W224-Y234 HydrophobicContact CZ2-CD2 4.24Å; W224-Y234 HydrophobicContact CZ2-CE1 4.4Å; W224-Y234 AromaticContact CZ2-CG 3.67Å; W224-Y234 HydrophobicContact CZ2-CG 3.67Å | ||
| 225 | P | 77.6 | Confident | 78.2 | Confident | 83 Ų | 83 | 57.1 Ų | 57.1 | 54% | 0.539 | 32% | 0.316 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.3 | -39.4 | -171 | 24.8 | -32.1 | 0 | 0 | 0 | 113.9 | Y208 G227 | Y208-P225 VanDerWaalsContact CE1-CD 3.44Å; Y208-P225 HydrophobicContact CE1-CG 3.71Å; P225-G227 VanDerWaalsContact C-N 3.3Å |
| 226 | E | 74 | Confident | 79.1 | Confident | 148 Ų | 148 | 53.4 Ų | 53.4 | 69% | 0.692 | 29% | 0.288 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.4 | 23 | 177.1 | -49.8 | 172.4 | -176.2 | 0 | 0 | 112.3 | Q230 | E226-Q230 HydrophobicContact CB-CG 3.83Å; E226-Q230 HydrophobicContact CG-CG 4.44Å; E226-Q230 PolarHBondContact OE1-NE2 2.86Å; E226-Q230 PolarHBondContact OE2-NE2 3.11Å |
| 227 | G | 75.4 | Confident | 80.1 | Confident | 23 Ų | 23 | 53.4 Ų | 53.4 | 24% | 0.237 | 27% | 0.268 | C | S | . | . | trans | 78.4 | -158.1 | 173.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | W224 P225 K229 Q230 | W224-G227 PolarHBondContact O-N 3.08Å; P225-G227 VanDerWaalsContact C-N 3.3Å; G227-K229 PolarHBondContact O-N 3.38Å; G227-Q230 PolarHBondContact O-N 2.93Å | ||
| 228 | P | 70.9 | Confident | 80.8 | Confident | 35 Ų | 35 | 52.4 Ų | 52.4 | 23% | 0.227 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -72.9 | -21.3 | -163.5 | 26.5 | -35 | 0 | 0 | 0 | 115.4 | A26 H231 F232 | A26-P228 HydrophobicContact CB-CB 3.22Å; A26-P228 HydrophobicContact CB-CG 4.01Å; P228-H231 PolarHBondContact O-N 2.69Å; P228-F232 PolarHBondContact O-N 3.28Å |
| 229 | K | 77.6 | Confident | 81.4 | Confident | 175 Ų | 175 | 51.5 Ų | 51.5 | 76% | 0.761 | 26% | 0.26 | S | S | * | . | H | α-helix | trans | -64.3 | -42.3 | 177.6 | -69.3 | -175.5 | 179.4 | 179.5 | 0 | 111.7 | G227 F232 T233 | G227-K229 PolarHBondContact O-N 3.38Å; K229-F232 PolarHBondContact O-N 2.87Å; K229-T233 PolarHBondContact O-N 3.37Å; K229-T233 PolarHBondContact O-OG1 2.92Å |
| 230 | Q | 79.5 | Confident | 82.2 | Confident | 47 Ų | 47 | 55.5 Ų | 55.5 | 22% | 0.22 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -64.7 | -43 | 176.8 | -76.3 | -171.1 | -30.6 | 0 | 0 | 112.1 | W224 E226 G227 F232 T233 Y234 | W224-Q230 HydrophobicContact CB-CB 4.5Å; W224-Q230 HydrophobicContact CD2-CB 4.48Å; W224-Q230 HydrophobicContact CE3-CB 3.98Å; E226-Q230 HydrophobicContact CB-CG 3.83Å; E226-Q230 HydrophobicContact CG-CG 4.44Å; E226-Q230 PolarHBondContact OE1-NE2 2.86Å; E226-Q230 PolarHBondContact OE2-NE2 3.11Å; G227-Q230 PolarHBondContact O-N 2.93Å; Q230-F232 VanDerWaalsContact C-N 3.31Å; Q230-F232 PolarHBondContact O-N 2.93Å; Q230-T233 PolarHBondContact O-N 3.05Å; Q230-Y234 WeakPolarHBondContact O-CB 3.14Å; Q230-Y234 PolarHBondContact O-N 3.41Å |
| 231 | H | 79.1 | Confident | 82.8 | Confident | 29 Ų | 29 | 58.2 Ų | 58.2 | 13% | 0.134 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -57.1 | -46.7 | 175.8 | 179.4 | -126.5 | 0 | 0 | 0 | 111.3 | A26 W224 P228 Y234 H235 | A26-H231 PolarHBondContact O-ND1 3.45Å; W224-H231 HydrophobicContact CB-CB 4.49Å; W224-H231 VanDerWaalsContact CD1-CB 3.48Å; W224-H231 AromaticContact CD1-CD2 3.67Å; W224-H231 AromaticContact CD1-CG 3.78Å; W224-H231 HydrophobicContact CD2-CB 4.39Å; W224-H231 HydrophobicContact CG-CB 3.86Å; W224-H231 AromaticContact NE1-CD2 3.21Å; W224-H231 PolarHBondContact NE1-CD2 3.45Å; W224-H231 AromaticContact NE1-CG 3.77Å; P228-H231 PolarHBondContact O-N 2.69Å; H231-Y234 PolarHBondContact O-N 3.36Å; H231-H235 WeakPolarHBondContact O-CB 3.49Å; H231-H235 PolarHBondContact O-N 3.48Å |
| 232 | F | 81.1 | Confident | 83.6 | Confident | 78 Ų | 78 | 56.3 Ų | 56.3 | 34% | 0.342 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -62.4 | -48.5 | 177 | -176.9 | -107.4 | 0 | 0 | 0 | 112.2 | P228 K229 Q230 Y234 H235 I236 A310 | P228-F232 PolarHBondContact O-N 3.28Å; K229-F232 PolarHBondContact O-N 2.87Å; Q230-F232 VanDerWaalsContact C-N 3.31Å; Q230-F232 PolarHBondContact O-N 2.93Å; F232-Y234 VanDerWaalsContact C-N 3.34Å; F232-Y234 PolarHBondContact O-N 3.03Å; F232-H235 PolarHBondContact O-N 3.05Å; F232-H235 VanDerWaalsContact O-N 3.12Å; F232-I236 HydrophobicContact CD1-CG1 4.26Å; F232-I236 HydrophobicContact CE1-CD1 4.35Å; F232-I236 HydrophobicContact CE1-CG1 3.89Å; F232-I236 HydrophobicContact CE2-CD1 4.16Å; F232-I236 HydrophobicContact CE2-CG1 4.24Å; F232-I236 HydrophobicContact CZ-CD1 3.87Å; F232-I236 HydrophobicContact CZ-CG1 3.89Å; F232-I236 WeakPolarHBondContact O-CG1 3.46Å; F232-I236 PolarHBondContact O-N 2.89Å; F232-A310 HydrophobicContact CD2-CB 3.39Å; F232-A310 HydrophobicContact CE2-CB 3.5Å |
| 233 | T | 86.4 | Confident | 84.3 | Confident | 81 Ų | 81 | 57.4 Ų | 57.4 | 50% | 0.497 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -58.1 | -45.4 | 177.9 | -60.5 | 0 | 0 | 0 | 0 | 111.8 | K229 Q230 H235 I236 I237 | K229-T233 PolarHBondContact O-N 3.37Å; K229-T233 PolarHBondContact O-OG1 2.92Å; Q230-T233 PolarHBondContact O-N 3.05Å; T233-H235 VanDerWaalsContact C-N 3.34Å; T233-H235 PolarHBondContact O-N 3.47Å; T233-I236 PolarHBondContact O-N 3.5Å; T233-I237 HydrophobicContact CG2-CD1 4.21Å; T233-I237 WeakPolarHBondContact O-CG1 3.36Å; T233-I237 PolarHBondContact O-N 3.29Å |
| 234 | Y | 87.7 | Confident | 84.9 | Confident | 21 Ų | 21 | 55.6 Ų | 55.6 | 8% | 0.082 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -59.5 | -45.2 | 175.2 | 174.1 | -94.3 | 0 | 0 | 0 | 111.5 | I153 L201 P204 Q205 W224 Q230 H231 F232 I236 I237 V238 | I153-Y234 HydrophobicContact CD1-CE1 4.35Å; L201-Y234 WeakPolarHBondContact O-CE2 3.43Å; L201-Y234 PolarHBondContact O-OH 3.49Å; P204-Y234 HydrophobicContact CB-CD2 4.36Å; P204-Y234 HydrophobicContact CB-CE2 4.02Å; P204-Y234 HydrophobicContact CG-CD2 4.45Å; P204-Y234 HydrophobicContact CG-CE2 3.94Å; Q205-Y234 HydrophobicContact CG-CD1 4.32Å; Q205-Y234 HydrophobicContact CG-CE1 3.37Å; Q205-Y234 WeakPolarHBondContact CG-OH 3.48Å; W224-Y234 HydrophobicContact CH2-CD1 4.12Å; W224-Y234 AromaticContact CH2-CD2 3.75Å; W224-Y234 HydrophobicContact CH2-CD2 3.75Å; W224-Y234 HydrophobicContact CH2-CE2 4.45Å; W224-Y234 AromaticContact CH2-CG 3.55Å; W224-Y234 HydrophobicContact CH2-CG 3.55Å; W224-Y234 AromaticContact CZ2-CD1 3.76Å; W224-Y234 HydrophobicContact CZ2-CD1 3.76Å; W224-Y234 HydrophobicContact CZ2-CD2 4.24Å; W224-Y234 HydrophobicContact CZ2-CE1 4.4Å; W224-Y234 AromaticContact CZ2-CG 3.67Å; W224-Y234 HydrophobicContact CZ2-CG 3.67Å; Q230-Y234 WeakPolarHBondContact O-CB 3.14Å; Q230-Y234 PolarHBondContact O-N 3.41Å; H231-Y234 PolarHBondContact O-N 3.36Å; F232-Y234 VanDerWaalsContact C-N 3.34Å; F232-Y234 PolarHBondContact O-N 3.03Å; Y234-I236 VanDerWaalsContact C-N 3.33Å; Y234-I236 PolarHBondContact O-N 3.45Å; Y234-I237 WeakPolarHBondContact O-CB 3.49Å; Y234-I237 PolarHBondContact O-N 3.28Å; Y234-V238 HydrophobicContact CD1-CG2 4.09Å; Y234-V238 HydrophobicContact CE1-CG2 3.54Å; Y234-V238 HydrophobicContact CE2-CG2 4.11Å; Y234-V238 WeakPolarHBondContact O-CG2 3.3Å; Y234-V238 PolarHBondContact O-N 2.83Å |
| 235 | H | 84.9 | Confident | 85.6 | Confident | 24 Ų | 24 | 58.9 Ų | 58.9 | 11% | 0.111 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -62.5 | -39.9 | 179.6 | -162.4 | 83.9 | 0 | 0 | 0 | 112.2 | H231 F232 T233 V238 I239 F306 | H231-H235 WeakPolarHBondContact O-CB 3.49Å; H231-H235 PolarHBondContact O-N 3.48Å; F232-H235 PolarHBondContact O-N 3.05Å; F232-H235 VanDerWaalsContact O-N 3.12Å; T233-H235 VanDerWaalsContact C-N 3.34Å; T233-H235 PolarHBondContact O-N 3.47Å; H235-V238 PolarHBondContact O-N 2.9Å; H235-I239 VanDerWaalsContact CD2-CD1 3.47Å; H235-I239 WeakPolarHBondContact CD2-CD1 3.36Å; H235-I239 WeakPolarHBondContact O-CG1 3.12Å; H235-I239 PolarHBondContact O-N 3.26Å; H235-F306 AromaticContact CE1-CD1 3.51Å; H235-F306 AromaticContact CE1-CD2 3.87Å; H235-F306 AromaticContact CE1-CE1 3.97Å; H235-F306 AromaticContact CE1-CG 3.41Å; H235-F306 VanDerWaalsContact CE1-CG 3.41Å; H235-F306 WeakPolarHBondContact CE1-CG 3.45Å; H235-F306 WeakPolarHBondContact NE2-CB 3.39Å; H235-F306 AromaticContact NE2-CD1 3.84Å; H235-F306 AromaticContact NE2-CD2 3.87Å; H235-F306 AromaticContact NE2-CG 3.34Å; H235-F306 VanDerWaalsContact NE2-CG 3.34Å; H235-F306 WeakPolarHBondContact NE2-CG 3.37Å |
| 236 | I | 89.6 | Confident | 86.4 | Confident | 55 Ų | 55 | 55 Ų | 55 | 28% | 0.282 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -61.7 | -44.1 | 174.1 | -67.2 | -61.8 | 0 | 0 | 0 | 111.4 | F232 T233 Y234 V238 I239 I240 | F232-I236 HydrophobicContact CD1-CG1 4.26Å; F232-I236 HydrophobicContact CE1-CD1 4.35Å; F232-I236 HydrophobicContact CE1-CG1 3.89Å; F232-I236 HydrophobicContact CE2-CD1 4.16Å; F232-I236 HydrophobicContact CE2-CG1 4.24Å; F232-I236 HydrophobicContact CZ-CD1 3.87Å; F232-I236 HydrophobicContact CZ-CG1 3.89Å; F232-I236 WeakPolarHBondContact O-CG1 3.46Å; F232-I236 PolarHBondContact O-N 2.89Å; T233-I236 PolarHBondContact O-N 3.5Å; Y234-I236 VanDerWaalsContact C-N 3.33Å; Y234-I236 PolarHBondContact O-N 3.45Å; I236-V238 VanDerWaalsContact C-N 3.31Å; I236-V238 PolarHBondContact O-N 3.47Å; I236-I239 PolarHBondContact O-N 3.28Å; I236-I240 HydrophobicContact CG2-CD1 3.85Å; I236-I240 HydrophobicContact CG2-CG1 4.49Å; I236-I240 WeakPolarHBondContact O-CG1 3.44Å; I236-I240 PolarHBondContact O-N 3.33Å |
| 237 | I | 92.3 | Very high | 87.4 | Confident | 79 Ų | 79 | 49.3 Ų | 49.3 | 41% | 0.405 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -59.2 | -44.5 | 175.6 | -67.5 | 165.9 | 0 | 0 | 0 | 110.6 | L201 T233 Y234 I240 L241 | L201-I237 HydrophobicContact CD1-CG2 4.37Å; T233-I237 HydrophobicContact CG2-CD1 4.21Å; T233-I237 WeakPolarHBondContact O-CG1 3.36Å; T233-I237 PolarHBondContact O-N 3.29Å; Y234-I237 WeakPolarHBondContact O-CB 3.49Å; Y234-I237 PolarHBondContact O-N 3.28Å; I237-I240 PolarHBondContact O-N 3.41Å; I237-L241 HydrophobicContact CG2-CD1 3.84Å; I237-L241 HydrophobicContact CG2-CG 4.43Å; I237-L241 WeakPolarHBondContact O-CG 3.39Å; I237-L241 PolarHBondContact O-N 3.42Å |
| 238 | V | 89.6 | Confident | 88.3 | Confident | 13 Ų | 13 | 53.6 Ų | 53.6 | 8% | 0.079 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -61.2 | -45.3 | 176.8 | 171.8 | 0 | 0 | 0 | 0 | 111.1 | L201 Y234 H235 I236 I240 L241 V242 | L201-V238 HydrophobicContact CD1-CG2 4.16Å; L201-V238 HydrophobicContact CG-CG2 4.34Å; Y234-V238 HydrophobicContact CD1-CG2 4.09Å; Y234-V238 HydrophobicContact CE1-CG2 3.54Å; Y234-V238 HydrophobicContact CE2-CG2 4.11Å; Y234-V238 WeakPolarHBondContact O-CG2 3.3Å; Y234-V238 PolarHBondContact O-N 2.83Å; H235-V238 PolarHBondContact O-N 2.9Å; I236-V238 VanDerWaalsContact C-N 3.31Å; I236-V238 PolarHBondContact O-N 3.47Å; V238-I240 VanDerWaalsContact C-N 3.33Å; V238-I240 PolarHBondContact O-N 3.3Å; V238-L241 PolarHBondContact O-N 3.13Å; V238-V242 HydrophobicContact CG1-CB 4.4Å; V238-V242 HydrophobicContact CG1-CG2 3.94Å; V238-V242 WeakPolarHBondContact O-CB 3.47Å; V238-V242 WeakPolarHBondContact O-CG2 3.34Å; V238-V242 PolarHBondContact O-N 3.06Å |
| 239 | I | 91.1 | Very high | 89.4 | Confident | 12 Ų | 12 | 54.3 Ų | 54.3 | 6% | 0.062 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -59.8 | -44.8 | 176.6 | -69.8 | 176.3 | 0 | 0 | 0 | 110.9 | H235 I236 L241 Y243 C244 H303 I307 | H235-I239 VanDerWaalsContact CD2-CD1 3.47Å; H235-I239 WeakPolarHBondContact CD2-CD1 3.36Å; H235-I239 WeakPolarHBondContact O-CG1 3.12Å; H235-I239 PolarHBondContact O-N 3.26Å; I236-I239 PolarHBondContact O-N 3.28Å; I239-L241 PolarHBondContact O-N 2.64Å; I239-Y243 WeakPolarHBondContact O-CA 3.12Å; I239-Y243 VanDerWaalsContact O-CB 3.23Å; I239-Y243 WeakPolarHBondContact O-CB 3.24Å; I239-Y243 PolarHBondContact O-N 3.42Å; I239-C244 PolarHBondContact O-N 3.11Å; I239-H303 HydrophobicContact CD1-CB 4.19Å; I239-H303 HydrophobicContact CG1-CB 4.43Å; I239-I307 HydrophobicContact CD1-CD1 3.85Å; I239-I307 HydrophobicContact CD1-CG1 3.82Å |
| 240 | I | 94 | Very high | 90 | Very high | 85 Ų | 85 | 46 Ų | 46 | 44% | 0.436 | 24% | 0.235 | S | C | . | . | I | π-helix | trans | -61.7 | -48.3 | -179.8 | -69.3 | 167.7 | 0 | 0 | 0 | 110.4 | I236 I237 V238 C244 F245 | I236-I240 HydrophobicContact CG2-CD1 3.85Å; I236-I240 HydrophobicContact CG2-CG1 4.49Å; I236-I240 WeakPolarHBondContact O-CG1 3.44Å; I236-I240 PolarHBondContact O-N 3.33Å; I237-I240 PolarHBondContact O-N 3.41Å; V238-I240 VanDerWaalsContact C-N 3.33Å; V238-I240 PolarHBondContact O-N 3.3Å; I240-C244 PolarHBondContact O-N 3.26Å; I240-F245 WeakPolarHBondContact O-CB 3.43Å; I240-F245 PolarHBondContact O-N 3.06Å |
| 241 | L | 93.9 | Very high | 90.6 | Very high | 60 Ų | 60 | 45.2 Ų | 45.2 | 31% | 0.314 | 24% | 0.24 | S | C | . | . | I | π-helix | trans | -78.8 | -36.5 | -174.3 | -66.5 | 178 | 0 | 0 | 0 | 113.9 | Y161 L201 I237 V238 I239 P246 | Y161-L241 WeakPolarHBondContact CE2-O 3.3Å; Y161-L241 PolarHBondContact OH-O 3.41Å; L201-L241 HydrophobicContact CD1-CD1 3.99Å; L201-L241 HydrophobicContact CD2-CB 4.43Å; L201-L241 HydrophobicContact CD2-CD1 4.48Å; I237-L241 HydrophobicContact CG2-CD1 3.84Å; I237-L241 HydrophobicContact CG2-CG 4.43Å; I237-L241 WeakPolarHBondContact O-CG 3.39Å; I237-L241 PolarHBondContact O-N 3.42Å; V238-L241 PolarHBondContact O-N 3.13Å; I239-L241 PolarHBondContact O-N 2.64Å; L241-P246 WeakPolarHBondContact O-CD 3.44Å |
| 242 | V | 92 | Very high | 91.2 | Very high | 5 Ų | 5 | 47.5 Ų | 47.5 | 3% | 0.03 | 26% | 0.255 | C | S | . | . | I | π-helix | trans | -91.2 | -23 | -174.9 | -179.2 | 0 | 0 | 0 | 0 | 112 | V156 F157 I160 L201 V238 P246 | V156-V242 HydrophobicContact CB-CG1 4.13Å; V156-V242 HydrophobicContact CG1-CG1 3.39Å; F157-V242 HydrophobicContact CB-CG2 4.35Å; F157-V242 HydrophobicContact CD2-CG2 3.92Å; I160-V242 HydrophobicContact CG2-CG1 4.46Å; L201-V242 HydrophobicContact CD2-CG2 3.79Å; V238-V242 HydrophobicContact CG1-CB 4.4Å; V238-V242 HydrophobicContact CG1-CG2 3.94Å; V238-V242 WeakPolarHBondContact O-CB 3.47Å; V238-V242 WeakPolarHBondContact O-CG2 3.34Å; V238-V242 PolarHBondContact O-N 3.06Å; V242-P246 WeakPolarHBondContact O-CG 3.45Å |
| 243 | Y | 92.5 | Very high | 91.7 | Very high | 27 Ų | 27 | 44.6 Ų | 44.6 | 11% | 0.106 | 24% | 0.244 | C | C | . | . | I | π-helix | trans | -121.1 | -67.1 | -175.7 | -172.7 | -100.3 | 0 | 0 | 0 | 112.5 | I239 P246 L247 F295 A296 W299 L300 H303 | I239-Y243 WeakPolarHBondContact O-CA 3.12Å; I239-Y243 VanDerWaalsContact O-CB 3.23Å; I239-Y243 WeakPolarHBondContact O-CB 3.24Å; I239-Y243 PolarHBondContact O-N 3.42Å; Y243-P246 WeakPolarHBondContact O-CD 3.24Å; Y243-P246 WeakPolarHBondContact O-CG 3.32Å; Y243-L247 HydrophobicContact CD1-CD1 3.95Å; Y243-L247 HydrophobicContact CD2-CD1 3.75Å; Y243-L247 HydrophobicContact CE1-CD1 3.63Å; Y243-L247 HydrophobicContact CE2-CD1 3.43Å; Y243-L247 VanDerWaalsContact CE2-CD1 3.43Å; Y243-L247 HydrophobicContact CG-CD1 3.98Å; Y243-L247 WeakPolarHBondContact O-CB 3.46Å; Y243-L247 WeakPolarHBondContact O-CG 3.19Å; Y243-L247 PolarHBondContact O-N 2.96Å; Y243-L247 VanDerWaalsContact O-N 3.14Å; Y243-F295 HydrophobicContact CD2-CE1 4.17Å; Y243-A296 PolarHBondContact OH-O 2.89Å; Y243-A296 VanDerWaalsContact OH-O 3.12Å; Y243-W299 HydrophobicContact CD2-CB 3.91Å; Y243-W299 HydrophobicContact CE2-CB 3.8Å; Y243-L300 HydrophobicContact CE1-CD1 4.35Å; Y243-H303 AromaticContact CD2-CD2 3.6Å; Y243-H303 AromaticContact CD2-NE2 3.8Å; Y243-H303 AromaticContact CG-CD2 3.64Å; Y243-H303 AromaticContact CG-NE2 3.87Å |
| 244 | C | 94.6 | Very high | 91.7 | Very high | 62 Ų | 62 | 41.6 Ų | 41.6 | 42% | 0.419 | 22% | 0.224 | S | C | . | . | I | π-helix | trans | -66.3 | -50 | -169 | -61.2 | 0 | 0 | 0 | 0 | 113.8 | I239 I240 L247 L248 | I239-C244 PolarHBondContact O-N 3.11Å; I240-C244 PolarHBondContact O-N 3.26Å; C244-L247 PolarHBondContact O-N 2.78Å; C244-L248 WeakPolarHBondContact O-CB 3.34Å; C244-L248 PolarHBondContact O-N 3.27Å |
| 245 | F | 94.9 | Very high | 91.8 | Very high | 95 Ų | 95 | 44.6 Ų | 44.6 | 42% | 0.417 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -61.6 | -51.8 | -177.4 | 179.9 | -103.2 | 0 | 0 | 0 | 113.3 | Y161 I240 L247 L248 I249 | Y161-F245 HydrophobicContact CE1-CE1 4.45Å; I240-F245 WeakPolarHBondContact O-CB 3.43Å; I240-F245 PolarHBondContact O-N 3.06Å; F245-L247 PolarHBondContact O-N 3.28Å; F245-L248 WeakPolarHBondContact O-CB 3.42Å; F245-L248 PolarHBondContact O-N 2.91Å; F245-I249 HydrophobicContact CD1-CD1 3.94Å; F245-I249 HydrophobicContact CE1-CD1 3.41Å; F245-I249 VanDerWaalsContact CE1-CD1 3.41Å; F245-I249 HydrophobicContact CE2-CD1 4.12Å; F245-I249 HydrophobicContact CZ-CD1 3.53Å; F245-I249 HydrophobicContact CZ-CG1 4.5Å; F245-I249 PolarHBondContact O-N 3.46Å; F245-I249 VanDerWaalsContact O-N 3.1Å |
| 246 | P | 94.1 | Very high | 92.1 | Very high | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -67.8 | -35.6 | 177.9 | 24.8 | -33.8 | 0 | 0 | 0 | 112.4 | I160 T164 L241 V242 Y243 L248 I249 M250 | I160-P246 HydrophobicContact CD1-CB 4.5Å; I160-P246 HydrophobicContact CG1-CB 3.65Å; I160-P246 HydrophobicContact CG1-CG 3.59Å; I160-P246 HydrophobicContact CG2-CB 4.49Å; I160-P246 HydrophobicContact CG2-CG 4.13Å; T164-P246 WeakPolarHBondContact OG1-CB 3.44Å; L241-P246 WeakPolarHBondContact O-CD 3.44Å; V242-P246 WeakPolarHBondContact O-CG 3.45Å; Y243-P246 WeakPolarHBondContact O-CD 3.24Å; Y243-P246 WeakPolarHBondContact O-CG 3.32Å; P246-L248 VanDerWaalsContact C-N 3.3Å; P246-L248 PolarHBondContact O-N 3.24Å; P246-I249 PolarHBondContact O-N 3.13Å; P246-M250 WeakPolarHBondContact O-CB 2.99Å; P246-M250 VanDerWaalsContact O-CG 3.31Å; P246-M250 WeakPolarHBondContact O-CG 3.4Å; P246-M250 PolarHBondContact O-N 2.66Å |
| 247 | L | 93.2 | Very high | 91.9 | Very high | 29 Ų | 29 | 44 Ų | 44 | 15% | 0.152 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -62.6 | -38 | 173.8 | -77.4 | 177.6 | 0 | 0 | 0 | 112.2 | Y243 C244 F245 M250 G251 V292 F295 A296 | Y243-L247 HydrophobicContact CD1-CD1 3.95Å; Y243-L247 HydrophobicContact CD2-CD1 3.75Å; Y243-L247 HydrophobicContact CE1-CD1 3.63Å; Y243-L247 HydrophobicContact CE2-CD1 3.43Å; Y243-L247 VanDerWaalsContact CE2-CD1 3.43Å; Y243-L247 HydrophobicContact CG-CD1 3.98Å; Y243-L247 WeakPolarHBondContact O-CB 3.46Å; Y243-L247 WeakPolarHBondContact O-CG 3.19Å; Y243-L247 PolarHBondContact O-N 2.96Å; Y243-L247 VanDerWaalsContact O-N 3.14Å; C244-L247 PolarHBondContact O-N 2.78Å; F245-L247 PolarHBondContact O-N 3.28Å; L247-M250 HydrophobicContact CD2-CE 3.94Å; L247-G251 WeakPolarHBondContact O-CA 3.38Å; L247-G251 PolarHBondContact O-N 3.41Å; L247-V292 HydrophobicContact CD2-CG1 3.88Å; L247-F295 HydrophobicContact CD2-CD1 4.24Å; L247-A296 HydrophobicContact CD1-CB 4.06Å; L247-A296 HydrophobicContact CD2-CB 3.96Å |
| 248 | L | 94.6 | Very high | 91.6 | Very high | 113 Ų | 113 | 41.3 Ų | 41.3 | 59% | 0.592 | 23% | 0.234 | S | C | * | . | H | α-helix | trans | -62.4 | -49.8 | 174.6 | 179.3 | 65.5 | 0 | 0 | 0 | 111.1 | C244 F245 P246 M250 G251 V252 | C244-L248 WeakPolarHBondContact O-CB 3.34Å; C244-L248 PolarHBondContact O-N 3.27Å; F245-L248 WeakPolarHBondContact O-CB 3.42Å; F245-L248 PolarHBondContact O-N 2.91Å; P246-L248 VanDerWaalsContact C-N 3.3Å; P246-L248 PolarHBondContact O-N 3.24Å; L248-M250 PolarHBondContact O-N 3.14Å; L248-G251 PolarHBondContact O-N 3.05Å; L248-V252 HydrophobicContact CD1-CG2 4.23Å; L248-V252 WeakPolarHBondContact O-CG2 3.31Å; L248-V252 PolarHBondContact O-N 2.79Å |
| 249 | I | 94.1 | Very high | 91.5 | Very high | 51 Ų | 51 | 46.1 Ų | 46.1 | 26% | 0.262 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -59.7 | -47.8 | 178.8 | -66 | 171.1 | 0 | 0 | 0 | 110.6 | T164 V168 F245 P246 T253 | T164-I249 HydrophobicContact CG2-CB 3.98Å; T164-I249 HydrophobicContact CG2-CD1 4.33Å; T164-I249 HydrophobicContact CG2-CG2 3.55Å; V168-I249 HydrophobicContact CG2-CG2 4.43Å; F245-I249 HydrophobicContact CD1-CD1 3.94Å; F245-I249 HydrophobicContact CE1-CD1 3.41Å; F245-I249 VanDerWaalsContact CE1-CD1 3.41Å; F245-I249 HydrophobicContact CE2-CD1 4.12Å; F245-I249 HydrophobicContact CZ-CD1 3.53Å; F245-I249 HydrophobicContact CZ-CG1 4.5Å; F245-I249 PolarHBondContact O-N 3.46Å; F245-I249 VanDerWaalsContact O-N 3.1Å; P246-I249 PolarHBondContact O-N 3.13Å; I249-T253 HydrophobicContact CG2-CG2 4.34Å; I249-T253 WeakPolarHBondContact O-CB 3.18Å; I249-T253 VanDerWaalsContact O-CG2 3.29Å; I249-T253 WeakPolarHBondContact O-CG2 3.43Å; I249-T253 PolarHBondContact O-N 3.48Å; I249-T253 PolarHBondContact O-OG1 3.36Å |
| 250 | M | 91.6 | Very high | 91.2 | Very high | 0 Ų | 0 | 49.1 Ų | 49.1 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -63.4 | -44.1 | 178.1 | -71.8 | -168.4 | -63.4 | 0 | 0 | 111.5 | I160 M163 T164 A167 P246 L247 L248 V252 T253 Y254 V292 | I160-M250 HydrophobicContact CD1-CE 3.38Å; I160-M250 HydrophobicContact CD1-SD 4.45Å; I160-M250 HydrophobicContact CG1-CE 4.31Å; M163-M250 HydrophobicContact CB-SD 3.89Å; M163-M250 HydrophobicContact CE-CE 4.47Å; M163-M250 HydrophobicContact CE-SD 4.24Å; T164-M250 HydrophobicContact CG2-CG 4.38Å; A167-M250 HydrophobicContact CB-CG 4.06Å; P246-M250 WeakPolarHBondContact O-CB 2.99Å; P246-M250 VanDerWaalsContact O-CG 3.31Å; P246-M250 WeakPolarHBondContact O-CG 3.4Å; P246-M250 PolarHBondContact O-N 2.66Å; L247-M250 HydrophobicContact CD2-CE 3.94Å; L248-M250 PolarHBondContact O-N 3.14Å; M250-V252 PolarHBondContact O-N 3.49Å; M250-T253 WeakPolarHBondContact CA-OG1 3.47Å; M250-T253 PolarHBondContact O-N 2.82Å; M250-T253 PolarHBondContact O-OG1 2.97Å; M250-T253 VanDerWaalsContact O-OG1 3.05Å; M250-Y254 HydrophobicContact CB-CD2 4.08Å; M250-Y254 HydrophobicContact CB-CE2 3.91Å; M250-Y254 HydrophobicContact CG-CE2 4.23Å; M250-Y254 WeakPolarHBondContact O-CB 3.18Å; M250-Y254 WeakPolarHBondContact O-CD2 3.37Å; M250-Y254 PolarHBondContact O-N 2.94Å; M250-V292 HydrophobicContact CB-CG1 4.32Å; M250-V292 HydrophobicContact CB-CG2 4.13Å; M250-V292 HydrophobicContact CE-CG1 4.2Å; M250-V292 HydrophobicContact CE-CG2 4.15Å; M250-V292 HydrophobicContact CG-CG2 4.47Å; M250-V292 HydrophobicContact SD-CG2 3.69Å |
| 251 | G | 91.1 | Very high | 90.6 | Very high | 30 Ų | 30 | 45.6 Ų | 45.6 | 31% | 0.309 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -58.2 | -49.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | L247 L248 T255 | L247-G251 WeakPolarHBondContact O-CA 3.38Å; L247-G251 PolarHBondContact O-N 3.41Å; L248-G251 PolarHBondContact O-N 3.05Å; G251-T255 VanDerWaalsContact O-CB 3.25Å; G251-T255 WeakPolarHBondContact O-CB 3.07Å; G251-T255 PolarHBondContact O-N 2.95Å; G251-T255 PolarHBondContact O-OG1 3.24Å |
| 252 | V | 92.1 | Very high | 90.1 | Very high | 77 Ų | 77 | 51.1 Ų | 51.1 | 47% | 0.467 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -62.8 | -51.4 | 177.6 | 173 | 0 | 0 | 0 | 0 | 111 | L248 M250 Y254 T255 I256 | L248-V252 HydrophobicContact CD1-CG2 4.23Å; L248-V252 WeakPolarHBondContact O-CG2 3.31Å; L248-V252 PolarHBondContact O-N 2.79Å; M250-V252 PolarHBondContact O-N 3.49Å; V252-Y254 PolarHBondContact O-N 3.43Å; V252-T255 PolarHBondContact O-N 3.29Å; V252-I256 HydrophobicContact CG1-CD1 3.85Å; V252-I256 WeakPolarHBondContact O-CG1 3.25Å; V252-I256 PolarHBondContact O-N 3.42Å |
| 253 | T | 90.7 | Very high | 89.1 | Confident | 18 Ų | 18 | 53.7 Ų | 53.7 | 11% | 0.11 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -61.4 | -43.8 | -177.6 | 50.8 | 0 | 0 | 0 | 0 | 112.4 | I249 M250 V257 | I249-T253 HydrophobicContact CG2-CG2 4.34Å; I249-T253 WeakPolarHBondContact O-CB 3.18Å; I249-T253 VanDerWaalsContact O-CG2 3.29Å; I249-T253 WeakPolarHBondContact O-CG2 3.43Å; I249-T253 PolarHBondContact O-N 3.48Å; I249-T253 PolarHBondContact O-OG1 3.36Å; M250-T253 WeakPolarHBondContact CA-OG1 3.47Å; M250-T253 PolarHBondContact O-N 2.82Å; M250-T253 PolarHBondContact O-OG1 2.97Å; M250-T253 VanDerWaalsContact O-OG1 3.05Å; T253-V257 WeakPolarHBondContact O-CB 3.49Å; T253-V257 WeakPolarHBondContact O-CG2 3.49Å; T253-V257 PolarHBondContact O-N 3.2Å |
| 254 | Y | 88 | Confident | 88 | Confident | 17 Ų | 17 | 54.7 Ų | 54.7 | 7% | 0.067 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -73.1 | -30.3 | 178 | -68.7 | -55 | 0 | 0 | 0 | 113.5 | A167 M250 V252 G258 M288 I289 V292 | A167-Y254 VanDerWaalsContact CA-OH 3.29Å; A167-Y254 WeakPolarHBondContact CA-OH 3.35Å; A167-Y254 HydrophobicContact CB-CE1 4.09Å; A167-Y254 HydrophobicContact CB-CE2 3.63Å; A167-Y254 WeakPolarHBondContact CB-OH 3.43Å; M250-Y254 HydrophobicContact CB-CD2 4.08Å; M250-Y254 HydrophobicContact CB-CE2 3.91Å; M250-Y254 HydrophobicContact CG-CE2 4.23Å; M250-Y254 WeakPolarHBondContact O-CB 3.18Å; M250-Y254 WeakPolarHBondContact O-CD2 3.37Å; M250-Y254 PolarHBondContact O-N 2.94Å; V252-Y254 PolarHBondContact O-N 3.43Å; Y254-G258 WeakPolarHBondContact O-CA 3.22Å; Y254-G258 PolarHBondContact O-N 3.06Å; Y254-M288 HydrophobicContact CD1-CB 4.37Å; Y254-M288 HydrophobicContact CE1-CB 3.49Å; Y254-M288 VanDerWaalsContact CE1-CB 3.49Å; Y254-M288 HydrophobicContact CE1-CE 3.69Å; Y254-M288 HydrophobicContact CE1-CG 4.34Å; Y254-M288 HydrophobicContact CE1-SD 4.04Å; Y254-M288 WeakPolarHBondContact OH-CE 3.28Å; Y254-I289 HydrophobicContact CG-CG1 4.29Å; Y254-V292 HydrophobicContact CD2-CG2 3.88Å; Y254-V292 HydrophobicContact CE2-CG2 3.4Å; Y254-V292 VanDerWaalsContact CE2-CG2 3.4Å |
| 255 | T | 89.5 | Confident | 86.2 | Confident | 85 Ų | 85 | 60.8 Ų | 60.8 | 52% | 0.521 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -64.9 | -47.2 | 174.1 | -59.4 | 0 | 0 | 0 | 0 | 110.3 | G251 V252 V257 G258 I259 | G251-T255 VanDerWaalsContact O-CB 3.25Å; G251-T255 WeakPolarHBondContact O-CB 3.07Å; G251-T255 PolarHBondContact O-N 2.95Å; G251-T255 PolarHBondContact O-OG1 3.24Å; V252-T255 PolarHBondContact O-N 3.29Å; T255-V257 PolarHBondContact O-N 3.42Å; T255-G258 PolarHBondContact O-N 2.73Å; T255-I259 HydrophobicContact CG2-CD1 3.9Å; T255-I259 WeakPolarHBondContact O-CG1 3.46Å; T255-I259 PolarHBondContact O-N 3.48Å |
| 256 | I | 89.8 | Confident | 84.6 | Confident | 65 Ų | 65 | 60.8 Ų | 60.8 | 33% | 0.333 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -60 | -50.3 | 176.3 | -62.9 | 164.5 | 0 | 0 | 0 | 110.3 | Y171 I175 V252 G258 I259 T260 | Y171-I256 HydrophobicContact CD2-CG2 4.49Å; Y171-I256 HydrophobicContact CE2-CB 4.29Å; Y171-I256 HydrophobicContact CE2-CD1 4.22Å; Y171-I256 HydrophobicContact CE2-CG2 3.85Å; I175-I256 HydrophobicContact CD1-CG2 4.29Å; I175-I256 HydrophobicContact CG1-CG2 4.49Å; V252-I256 HydrophobicContact CG1-CD1 3.85Å; V252-I256 WeakPolarHBondContact O-CG1 3.25Å; V252-I256 PolarHBondContact O-N 3.42Å; I256-G258 VanDerWaalsContact C-N 3.26Å; I256-G258 PolarHBondContact O-N 3.27Å; I256-I259 PolarHBondContact O-N 3.38Å; I256-T260 PolarHBondContact O-N 3.37Å; I256-T260 PolarHBondContact O-OG1 2.95Å; I256-T260 VanDerWaalsContact O-OG1 3.06Å |
| 257 | V | 86.6 | Confident | 82.7 | Confident | 1 Ų | 1 | 65.1 Ų | 65.1 | 1% | 0.006 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -60.2 | -38.1 | 178.7 | 171.2 | 0 | 0 | 0 | 0 | 111.8 | Y171 I174 I175 T253 T255 L261 V285 | Y171-V257 HydrophobicContact CD2-CG2 4Å; I174-V257 HydrophobicContact CD1-CG1 3.54Å; I174-V257 HydrophobicContact CG2-CG1 4.44Å; I175-V257 HydrophobicContact CG1-CG2 4.47Å; T253-V257 WeakPolarHBondContact O-CB 3.49Å; T253-V257 WeakPolarHBondContact O-CG2 3.49Å; T253-V257 PolarHBondContact O-N 3.2Å; T255-V257 PolarHBondContact O-N 3.42Å; V257-L261 HydrophobicContact CG1-CD1 3.83Å; V257-L261 WeakPolarHBondContact O-CB 3.18Å; V257-L261 WeakPolarHBondContact O-CG 3.38Å; V257-L261 PolarHBondContact O-N 3.07Å; V257-L261 VanDerWaalsContact O-N 3.07Å; V257-V285 HydrophobicContact CG1-CB 4.33Å; V257-V285 HydrophobicContact CG1-CG1 3.88Å; V257-V285 HydrophobicContact CG1-CG2 3.49Å; V257-V285 VanDerWaalsContact CG1-CG2 3.49Å |
| 258 | G | 86.1 | Confident | 81 | Confident | 22 Ų | 22 | 67.2 Ų | 67.2 | 23% | 0.227 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -63.8 | -49.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y254 T255 I256 T260 L261 W262 | Y254-G258 WeakPolarHBondContact O-CA 3.22Å; Y254-G258 PolarHBondContact O-N 3.06Å; T255-G258 PolarHBondContact O-N 2.73Å; I256-G258 VanDerWaalsContact C-N 3.26Å; I256-G258 PolarHBondContact O-N 3.27Å; G258-T260 PolarHBondContact O-N 2.97Å; G258-L261 PolarHBondContact O-N 3.3Å; G258-W262 WeakPolarHBondContact O-CB 3.38Å; G258-W262 PolarHBondContact O-N 3.04Å |
| 259 | I | 87 | Confident | 79.2 | Confident | 114 Ų | 114 | 70.4 Ų | 70.4 | 59% | 0.585 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -61.1 | -45.6 | 177.5 | -66.1 | 166.9 | 0 | 0 | 0 | 110.3 | T255 I256 L261 W262 G263 | T255-I259 HydrophobicContact CG2-CD1 3.9Å; T255-I259 WeakPolarHBondContact O-CG1 3.46Å; T255-I259 PolarHBondContact O-N 3.48Å; I256-I259 PolarHBondContact O-N 3.38Å; I259-L261 VanDerWaalsContact C-N 3.34Å; I259-L261 PolarHBondContact O-N 3.17Å; I259-W262 PolarHBondContact O-N 3.42Å; I259-G263 VanDerWaalsContact O-CA 3.3Å; I259-G263 WeakPolarHBondContact O-CA 3.15Å; I259-G263 PolarHBondContact O-N 3.05Å |
| 260 | T | 84.4 | Confident | 77.8 | Confident | 75 Ų | 75 | 70.3 Ų | 70.3 | 46% | 0.46 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -64.6 | -36.2 | 179.9 | -53.5 | 0 | 0 | 0 | 0 | 112.9 | I175 I256 G258 | I175-T260 HydrophobicContact CD1-CG2 3.69Å; I175-T260 VanDerWaalsContact CD1-OG1 3.23Å; I175-T260 WeakPolarHBondContact CD1-OG1 3.36Å; I256-T260 PolarHBondContact O-N 3.37Å; I256-T260 PolarHBondContact O-OG1 2.95Å; I256-T260 VanDerWaalsContact O-OG1 3.06Å; G258-T260 PolarHBondContact O-N 2.97Å |
| 261 | L | 82.6 | Confident | 76.6 | Confident | 12 Ų | 12 | 74.5 Ų | 74.5 | 6% | 0.063 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -79.8 | -24.1 | -179.4 | -77.8 | 170.7 | 0 | 0 | 0 | 114.2 | I174 V257 G258 I259 L278 K281 R282 V285 | I174-L261 HydrophobicContact CD1-CD1 4.25Å; I174-L261 HydrophobicContact CG2-CD2 4.32Å; I174-L261 HydrophobicContact CG2-CG 4.26Å; V257-L261 HydrophobicContact CG1-CD1 3.83Å; V257-L261 WeakPolarHBondContact O-CB 3.18Å; V257-L261 WeakPolarHBondContact O-CG 3.38Å; V257-L261 PolarHBondContact O-N 3.07Å; V257-L261 VanDerWaalsContact O-N 3.07Å; G258-L261 PolarHBondContact O-N 3.3Å; I259-L261 VanDerWaalsContact C-N 3.34Å; I259-L261 PolarHBondContact O-N 3.17Å; L261-L278 HydrophobicContact CD2-CD2 4.2Å; L261-K281 HydrophobicContact CD2-CB 3.99Å; L261-K281 HydrophobicContact CD2-CD 4.36Å; L261-R282 HydrophobicContact CB-CG 4.25Å; L261-R282 VanDerWaalsContact O-CZ 3.31Å; L261-R282 PolarHBondContact O-NE 3.47Å; L261-R282 PolarHBondContact O-NH2 3.45Å; L261-V285 HydrophobicContact CD1-CB 4.13Å; L261-V285 HydrophobicContact CD1-CG1 4.5Å; L261-V285 HydrophobicContact CD1-CG2 3.57Å |
| 262 | W | 83.5 | Confident | 75.7 | Confident | 175 Ų | 175 | 79.3 Ų | 79.3 | 66% | 0.663 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -109.4 | -23.8 | -176 | -124.9 | -90.4 | 0 | 0 | 0 | 114.3 | G258 I259 R282 | G258-W262 WeakPolarHBondContact O-CB 3.38Å; G258-W262 PolarHBondContact O-N 3.04Å; I259-W262 PolarHBondContact O-N 3.42Å; W262-R282 HydrophobicContact CE3-CG 3.76Å; W262-R282 HydrophobicContact CH2-CB 4.2Å; W262-R282 HydrophobicContact CH2-CG 4.11Å; W262-R282 HydrophobicContact CZ3-CB 3.64Å; W262-R282 HydrophobicContact CZ3-CG 3.33Å |
| 263 | G | 70.9 | Confident | 74.7 | Confident | 60 Ų | 60 | 82.8 Ų | 82.8 | 62% | 0.619 | 48% | 0.48 | S | S | * | . | S | Bend | trans | -95.7 | -2.6 | -177.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | I259 E265 | I259-G263 VanDerWaalsContact O-CA 3.3Å; I259-G263 WeakPolarHBondContact O-CA 3.15Å; I259-G263 PolarHBondContact O-N 3.05Å; G263-E265 PolarHBondContact O-N 2.86Å |
| 264 | G | 68.2 | Low | 74 | Confident | 48 Ų | 48 | 87.2 Ų | 87.2 | 50% | 0.495 | 50% | 0.495 | S | S | . | . | S | Bend | trans | -73.5 | 117.3 | 170.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | I266 | G264-I266 PolarHBondContact O-N 3.47Š|
| 265 | E | 58.3 | Low | 73.4 | Confident | 190 Ų | 190 | 89.6 Ų | 89.6 | 89% | 0.888 | 51% | 0.507 | S | S | * | . | trans | -58.2 | 128.4 | 163.9 | -84.7 | 179.6 | 144 | 0 | 0 | 108.6 | G263 P267 | G263-E265 PolarHBondContact O-N 2.86Å; E265-P267 WeakPolarHBondContact O-CD 3.44Å | ||
| 266 | I | 59.3 | Low | 72.8 | Confident | 94 Ų | 94 | 92 Ų | 92 | 48% | 0.482 | 51% | 0.512 | S | S | . | . | trans | -75.9 | 108.2 | 178.6 | -60 | 152.3 | 0 | 0 | 0 | 106 | G264 G268 | G264-I266 PolarHBondContact O-N 3.47Å; I266-G268 PolarHBondContact O-N 2.83Å | ||
| 267 | P | 54.7 | Low | 72.2 | Confident | 91 Ų | 91 | 94.6 Ų | 94.6 | 59% | 0.591 | 52% | 0.523 | S | S | * | . | trans | -65.7 | 130.4 | 171.6 | -9.6 | 28 | 0 | 0 | 0 | 107 | E265 T270 | E265-P267 WeakPolarHBondContact O-CD 3.44Å; P267-T270 PolarHBondContact O-OG1 3.42Å | ||
| 268 | G | 58.1 | Low | 71.9 | Confident | 73 Ų | 73 | 95.9 Ų | 95.9 | 75% | 0.753 | 53% | 0.529 | S | S | * | . | S | Bend | trans | -49.5 | 155.6 | -173.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | I266 T270 | I266-G268 PolarHBondContact O-N 2.83Å; G268-T270 PolarHBondContact O-N 3.34Å |
| 269 | D | 57.6 | Low | 71.6 | Confident | 180 Ų | 180 | 101.9 Ų | 101.9 | 96% | 0.963 | 55% | 0.549 | S | S | * | . | trans | 52.6 | 39.8 | 176.6 | -90.3 | 2 | 0 | 0 | 0 | 116.6 | C271 | D269-C271 PolarHBondContact O-N 3.33Š| ||
| 270 | T | 63.9 | Low | 71 | Confident | 50 Ų | 50 | 99.1 Ų | 99.1 | 31% | 0.307 | 54% | 0.544 | S | S | . | . | trans | -83.4 | 113.5 | 166 | 37.6 | 0 | 0 | 0 | 0 | 111.2 | P267 G268 Y274 | P267-T270 PolarHBondContact O-OG1 3.42Å; G268-T270 PolarHBondContact O-N 3.34Å; T270-Y274 HydrophobicContact CG2-CD1 4.43Å | ||
| 271 | C | 65.8 | Low | 70.7 | Confident | 87 Ų | 87 | 100 Ų | 100 | 59% | 0.588 | 54% | 0.541 | S | S | * | . | trans | -23.8 | 130.9 | 171.5 | -176.4 | 0 | 0 | 0 | 0 | 114.1 | D269 K273 Y274 | D269-C271 PolarHBondContact O-N 3.33Å; C271-K273 PolarHBondContact O-N 3.03Å; C271-Y274 WeakPolarHBondContact O-CB 3.42Å; C271-Y274 PolarHBondContact O-N 3.18Å | ||
| 272 | D | 73.1 | Confident | 70.8 | Confident | 132 Ų | 132 | 102.3 Ų | 102.3 | 71% | 0.706 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -38.7 | -34.4 | -179.8 | -66.8 | -43.8 | 0 | 0 | 0 | 114.9 | Y274 H275 E276 | D272-Y274 VanDerWaalsContact C-N 3.32Å; D272-Y274 PolarHBondContact O-N 3.25Å; D272-H275 PolarHBondContact O-N 3.49Å; D272-E276 WeakPolarHBondContact O-CG 3.34Å; D272-E276 PolarHBondContact O-N 3.46Å |
| 273 | K | 70.8 | Confident | 70.8 | Confident | 149 Ų | 149 | 98.2 Ų | 98.2 | 65% | 0.648 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -58 | -36.5 | 176.3 | -64.2 | -178.2 | -178.6 | 175.4 | 0 | 113.7 | C271 Q277 | C271-K273 PolarHBondContact O-N 3.03Å; K273-Q277 VanDerWaalsContact O-CG 3.31Å; K273-Q277 WeakPolarHBondContact O-CG 3.37Å; K273-Q277 PolarHBondContact O-N 3.3Å |
| 274 | Y | 76.1 | Confident | 71.1 | Confident | 112 Ų | 112 | 98 Ų | 98 | 44% | 0.439 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -69.3 | -43.5 | 177.9 | -177.5 | -107 | 0 | 0 | 0 | 111.1 | T270 C271 D272 E276 Q277 L278 | T270-Y274 HydrophobicContact CG2-CD1 4.43Å; C271-Y274 WeakPolarHBondContact O-CB 3.42Å; C271-Y274 PolarHBondContact O-N 3.18Å; D272-Y274 VanDerWaalsContact C-N 3.32Å; D272-Y274 PolarHBondContact O-N 3.25Å; Y274-E276 PolarHBondContact O-N 3.39Å; Y274-Q277 PolarHBondContact O-N 2.94Å; Y274-L278 HydrophobicContact CD1-CD1 3.63Å; Y274-L278 HydrophobicContact CE1-CD1 3.21Å; Y274-L278 HydrophobicContact CE1-CG 4.24Å; Y274-L278 HydrophobicContact CE2-CD1 4.46Å; Y274-L278 HydrophobicContact CG-CD1 4.4Å; Y274-L278 PolarHBondContact O-N 3.48Å |
| 275 | H | 76.2 | Confident | 71.7 | Confident | 67 Ų | 67 | 96 Ų | 96 | 31% | 0.31 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.4 | -41.2 | 173.6 | -79.4 | -68.4 | 0 | 0 | 0 | 112.5 | D272 L278 K279 | D272-H275 PolarHBondContact O-N 3.49Å; H275-L278 PolarHBondContact O-N 2.95Å; H275-K279 WeakPolarHBondContact O-CB 3.13Å; H275-K279 WeakPolarHBondContact O-CG 3.45Å; H275-K279 PolarHBondContact O-N 2.92Å |
| 276 | E | 76.3 | Confident | 72.9 | Confident | 136 Ų | 136 | 93.8 Ų | 93.8 | 64% | 0.636 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -63.2 | -42.9 | 174.8 | -72 | -166 | 155.3 | 0 | 0 | 112.6 | D272 Y274 K279 A280 | D272-E276 WeakPolarHBondContact O-CG 3.34Å; D272-E276 PolarHBondContact O-N 3.46Å; Y274-E276 PolarHBondContact O-N 3.39Å; E276-K279 PolarHBondContact O-N 2.96Å; E276-A280 WeakPolarHBondContact O-CB 3.5Å; E276-A280 PolarHBondContact O-N 3.29Å |
| 277 | Q | 77.4 | Confident | 74 | Confident | 119 Ų | 119 | 90.3 Ų | 90.3 | 56% | 0.556 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -63.8 | -42 | 176.5 | -74.1 | -177.8 | 10.5 | 0 | 0 | 112.2 | K273 Y274 A280 K281 | K273-Q277 VanDerWaalsContact O-CG 3.31Å; K273-Q277 WeakPolarHBondContact O-CG 3.37Å; K273-Q277 PolarHBondContact O-N 3.3Å; Y274-Q277 PolarHBondContact O-N 2.94Å; Q277-A280 PolarHBondContact O-N 2.99Å; Q277-K281 WeakPolarHBondContact O-CG 3.37Å; Q277-K281 PolarHBondContact O-N 3.39Å |
| 278 | L | 79.1 | Confident | 75.3 | Confident | 27 Ų | 27 | 86.4 Ų | 86.4 | 14% | 0.141 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -61.2 | -47.3 | 174.4 | -88 | 161.7 | 0 | 0 | 0 | 111.9 | L261 Y274 H275 A280 K281 R282 | L261-L278 HydrophobicContact CD2-CD2 4.2Å; Y274-L278 HydrophobicContact CD1-CD1 3.63Å; Y274-L278 HydrophobicContact CE1-CD1 3.21Å; Y274-L278 HydrophobicContact CE1-CG 4.24Å; Y274-L278 HydrophobicContact CE2-CD1 4.46Å; Y274-L278 HydrophobicContact CG-CD1 4.4Å; Y274-L278 PolarHBondContact O-N 3.48Å; H275-L278 PolarHBondContact O-N 2.95Å; L278-A280 VanDerWaalsContact C-N 3.29Å; L278-A280 PolarHBondContact O-N 3.23Å; L278-K281 PolarHBondContact O-N 3.36Å; L278-R282 WeakPolarHBondContact O-CB 3.46Å; L278-R282 WeakPolarHBondContact O-CG 3.25Å; L278-R282 PolarHBondContact O-N 3.5Å |
| 279 | K | 79.7 | Confident | 76.7 | Confident | 148 Ų | 148 | 86.2 Ų | 86.2 | 64% | 0.643 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -58.1 | -42.7 | 175.7 | -75.8 | 175.4 | -177.9 | 174.7 | 0 | 111.2 | H275 E276 K283 | H275-K279 WeakPolarHBondContact O-CB 3.13Å; H275-K279 WeakPolarHBondContact O-CG 3.45Å; H275-K279 PolarHBondContact O-N 2.92Å; E276-K279 PolarHBondContact O-N 2.96Å; K279-K283 WeakPolarHBondContact O-CB 3.33Å; K279-K283 PolarHBondContact O-N 2.89Å |
| 280 | A | 75.9 | Confident | 78.1 | Confident | 57 Ų | 57 | 80.7 Ų | 80.7 | 47% | 0.471 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -63.9 | -44.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | E276 Q277 L278 K283 V284 | E276-A280 WeakPolarHBondContact O-CB 3.5Å; E276-A280 PolarHBondContact O-N 3.29Å; Q277-A280 PolarHBondContact O-N 2.99Å; L278-A280 VanDerWaalsContact C-N 3.29Å; L278-A280 PolarHBondContact O-N 3.23Å; A280-K283 WeakPolarHBondContact O-CB 3.49Å; A280-K283 PolarHBondContact O-N 3.24Å; A280-V284 PolarHBondContact O-N 2.87Å |
| 281 | K | 78.3 | Confident | 79.1 | Confident | 94 Ų | 94 | 78.8 Ų | 78.8 | 41% | 0.409 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -61.7 | -47.4 | 176.5 | -73.3 | -178.7 | 180 | -174.6 | 0 | 111.8 | L261 Q277 L278 K283 V284 V285 | L261-K281 HydrophobicContact CD2-CB 3.99Å; L261-K281 HydrophobicContact CD2-CD 4.36Å; Q277-K281 WeakPolarHBondContact O-CG 3.37Å; Q277-K281 PolarHBondContact O-N 3.39Å; L278-K281 PolarHBondContact O-N 3.36Å; K281-K283 VanDerWaalsContact C-N 3.29Å; K281-K283 PolarHBondContact O-N 2.94Å; K281-V284 PolarHBondContact O-N 3.21Å; K281-V284 VanDerWaalsContact O-N 3.17Å; K281-V285 PolarHBondContact O-N 3.37Å |
| 282 | R | 84.3 | Confident | 80.1 | Confident | 60 Ų | 60 | 75.4 Ų | 75.4 | 23% | 0.226 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -57 | -41.2 | 175.6 | -74.8 | 174.6 | 176.9 | -176 | 8.9 | 112 | L261 W262 L278 V284 V285 K286 | L261-R282 HydrophobicContact CB-CG 4.25Å; L261-R282 VanDerWaalsContact O-CZ 3.31Å; L261-R282 PolarHBondContact O-NE 3.47Å; L261-R282 PolarHBondContact O-NH2 3.45Å; W262-R282 HydrophobicContact CE3-CG 3.76Å; W262-R282 HydrophobicContact CH2-CB 4.2Å; W262-R282 HydrophobicContact CH2-CG 4.11Å; W262-R282 HydrophobicContact CZ3-CB 3.64Å; W262-R282 HydrophobicContact CZ3-CG 3.33Å; L278-R282 WeakPolarHBondContact O-CB 3.46Å; L278-R282 WeakPolarHBondContact O-CG 3.25Å; L278-R282 PolarHBondContact O-N 3.5Å; R282-V284 PolarHBondContact O-N 3.38Å; R282-V285 PolarHBondContact O-N 2.97Å; R282-K286 WeakPolarHBondContact O-CB 3.26Å; R282-K286 PolarHBondContact O-N 3.48Å |
| 283 | K | 82.1 | Confident | 81 | Confident | 89 Ų | 89 | 72.6 Ų | 72.6 | 39% | 0.387 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -61.3 | -43.3 | 177 | -170.6 | -178.9 | -175.5 | -170 | 0 | 112.4 | K279 A280 K281 M287 L346 | K279-K283 WeakPolarHBondContact O-CB 3.33Å; K279-K283 PolarHBondContact O-N 2.89Å; A280-K283 WeakPolarHBondContact O-CB 3.49Å; A280-K283 PolarHBondContact O-N 3.24Å; K281-K283 VanDerWaalsContact C-N 3.29Å; K281-K283 PolarHBondContact O-N 2.94Å; K283-M287 WeakPolarHBondContact O-CB 3.48Å; K283-M287 PolarHBondContact O-N 2.88Å; K283-L346 WeakPolarHBondContact CE-O 3.47Å; K283-L346 PolarHBondContact NZ-O 3.44Å; K283-L346 VanDerWaalsContact NZ-O 3.08Å |
| 284 | V | 78.6 | Confident | 81.9 | Confident | 56 Ų | 56 | 67.1 Ų | 67.1 | 34% | 0.339 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -65.7 | -43.6 | 178.2 | 175.5 | 0 | 0 | 0 | 0 | 110.9 | A280 K281 R282 M287 M288 | A280-V284 PolarHBondContact O-N 2.87Å; K281-V284 PolarHBondContact O-N 3.21Å; K281-V284 VanDerWaalsContact O-N 3.17Å; R282-V284 PolarHBondContact O-N 3.38Å; V284-M287 WeakPolarHBondContact O-CB 3.33Å; V284-M287 PolarHBondContact O-N 2.8Å; V284-M288 HydrophobicContact CG1-SD 4.01Å; V284-M288 VanDerWaalsContact O-CG 3.28Å; V284-M288 WeakPolarHBondContact O-CG 3.5Å; V284-M288 PolarHBondContact O-N 3.33Å; V284-M288 VanDerWaalsContact O-N 3.08Å |
| 285 | V | 80.2 | Confident | 82.6 | Confident | 6 Ų | 6 | 62.5 Ų | 62.5 | 4% | 0.036 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -66.6 | -43.9 | 178.7 | 173.9 | 0 | 0 | 0 | 0 | 111.5 | I174 V257 L261 K281 R282 M287 M288 I289 | I174-V285 HydrophobicContact CD1-CG2 3.77Å; V257-V285 HydrophobicContact CG1-CB 4.33Å; V257-V285 HydrophobicContact CG1-CG1 3.88Å; V257-V285 HydrophobicContact CG1-CG2 3.49Å; V257-V285 VanDerWaalsContact CG1-CG2 3.49Å; L261-V285 HydrophobicContact CD1-CB 4.13Å; L261-V285 HydrophobicContact CD1-CG1 4.5Å; L261-V285 HydrophobicContact CD1-CG2 3.57Å; K281-V285 PolarHBondContact O-N 3.37Å; R282-V285 PolarHBondContact O-N 2.97Å; V285-M287 VanDerWaalsContact C-N 3.28Å; V285-M287 PolarHBondContact O-N 2.64Å; V285-M288 PolarHBondContact O-N 3.08Å; V285-I289 HydrophobicContact CG1-CD1 3.95Å; V285-I289 HydrophobicContact CG1-CG1 4.41Å; V285-I289 WeakPolarHBondContact O-CG1 3.46Å; V285-I289 PolarHBondContact O-N 3.17Å |
| 286 | K | 84.2 | Confident | 83.3 | Confident | 142 Ų | 142 | 60.4 Ų | 60.4 | 62% | 0.617 | 30% | 0.303 | S | S | * | . | H | α-helix | trans | -56.4 | -43.2 | 173.8 | -176.7 | 177 | 179.6 | 175.8 | 0 | 111.5 | R282 M288 I289 I290 | R282-K286 WeakPolarHBondContact O-CB 3.26Å; R282-K286 PolarHBondContact O-N 3.48Å; K286-M288 VanDerWaalsContact C-N 3.32Å; K286-M288 PolarHBondContact O-N 3.05Å; K286-I289 PolarHBondContact O-N 3.09Å; K286-I290 HydrophobicContact CG-CD1 4.14Å; K286-I290 WeakPolarHBondContact O-CD1 3.34Å; K286-I290 VanDerWaalsContact O-CG1 3.27Å; K286-I290 WeakPolarHBondContact O-CG1 3.18Å; K286-I290 PolarHBondContact O-N 3.45Å |
| 287 | M | 82.7 | Confident | 84.1 | Confident | 22 Ų | 22 | 58.8 Ų | 58.8 | 11% | 0.108 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -56.3 | -47.5 | 173.7 | 165.6 | 179.7 | 127.9 | 0 | 0 | 111.4 | K283 V284 V285 I290 V291 I342 Y343 L346 | K283-M287 WeakPolarHBondContact O-CB 3.48Å; K283-M287 PolarHBondContact O-N 2.88Å; V284-M287 WeakPolarHBondContact O-CB 3.33Å; V284-M287 PolarHBondContact O-N 2.8Å; V285-M287 VanDerWaalsContact C-N 3.28Å; V285-M287 PolarHBondContact O-N 2.64Å; M287-I290 WeakPolarHBondContact O-CB 3.35Å; M287-I290 PolarHBondContact O-N 2.82Å; M287-V291 WeakPolarHBondContact O-CG2 3.49Å; M287-V291 PolarHBondContact O-N 3Å; M287-V291 VanDerWaalsContact O-N 3.11Å; M287-I342 HydrophobicContact CG-CG2 3.91Å; M287-Y343 HydrophobicContact CE-CD1 3.75Å; M287-Y343 HydrophobicContact CE-CE1 3.96Å; M287-Y343 HydrophobicContact SD-CD1 4.47Å; M287-L346 HydrophobicContact CB-CB 3.97Å; M287-L346 HydrophobicContact CB-CD1 3.46Å; M287-L346 VanDerWaalsContact CB-CD1 3.46Å; M287-L346 HydrophobicContact CB-CG 4.33Å; M287-L346 HydrophobicContact CG-CB 3.95Å; M287-L346 HydrophobicContact CG-CD1 3.68Å; M287-L346 HydrophobicContact CG-CG 4.44Å; M287-L346 HydrophobicContact SD-CB 3.75Å |
| 288 | M | 82 | Confident | 84.9 | Confident | 9 Ų | 9 | 53.4 Ų | 53.4 | 4% | 0.044 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -68.6 | -38.5 | -176.7 | -64.4 | 170.5 | 80.5 | 0 | 0 | 112.7 | I166 R170 Y254 V284 V285 K286 I290 V291 V292 | I166-M288 HydrophobicContact CB-CE 4.36Å; I166-M288 HydrophobicContact CG2-CE 3.31Å; I166-M288 WeakPolarHBondContact O-CE 3.41Å; R170-M288 HydrophobicContact CB-CE 3.91Å; R170-M288 HydrophobicContact CB-SD 4.11Å; R170-M288 HydrophobicContact CG-CE 3.47Å; R170-M288 VanDerWaalsContact CG-CE 3.47Å; R170-M288 HydrophobicContact CG-SD 3.59Å; R170-M288 VanDerWaalsContact CG-SD 3.59Å; Y254-M288 HydrophobicContact CD1-CB 4.37Å; Y254-M288 HydrophobicContact CE1-CB 3.49Å; Y254-M288 VanDerWaalsContact CE1-CB 3.49Å; Y254-M288 HydrophobicContact CE1-CE 3.69Å; Y254-M288 HydrophobicContact CE1-CG 4.34Å; Y254-M288 HydrophobicContact CE1-SD 4.04Å; Y254-M288 WeakPolarHBondContact OH-CE 3.28Å; V284-M288 HydrophobicContact CG1-SD 4.01Å; V284-M288 VanDerWaalsContact O-CG 3.28Å; V284-M288 WeakPolarHBondContact O-CG 3.5Å; V284-M288 PolarHBondContact O-N 3.33Å; V284-M288 VanDerWaalsContact O-N 3.08Å; V285-M288 PolarHBondContact O-N 3.08Å; K286-M288 VanDerWaalsContact C-N 3.32Å; K286-M288 PolarHBondContact O-N 3.05Å; M288-I290 VanDerWaalsContact C-N 3.31Å; M288-I290 PolarHBondContact O-N 3.37Å; M288-V291 PolarHBondContact O-N 3.31Å; M288-V292 WeakPolarHBondContact O-CG2 3.32Å; M288-V292 PolarHBondContact O-N 2.93Å |
| 289 | I | 86.3 | Confident | 85.5 | Confident | 69 Ų | 69 | 52.9 Ų | 52.9 | 35% | 0.354 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -58.1 | -45 | 172 | -66.7 | 168.1 | 0 | 0 | 0 | 110.4 | Y254 V285 K286 V291 V292 V293 | Y254-I289 HydrophobicContact CG-CG1 4.29Å; V285-I289 HydrophobicContact CG1-CD1 3.95Å; V285-I289 HydrophobicContact CG1-CG1 4.41Å; V285-I289 WeakPolarHBondContact O-CG1 3.46Å; V285-I289 PolarHBondContact O-N 3.17Å; K286-I289 PolarHBondContact O-N 3.09Å; I289-V291 VanDerWaalsContact C-N 3.32Å; I289-V291 PolarHBondContact O-N 2.99Å; I289-V292 PolarHBondContact O-N 3.11Å; I289-V293 HydrophobicContact CG2-CG2 4.21Å; I289-V293 WeakPolarHBondContact O-CG2 3.37Å; I289-V293 PolarHBondContact O-N 3.3Å |
| 290 | I | 88 | Confident | 86.1 | Confident | 64 Ų | 64 | 49.5 Ų | 49.5 | 33% | 0.328 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -58.7 | -43.8 | 177.2 | -68.6 | 163.8 | 0 | 0 | 0 | 111 | K286 M287 M288 V292 V293 T294 I342 L346 | K286-I290 HydrophobicContact CG-CD1 4.14Å; K286-I290 WeakPolarHBondContact O-CD1 3.34Å; K286-I290 VanDerWaalsContact O-CG1 3.27Å; K286-I290 WeakPolarHBondContact O-CG1 3.18Å; K286-I290 PolarHBondContact O-N 3.45Å; M287-I290 WeakPolarHBondContact O-CB 3.35Å; M287-I290 PolarHBondContact O-N 2.82Å; M288-I290 VanDerWaalsContact C-N 3.31Å; M288-I290 PolarHBondContact O-N 3.37Å; I290-V292 PolarHBondContact O-N 2.91Å; I290-V293 PolarHBondContact O-N 2.95Å; I290-T294 VanDerWaalsContact O-CB 3.31Å; I290-T294 WeakPolarHBondContact O-CB 3.41Å; I290-T294 PolarHBondContact O-N 3.1Å; I290-T294 PolarHBondContact O-OG1 3.06Å; I290-I342 HydrophobicContact CG2-CD1 4.3Å; I290-L346 HydrophobicContact CD1-CD1 4.05Å |
| 291 | V | 84.9 | Confident | 86.9 | Confident | 10 Ų | 10 | 48.8 Ų | 48.8 | 6% | 0.061 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -61.3 | -45.3 | 177.7 | -174.6 | 0 | 0 | 0 | 0 | 110.9 | M163 M287 M288 I289 T294 F295 I342 | M163-V291 HydrophobicContact CE-CB 4.26Å; M163-V291 HydrophobicContact CE-CG1 3.4Å; M163-V291 HydrophobicContact SD-CG1 3.96Å; M287-V291 WeakPolarHBondContact O-CG2 3.49Å; M287-V291 PolarHBondContact O-N 3Å; M287-V291 VanDerWaalsContact O-N 3.11Å; M288-V291 PolarHBondContact O-N 3.31Å; I289-V291 VanDerWaalsContact C-N 3.32Å; I289-V291 PolarHBondContact O-N 2.99Å; V291-T294 PolarHBondContact O-N 2.88Å; V291-F295 PolarHBondContact O-N 3.37Å; V291-I342 HydrophobicContact CB-CD1 4.47Å; V291-I342 HydrophobicContact CG2-CB 4.41Å; V291-I342 HydrophobicContact CG2-CD1 3.89Å; V291-I342 HydrophobicContact CG2-CG2 3.7Å |
| 292 | V | 86.8 | Confident | 87.4 | Confident | 16 Ų | 16 | 46.3 Ų | 46.3 | 10% | 0.097 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -63.4 | -47.6 | 179.6 | 175.4 | 0 | 0 | 0 | 0 | 112.2 | M163 L247 M250 Y254 M288 I289 I290 T294 F295 A296 | M163-V292 HydrophobicContact CE-CG2 4.3Å; L247-V292 HydrophobicContact CD2-CG1 3.88Å; M250-V292 HydrophobicContact CB-CG1 4.32Å; M250-V292 HydrophobicContact CB-CG2 4.13Å; M250-V292 HydrophobicContact CE-CG1 4.2Å; M250-V292 HydrophobicContact CE-CG2 4.15Å; M250-V292 HydrophobicContact CG-CG2 4.47Å; M250-V292 HydrophobicContact SD-CG2 3.69Å; Y254-V292 HydrophobicContact CD2-CG2 3.88Å; Y254-V292 HydrophobicContact CE2-CG2 3.4Å; Y254-V292 VanDerWaalsContact CE2-CG2 3.4Å; M288-V292 WeakPolarHBondContact O-CG2 3.32Å; M288-V292 PolarHBondContact O-N 2.93Å; I289-V292 PolarHBondContact O-N 3.11Å; I290-V292 PolarHBondContact O-N 2.91Å; V292-T294 VanDerWaalsContact C-N 3.28Å; V292-T294 PolarHBondContact O-N 2.83Å; V292-F295 PolarHBondContact O-N 2.92Å; V292-A296 PolarHBondContact O-N 3.31Å |
| 293 | V | 90.8 | Very high | 87.6 | Confident | 73 Ų | 73 | 44 Ų | 44 | 44% | 0.442 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -61.8 | -41.4 | 179 | 171.2 | 0 | 0 | 0 | 0 | 110.4 | I289 I290 A296 I297 | I289-V293 HydrophobicContact CG2-CG2 4.21Å; I289-V293 WeakPolarHBondContact O-CG2 3.37Å; I289-V293 PolarHBondContact O-N 3.3Å; I290-V293 PolarHBondContact O-N 2.95Å; V293-A296 PolarHBondContact O-N 3.22Å; V293-I297 HydrophobicContact CG1-CD1 3.57Å; V293-I297 HydrophobicContact CG1-CG1 4.32Å; V293-I297 WeakPolarHBondContact O-CB 3.39Å; V293-I297 VanDerWaalsContact O-CG1 3.28Å; V293-I297 WeakPolarHBondContact O-CG1 3.38Å; V293-I297 PolarHBondContact O-N 3.47Å |
| 294 | T | 91.2 | Very high | 87.9 | Confident | 34 Ų | 34 | 43.2 Ų | 43.2 | 21% | 0.209 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -60.6 | -47.7 | 175.9 | -56 | 0 | 0 | 0 | 0 | 110.9 | I290 V291 V292 I297 C298 Y338 | I290-T294 VanDerWaalsContact O-CB 3.31Å; I290-T294 WeakPolarHBondContact O-CB 3.41Å; I290-T294 PolarHBondContact O-N 3.1Å; I290-T294 PolarHBondContact O-OG1 3.06Å; V291-T294 PolarHBondContact O-N 2.88Å; V292-T294 VanDerWaalsContact C-N 3.28Å; V292-T294 PolarHBondContact O-N 2.83Å; T294-I297 PolarHBondContact O-N 3.49Å; T294-C298 WeakPolarHBondContact O-CB 2.94Å; T294-C298 PolarHBondContact O-N 3.48Å; T294-C298 PolarHBondContact O-SG 2.74Å; T294-Y338 HydrophobicContact CG2-CD2 3.34Å; T294-Y338 HydrophobicContact CG2-CE2 4.06Å; T294-Y338 HydrophobicContact CG2-CG 3.91Å |
| 295 | F | 88.8 | Confident | 88.3 | Confident | 15 Ų | 15 | 41.1 Ų | 41.1 | 7% | 0.066 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -59.5 | -48.2 | 176.7 | -179.1 | -89.1 | 0 | 0 | 0 | 111.9 | V156 I160 M163 Y243 L247 V291 V292 I297 C298 W299 | V156-F295 HydrophobicContact CG1-CE2 4.47Å; V156-F295 HydrophobicContact CG1-CZ 4.32Å; I160-F295 HydrophobicContact CB-CE1 4.43Å; I160-F295 HydrophobicContact CB-CE2 4.32Å; I160-F295 HydrophobicContact CB-CZ 3.9Å; I160-F295 HydrophobicContact CD1-CD1 3.49Å; I160-F295 VanDerWaalsContact CD1-CD1 3.49Å; I160-F295 HydrophobicContact CD1-CD2 4.11Å; I160-F295 HydrophobicContact CD1-CE1 3.29Å; I160-F295 HydrophobicContact CD1-CE2 3.93Å; I160-F295 HydrophobicContact CD1-CG 3.91Å; I160-F295 HydrophobicContact CD1-CZ 3.53Å; I160-F295 HydrophobicContact CG1-CD1 4.43Å; I160-F295 HydrophobicContact CG1-CE1 3.75Å; I160-F295 HydrophobicContact CG1-CE2 4.41Å; I160-F295 HydrophobicContact CG1-CZ 3.74Å; M163-F295 HydrophobicContact CE-CB 4.22Å; Y243-F295 HydrophobicContact CD2-CE1 4.17Å; L247-F295 HydrophobicContact CD2-CD1 4.24Å; V291-F295 PolarHBondContact O-N 3.37Å; V292-F295 PolarHBondContact O-N 2.92Å; F295-I297 PolarHBondContact O-N 3.28Å; F295-C298 PolarHBondContact O-N 3.38Å; F295-W299 AromaticContact CD2-CD1 3.54Å; F295-W299 AromaticContact CD2-NE1 3.7Å; F295-W299 HydrophobicContact CE1-CG 4.4Å; F295-W299 AromaticContact CE2-CD1 3.38Å; F295-W299 HydrophobicContact CE2-CG 4.17Å; F295-W299 AromaticContact CE2-NE1 3.33Å; F295-W299 VanDerWaalsContact CE2-NE1 3.33Å; F295-W299 AromaticContact CG-CD1 3.99Å; F295-W299 AromaticContact CZ-CD1 3.69Å; F295-W299 HydrophobicContact CZ-CG 4.07Å; F295-W299 AromaticContact CZ-NE1 3.95Å; F295-W299 PolarHBondContact O-N 3.04Å; F295-W299 VanDerWaalsContact O-N 3.08Å |
| 296 | A | 91.6 | Very high | 88.3 | Confident | 22 Ų | 22 | 42 Ų | 42 | 18% | 0.182 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -57.8 | -50.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y243 L247 V292 V293 C298 L300 | Y243-A296 PolarHBondContact OH-O 2.89Å; Y243-A296 VanDerWaalsContact OH-O 3.12Å; L247-A296 HydrophobicContact CD1-CB 4.06Å; L247-A296 HydrophobicContact CD2-CB 3.96Å; V292-A296 PolarHBondContact O-N 3.31Å; V293-A296 PolarHBondContact O-N 3.22Å; A296-C298 VanDerWaalsContact C-N 3.34Å; A296-C298 PolarHBondContact O-N 3.39Å; A296-L300 WeakPolarHBondContact O-CB 3.16Å; A296-L300 PolarHBondContact O-N 3.07Å |
| 297 | I | 94.5 | Very high | 88.3 | Confident | 103 Ų | 103 | 38 Ų | 38 | 53% | 0.528 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -64.5 | -38.8 | -179.6 | -67 | 170.1 | 0 | 0 | 0 | 111.4 | V293 T294 F295 P301 | V293-I297 HydrophobicContact CG1-CD1 3.57Å; V293-I297 HydrophobicContact CG1-CG1 4.32Å; V293-I297 WeakPolarHBondContact O-CB 3.39Å; V293-I297 VanDerWaalsContact O-CG1 3.28Å; V293-I297 WeakPolarHBondContact O-CG1 3.38Å; V293-I297 PolarHBondContact O-N 3.47Å; T294-I297 PolarHBondContact O-N 3.49Å; F295-I297 PolarHBondContact O-N 3.28Å; I297-P301 WeakPolarHBondContact O-CD 3.41Å |
| 298 | C | 93.6 | Very high | 88.4 | Confident | 5 Ų | 5 | 40.5 Ų | 40.5 | 3% | 0.034 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -70.3 | -38.2 | -176.9 | -68.2 | 0 | 0 | 0 | 0 | 113 | T294 F295 A296 L331 A332 | T294-C298 WeakPolarHBondContact O-CB 2.94Å; T294-C298 PolarHBondContact O-N 3.48Å; T294-C298 PolarHBondContact O-SG 2.74Å; F295-C298 PolarHBondContact O-N 3.38Å; A296-C298 VanDerWaalsContact C-N 3.34Å; A296-C298 PolarHBondContact O-N 3.39Å; C298-L331 HydrophobicContact CB-CG 4.44Å; C298-L331 WeakPolarHBondContact CB-O 3.29Å; C298-A332 WeakPolarHBondContact O-CA 3.09Å; C298-A332 PolarHBondContact O-N 3.04Å |
| 299 | W | 91.1 | Very high | 88.1 | Confident | 17 Ų | 17 | 41 Ų | 41 | 6% | 0.064 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -89.1 | -23 | -175.6 | -77.4 | 89.1 | 0 | 0 | 0 | 113.7 | V156 Y243 F295 Y302 H303 A332 S335 | V156-W299 HydrophobicContact CB-CH2 4.27Å; V156-W299 HydrophobicContact CB-CZ2 4.36Å; V156-W299 HydrophobicContact CG1-CH2 3.96Å; V156-W299 HydrophobicContact CG1-CZ2 3.84Å; V156-W299 HydrophobicContact CG1-CZ3 4.31Å; V156-W299 HydrophobicContact CG2-CH2 3.25Å; V156-W299 HydrophobicContact CG2-CZ2 3.46Å; V156-W299 VanDerWaalsContact CG2-CZ2 3.46Å; V156-W299 HydrophobicContact CG2-CZ3 4.15Å; Y243-W299 HydrophobicContact CD2-CB 3.91Å; Y243-W299 HydrophobicContact CE2-CB 3.8Å; F295-W299 AromaticContact CD2-CD1 3.54Å; F295-W299 AromaticContact CD2-NE1 3.7Å; F295-W299 HydrophobicContact CE1-CG 4.4Å; F295-W299 AromaticContact CE2-CD1 3.38Å; F295-W299 HydrophobicContact CE2-CG 4.17Å; F295-W299 AromaticContact CE2-NE1 3.33Å; F295-W299 VanDerWaalsContact CE2-NE1 3.33Å; F295-W299 AromaticContact CG-CD1 3.99Å; F295-W299 AromaticContact CZ-CD1 3.69Å; F295-W299 HydrophobicContact CZ-CG 4.07Å; F295-W299 AromaticContact CZ-NE1 3.95Å; F295-W299 PolarHBondContact O-N 3.04Å; F295-W299 VanDerWaalsContact O-N 3.08Å; W299-Y302 HydrophobicContact CE3-CD1 4.11Å; W299-Y302 HydrophobicContact CZ3-CD1 4.04Å; W299-Y302 HydrophobicContact CZ3-CE1 4.15Å; W299-Y302 WeakPolarHBondContact O-CB 3.3Å; W299-Y302 PolarHBondContact O-N 3.49Å; W299-H303 AromaticContact CE3-NE2 3.81Å; W299-H303 PolarHBondContact O-CD2 3.33Å; W299-H303 VanDerWaalsContact O-CD2 3.25Å; W299-H303 PolarHBondContact O-N 3.39Å; W299-H303 VanDerWaalsContact O-N 3.1Å; W299-A332 HydrophobicContact CD2-CB 4.25Å; W299-A332 HydrophobicContact CE3-CB 4.2Å; W299-A332 HydrophobicContact CH2-CB 4.38Å; W299-A332 HydrophobicContact CZ2-CB 4.47Å; W299-A332 HydrophobicContact CZ3-CB 4.27Å; W299-S335 PolarHBondContact NE1-OG 3.44Å |
| 300 | L | 92.3 | Very high | 87.5 | Confident | 76 Ų | 76 | 39.6 Ų | 39.6 | 40% | 0.398 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -56.2 | -50.2 | -177.9 | -179.7 | 66.9 | 0 | 0 | 0 | 113.4 | Y243 A296 Y302 H303 I304 | Y243-L300 HydrophobicContact CE1-CD1 4.35Å; A296-L300 WeakPolarHBondContact O-CB 3.16Å; A296-L300 PolarHBondContact O-N 3.07Å; L300-Y302 VanDerWaalsContact C-N 3.25Å; L300-Y302 PolarHBondContact O-N 2.94Å; L300-H303 PolarHBondContact O-N 2.8Å; L300-I304 HydrophobicContact CD1-CD1 3.75Å; L300-I304 HydrophobicContact CD1-CG1 4.01Å; L300-I304 HydrophobicContact CD2-CD1 4.28Å; L300-I304 HydrophobicContact CG-CD1 3.64Å; L300-I304 HydrophobicContact CG-CG1 4.28Å; L300-I304 WeakPolarHBondContact O-CB 3.44Å; L300-I304 VanDerWaalsContact O-CG1 3.31Å; L300-I304 WeakPolarHBondContact O-CG1 3.48Å; L300-I304 PolarHBondContact O-N 3.23Å |
| 301 | P | 92.8 | Very high | 87.1 | Confident | 42 Ų | 42 | 41.4 Ų | 41.4 | 27% | 0.273 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -65 | -31.5 | -177.5 | -25.5 | 39.2 | 0 | 0 | 0 | 113 | I297 Y305 L331 | I297-P301 WeakPolarHBondContact O-CD 3.41Å; P301-Y305 WeakPolarHBondContact O-CB 3.48Å; P301-Y305 PolarHBondContact O-N 3.38Å; P301-L331 HydrophobicContact CG-CD2 3.75Å |
| 302 | Y | 88.8 | Confident | 86.8 | Confident | 42 Ų | 42 | 47.6 Ų | 47.6 | 17% | 0.165 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -65 | -52.8 | 174.5 | -177.5 | -99.2 | 0 | 0 | 0 | 110.4 | W299 L300 I304 Y305 F306 Y325 F329 A332 | W299-Y302 HydrophobicContact CE3-CD1 4.11Å; W299-Y302 HydrophobicContact CZ3-CD1 4.04Å; W299-Y302 HydrophobicContact CZ3-CE1 4.15Å; W299-Y302 WeakPolarHBondContact O-CB 3.3Å; W299-Y302 PolarHBondContact O-N 3.49Å; L300-Y302 VanDerWaalsContact C-N 3.25Å; L300-Y302 PolarHBondContact O-N 2.94Å; Y302-I304 PolarHBondContact O-N 3.5Å; Y302-Y305 WeakPolarHBondContact O-CB 3.4Å; Y302-Y305 PolarHBondContact O-N 3.42Å; Y302-Y305 VanDerWaalsContact O-N 3.15Å; Y302-F306 HydrophobicContact CD1-CD2 4.16Å; Y302-F306 AromaticContact CD1-CE2 3.87Å; Y302-F306 HydrophobicContact CD1-CE2 3.87Å; Y302-F306 AromaticContact CD2-CE2 3.89Å; Y302-F306 HydrophobicContact CD2-CE2 3.89Å; Y302-F306 AromaticContact CE1-CD2 3.99Å; Y302-F306 HydrophobicContact CE1-CD2 3.99Å; Y302-F306 AromaticContact CE1-CE2 3.37Å; Y302-F306 HydrophobicContact CE1-CE2 3.37Å; Y302-F306 HydrophobicContact CE1-CZ 4.13Å; Y302-F306 HydrophobicContact CE2-CD2 4.46Å; Y302-F306 AromaticContact CE2-CE2 3.41Å; Y302-F306 HydrophobicContact CE2-CE2 3.41Å; Y302-F306 VanDerWaalsContact CE2-CE2 3.41Å; Y302-F306 HydrophobicContact CE2-CZ 4.04Å; Y302-F306 HydrophobicContact CG-CD2 4.47Å; Y302-F306 HydrophobicContact CG-CE2 4.11Å; Y302-F306 AromaticContact CZ-CE2 3.13Å; Y302-F306 AromaticContact CZ-CZ 3.62Å; Y302-F306 VanDerWaalsContact O-CD2 3.26Å; Y302-F306 WeakPolarHBondContact O-CD2 3.21Å; Y302-F306 PolarHBondContact O-N 2.9Å; Y302-F306 WeakPolarHBondContact OH-CE2 3.39Å; Y302-F306 WeakPolarHBondContact OH-CZ 3.43Å; Y302-Y325 HydrophobicContact CE2-CE2 4.12Å; Y302-F329 HydrophobicContact CD2-CB 4.44Å; Y302-F329 HydrophobicContact CD2-CD2 4.19Å; Y302-F329 HydrophobicContact CE2-CB 4.48Å; Y302-F329 AromaticContact CE2-CD2 3.65Å; Y302-F329 HydrophobicContact CE2-CD2 3.65Å; Y302-F329 HydrophobicContact CE2-CE2 4.44Å; Y302-A332 HydrophobicContact CD2-CB 4.35Å; Y302-A332 HydrophobicContact CG-CB 4.17Å |
| 303 | H | 88.1 | Confident | 86 | Confident | 11 Ų | 11 | 51.2 Ų | 51.2 | 5% | 0.051 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -62.9 | -39.6 | 178.3 | -67.1 | -52 | 0 | 0 | 0 | 113.2 | I239 Y243 W299 L300 Y305 F306 I307 | I239-H303 HydrophobicContact CD1-CB 4.19Å; I239-H303 HydrophobicContact CG1-CB 4.43Å; Y243-H303 AromaticContact CD2-CD2 3.6Å; Y243-H303 AromaticContact CD2-NE2 3.8Å; Y243-H303 AromaticContact CG-CD2 3.64Å; Y243-H303 AromaticContact CG-NE2 3.87Å; W299-H303 AromaticContact CE3-NE2 3.81Å; W299-H303 PolarHBondContact O-CD2 3.33Å; W299-H303 VanDerWaalsContact O-CD2 3.25Å; W299-H303 PolarHBondContact O-N 3.39Å; W299-H303 VanDerWaalsContact O-N 3.1Å; L300-H303 PolarHBondContact O-N 2.8Å; H303-Y305 VanDerWaalsContact C-N 3.31Å; H303-Y305 PolarHBondContact O-N 3.05Å; H303-F306 PolarHBondContact O-N 3.34Å; H303-I307 WeakPolarHBondContact O-CG1 3.31Å; H303-I307 PolarHBondContact O-N 3.31Å |
| 304 | I | 88.7 | Confident | 85 | Confident | 74 Ų | 74 | 53.9 Ų | 53.9 | 38% | 0.379 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -59.7 | -43.8 | 174.5 | -70.4 | 173.7 | 0 | 0 | 0 | 110.5 | L300 Y302 F306 I307 L308 | L300-I304 HydrophobicContact CD1-CD1 3.75Å; L300-I304 HydrophobicContact CD1-CG1 4.01Å; L300-I304 HydrophobicContact CD2-CD1 4.28Å; L300-I304 HydrophobicContact CG-CD1 3.64Å; L300-I304 HydrophobicContact CG-CG1 4.28Å; L300-I304 WeakPolarHBondContact O-CB 3.44Å; L300-I304 VanDerWaalsContact O-CG1 3.31Å; L300-I304 WeakPolarHBondContact O-CG1 3.48Å; L300-I304 PolarHBondContact O-N 3.23Å; Y302-I304 PolarHBondContact O-N 3.5Å; I304-F306 VanDerWaalsContact C-N 3.34Å; I304-F306 PolarHBondContact O-N 3.45Å; I304-I307 PolarHBondContact O-N 3.05Å; I304-L308 HydrophobicContact CG2-CD1 3.57Å; I304-L308 HydrophobicContact CG2-CG 3.99Å; I304-L308 WeakPolarHBondContact O-CB 3.46Å; I304-L308 WeakPolarHBondContact O-CG 3.19Å; I304-L308 PolarHBondContact O-N 2.9Å |
| 305 | Y | 86.4 | Confident | 83.9 | Confident | 12 Ų | 12 | 54.9 Ų | 54.9 | 5% | 0.047 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -56.7 | -45.8 | 178 | 173.3 | -87.1 | 0 | 0 | 0 | 112.1 | V30 P301 Y302 H303 L308 T309 I321 I324 Y325 | V30-Y305 HydrophobicContact CG1-CE1 3.81Å; V30-Y305 HydrophobicContact CG2-CE1 4.33Å; P301-Y305 WeakPolarHBondContact O-CB 3.48Å; P301-Y305 PolarHBondContact O-N 3.38Å; Y302-Y305 WeakPolarHBondContact O-CB 3.4Å; Y302-Y305 PolarHBondContact O-N 3.42Å; Y302-Y305 VanDerWaalsContact O-N 3.15Å; H303-Y305 VanDerWaalsContact C-N 3.31Å; H303-Y305 PolarHBondContact O-N 3.05Å; Y305-L308 PolarHBondContact O-N 2.76Å; Y305-T309 HydrophobicContact CD1-CG2 4.42Å; Y305-T309 HydrophobicContact CD2-CG2 4.33Å; Y305-T309 HydrophobicContact CE1-CG2 4.02Å; Y305-T309 HydrophobicContact CE2-CG2 3.97Å; Y305-T309 WeakPolarHBondContact O-CB 3.2Å; Y305-T309 WeakPolarHBondContact O-CG2 3.45Å; Y305-T309 PolarHBondContact O-N 3.42Å; Y305-T309 PolarHBondContact O-OG1 3.48Å; Y305-I321 HydrophobicContact CD2-CD1 4.37Å; Y305-I321 HydrophobicContact CE2-CD1 3.63Å; Y305-I321 HydrophobicContact CE2-CG1 3.8Å; Y305-I324 HydrophobicContact CD2-CG2 4.08Å; Y305-Y325 HydrophobicContact CD1-CD2 4.21Å; Y305-Y325 AromaticContact CE1-CD2 3.87Å; Y305-Y325 HydrophobicContact CE1-CD2 3.87Å; Y305-Y325 HydrophobicContact CE1-CG 4.44Å |
| 306 | F | 81.3 | Confident | 82.8 | Confident | 25 Ų | 25 | 54.9 Ų | 54.9 | 11% | 0.11 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -66.7 | -40.5 | 177.8 | -79 | -87.9 | 0 | 0 | 0 | 113 | V30 H235 Y302 H303 I304 T309 A310 | V30-F306 HydrophobicContact CB-CZ 4.41Å; V30-F306 HydrophobicContact CG2-CD1 4.22Å; V30-F306 HydrophobicContact CG2-CE1 3.17Å; V30-F306 HydrophobicContact CG2-CE2 3.96Å; V30-F306 HydrophobicContact CG2-CZ 3.02Å; H235-F306 AromaticContact CE1-CD1 3.51Å; H235-F306 AromaticContact CE1-CD2 3.87Å; H235-F306 AromaticContact CE1-CE1 3.97Å; H235-F306 AromaticContact CE1-CG 3.41Å; H235-F306 VanDerWaalsContact CE1-CG 3.41Å; H235-F306 WeakPolarHBondContact CE1-CG 3.45Å; H235-F306 WeakPolarHBondContact NE2-CB 3.39Å; H235-F306 AromaticContact NE2-CD1 3.84Å; H235-F306 AromaticContact NE2-CD2 3.87Å; H235-F306 AromaticContact NE2-CG 3.34Å; H235-F306 VanDerWaalsContact NE2-CG 3.34Å; H235-F306 WeakPolarHBondContact NE2-CG 3.37Å; Y302-F306 HydrophobicContact CD1-CD2 4.16Å; Y302-F306 AromaticContact CD1-CE2 3.87Å; Y302-F306 HydrophobicContact CD1-CE2 3.87Å; Y302-F306 AromaticContact CD2-CE2 3.89Å; Y302-F306 HydrophobicContact CD2-CE2 3.89Å; Y302-F306 AromaticContact CE1-CD2 3.99Å; Y302-F306 HydrophobicContact CE1-CD2 3.99Å; Y302-F306 AromaticContact CE1-CE2 3.37Å; Y302-F306 HydrophobicContact CE1-CE2 3.37Å; Y302-F306 HydrophobicContact CE1-CZ 4.13Å; Y302-F306 HydrophobicContact CE2-CD2 4.46Å; Y302-F306 AromaticContact CE2-CE2 3.41Å; Y302-F306 HydrophobicContact CE2-CE2 3.41Å; Y302-F306 VanDerWaalsContact CE2-CE2 3.41Å; Y302-F306 HydrophobicContact CE2-CZ 4.04Å; Y302-F306 HydrophobicContact CG-CD2 4.47Å; Y302-F306 HydrophobicContact CG-CE2 4.11Å; Y302-F306 AromaticContact CZ-CE2 3.13Å; Y302-F306 AromaticContact CZ-CZ 3.62Å; Y302-F306 VanDerWaalsContact O-CD2 3.26Å; Y302-F306 WeakPolarHBondContact O-CD2 3.21Å; Y302-F306 PolarHBondContact O-N 2.9Å; Y302-F306 WeakPolarHBondContact OH-CE2 3.39Å; Y302-F306 WeakPolarHBondContact OH-CZ 3.43Å; H303-F306 PolarHBondContact O-N 3.34Å; I304-F306 VanDerWaalsContact C-N 3.34Å; I304-F306 PolarHBondContact O-N 3.45Å; F306-T309 WeakPolarHBondContact CA-OG1 3.4Å; F306-T309 PolarHBondContact O-OG1 2.88Å; F306-A310 WeakPolarHBondContact O-CB 3.5Å; F306-A310 PolarHBondContact O-N 3.27Å |
| 307 | I | 83.7 | Confident | 81.5 | Confident | 56 Ų | 56 | 62.5 Ų | 62.5 | 29% | 0.287 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -63.7 | -47.1 | 178 | -67.3 | 168 | 0 | 0 | 0 | 109.9 | I239 H303 I304 A310 I311 | I239-I307 HydrophobicContact CD1-CD1 3.85Å; I239-I307 HydrophobicContact CD1-CG1 3.82Å; H303-I307 WeakPolarHBondContact O-CG1 3.31Å; H303-I307 PolarHBondContact O-N 3.31Å; I304-I307 PolarHBondContact O-N 3.05Å; I307-A310 PolarHBondContact O-N 3.28Å; I307-I311 HydrophobicContact CG2-CD1 3.67Å; I307-I311 HydrophobicContact CG2-CG1 4.47Å; I307-I311 VanDerWaalsContact O-CG1 3.32Å; I307-I311 WeakPolarHBondContact O-CG1 3.31Å; I307-I311 PolarHBondContact O-N 3.07Å |
| 308 | L | 84.4 | Confident | 80.4 | Confident | 75 Ų | 75 | 65.5 Ų | 65.5 | 39% | 0.393 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -65.8 | -42.7 | -178.4 | -72.2 | 178.3 | 0 | 0 | 0 | 112.5 | I304 Y305 A310 I311 Y312 L315 | I304-L308 HydrophobicContact CG2-CD1 3.57Å; I304-L308 HydrophobicContact CG2-CG 3.99Å; I304-L308 WeakPolarHBondContact O-CB 3.46Å; I304-L308 WeakPolarHBondContact O-CG 3.19Å; I304-L308 PolarHBondContact O-N 2.9Å; Y305-L308 PolarHBondContact O-N 2.76Å; L308-A310 VanDerWaalsContact C-N 3.28Å; L308-A310 PolarHBondContact O-N 3.44Å; L308-I311 PolarHBondContact O-N 2.94Å; L308-Y312 HydrophobicContact CD2-CD2 4.44Å; L308-Y312 WeakPolarHBondContact O-CB 3.27Å; L308-Y312 PolarHBondContact O-N 3.48Å; L308-L315 HydrophobicContact CB-CD1 4.41Å |
| 309 | T | 76 | Confident | 78.9 | Confident | 19 Ų | 19 | 71.7 Ų | 71.7 | 12% | 0.117 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -69.8 | -27.6 | 178.4 | 49.8 | 0 | 0 | 0 | 0 | 112.3 | Y305 F306 I321 | Y305-T309 HydrophobicContact CD1-CG2 4.42Å; Y305-T309 HydrophobicContact CD2-CG2 4.33Å; Y305-T309 HydrophobicContact CE1-CG2 4.02Å; Y305-T309 HydrophobicContact CE2-CG2 3.97Å; Y305-T309 WeakPolarHBondContact O-CB 3.2Å; Y305-T309 WeakPolarHBondContact O-CG2 3.45Å; Y305-T309 PolarHBondContact O-N 3.42Å; Y305-T309 PolarHBondContact O-OG1 3.48Å; F306-T309 WeakPolarHBondContact CA-OG1 3.4Å; F306-T309 PolarHBondContact O-OG1 2.88Å; T309-I321 HydrophobicContact CG2-CD1 4.36Å |
| 310 | A | 74.2 | Confident | 78.1 | Confident | 41 Ų | 41 | 78.2 Ų | 78.2 | 34% | 0.339 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -75.2 | -39.6 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | F232 F306 I307 L308 | F232-A310 HydrophobicContact CD2-CB 3.39Å; F232-A310 HydrophobicContact CE2-CB 3.5Å; F306-A310 WeakPolarHBondContact O-CB 3.5Å; F306-A310 PolarHBondContact O-N 3.27Å; I307-A310 PolarHBondContact O-N 3.28Å; L308-A310 VanDerWaalsContact C-N 3.28Å; L308-A310 PolarHBondContact O-N 3.44Å |
| 311 | I | 79.9 | Confident | 77.3 | Confident | 101 Ų | 101 | 75.3 Ų | 75.3 | 52% | 0.518 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -75.4 | -45.5 | 178.2 | -64 | 169.2 | 0 | 0 | 0 | 110.6 | I307 L308 | I307-I311 HydrophobicContact CG2-CD1 3.67Å; I307-I311 HydrophobicContact CG2-CG1 4.47Å; I307-I311 VanDerWaalsContact O-CG1 3.32Å; I307-I311 WeakPolarHBondContact O-CG1 3.31Å; I307-I311 PolarHBondContact O-N 3.07Å; L308-I311 PolarHBondContact O-N 2.94Å |
| 312 | Y | 78.1 | Confident | 76.2 | Confident | 140 Ų | 140 | 74.1 Ų | 74.1 | 55% | 0.549 | 33% | 0.334 | S | S | . | . | trans | -112.9 | 81.1 | -176.4 | -60.6 | -76.4 | 0 | 0 | 0 | 111 | L308 Q314 L315 | L308-Y312 HydrophobicContact CD2-CD2 4.44Å; L308-Y312 WeakPolarHBondContact O-CB 3.27Å; L308-Y312 PolarHBondContact O-N 3.48Å; Y312-Q314 PolarHBondContact O-N 2.91Å; Y312-L315 HydrophobicContact CD2-CD1 4.26Å; Y312-L315 HydrophobicContact CG-CD1 4.29Å; Y312-L315 WeakPolarHBondContact O-CB 3.35Å; Y312-L315 PolarHBondContact O-N 3.06Å | ||
| 313 | Q | 70.4 | Confident | 75.7 | Confident | 92 Ų | 92 | 74.1 Ų | 74.1 | 43% | 0.43 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -57.1 | -23 | 177.2 | -65.8 | 178.5 | -11.8 | 0 | 0 | 113.3 | L315 N316 | Q313-L315 VanDerWaalsContact C-N 3.35Å; Q313-N316 VanDerWaalsContact O-CB 3.32Å; Q313-N316 WeakPolarHBondContact O-CB 3.31Å; Q313-N316 PolarHBondContact O-N 3.02Å |
| 314 | Q | 68.9 | Low | 75.5 | Confident | 130 Ų | 130 | 77.7 Ų | 77.7 | 61% | 0.607 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -68.6 | -29.1 | 176.2 | -61.2 | -65.3 | -2.5 | 0 | 0 | 113.3 | Y312 N316 R317 | Y312-Q314 PolarHBondContact O-N 2.91Å; Q314-N316 PolarHBondContact O-N 3.26Å; Q314-R317 PolarHBondContact O-N 3.45Å; Q314-R317 VanDerWaalsContact O-N 3.16Å |
| 315 | L | 69.3 | Low | 75 | Confident | 54 Ų | 54 | 74.7 Ų | 74.7 | 28% | 0.283 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -65.3 | -26.6 | 177.1 | -69.2 | 179.2 | 0 | 0 | 0 | 112 | L308 Y312 Q313 R317 W318 | L308-L315 HydrophobicContact CB-CD1 4.41Å; Y312-L315 HydrophobicContact CD2-CD1 4.26Å; Y312-L315 HydrophobicContact CG-CD1 4.29Å; Y312-L315 WeakPolarHBondContact O-CB 3.35Å; Y312-L315 PolarHBondContact O-N 3.06Å; Q313-L315 VanDerWaalsContact C-N 3.35Å; L315-R317 VanDerWaalsContact C-N 3.27Å; L315-R317 PolarHBondContact O-N 3.1Å; L315-W318 WeakPolarHBondContact O-CB 3.45Å; L315-W318 PolarHBondContact O-N 3.25Å |
| 316 | N | 64.8 | Low | 74.7 | Confident | 15 Ų | 15 | 74.7 Ų | 74.7 | 8% | 0.08 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -58.6 | -45.3 | 175.6 | -121.4 | -12.7 | 0 | 0 | 0 | 109 | W33 Q313 Q314 W318 I321 | W33-N316 HydrophobicContact CD2-CB 4.38Å; W33-N316 HydrophobicContact CH2-CB 4.23Å; W33-N316 WeakPolarHBondContact CH2-O 3.4Å; W33-N316 HydrophobicContact CZ2-CB 3.43Å; W33-N316 VanDerWaalsContact CZ2-CB 3.43Å; W33-N316 WeakPolarHBondContact CZ2-O 3.43Å; W33-N316 VanDerWaalsContact CZ3-O 3.27Å; W33-N316 WeakPolarHBondContact CZ3-O 3.13Å; W33-N316 PolarHBondContact NE1-ND2 2.95Å; W33-N316 PolarHBondContact NE1-OD1 2.92Å; Q313-N316 VanDerWaalsContact O-CB 3.32Å; Q313-N316 WeakPolarHBondContact O-CB 3.31Å; Q313-N316 PolarHBondContact O-N 3.02Å; Q314-N316 PolarHBondContact O-N 3.26Å; N316-W318 PolarHBondContact O-N 2.68Å; N316-I321 VanDerWaalsContact O-CG2 3.32Å; N316-I321 WeakPolarHBondContact O-CG2 3.32Å |
| 317 | R | 64.4 | Low | 75 | Confident | 183 Ų | 183 | 75.6 Ų | 75.6 | 69% | 0.691 | 35% | 0.351 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.3 | -4.4 | -176.2 | -60.7 | -175.2 | 177.2 | -173.2 | 0.9 | 115.9 | Q314 L315 | Q314-R317 PolarHBondContact O-N 3.45Å; Q314-R317 VanDerWaalsContact O-N 3.16Å; L315-R317 VanDerWaalsContact C-N 3.27Å; L315-R317 PolarHBondContact O-N 3.1Å |
| 318 | W | 70.1 | Confident | 75.3 | Confident | 165 Ų | 165 | 73.5 Ų | 73.5 | 63% | 0.625 | 34% | 0.342 | S | S | * | . | S | Bend | trans | -74.5 | 139.3 | -178.1 | -78 | 35.6 | 0 | 0 | 0 | 113.2 | L315 N316 Y320 I321 | L315-W318 WeakPolarHBondContact O-CB 3.45Å; L315-W318 PolarHBondContact O-N 3.25Å; N316-W318 PolarHBondContact O-N 2.68Å; W318-Y320 PolarHBondContact O-N 2.97Å; W318-Y320 VanDerWaalsContact O-N 3.14Å; W318-I321 VanDerWaalsContact O-CG2 3.28Å; W318-I321 WeakPolarHBondContact O-CG2 3.3Å; W318-I321 PolarHBondContact O-N 3.19Å |
| 319 | K | 64 | Low | 75.3 | Confident | 135 Ų | 135 | 70.5 Ų | 70.5 | 59% | 0.587 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.1 | -28.2 | -178.4 | -171.6 | 177.4 | -179.8 | -179.4 | 0 | 114.1 | ||
| 320 | Y | 73.3 | Confident | 76 | Confident | 155 Ų | 155 | 72.8 Ų | 72.8 | 61% | 0.608 | 33% | 0.332 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.1 | -4.6 | -175.4 | -62.8 | -69.1 | 0 | 0 | 0 | 114.5 | W318 Q322 Q323 I324 | W318-Y320 PolarHBondContact O-N 2.97Å; W318-Y320 VanDerWaalsContact O-N 3.14Å; Y320-Q322 PolarHBondContact O-N 2.79Å; Y320-Q323 PolarHBondContact O-N 2.92Å; Y320-I324 PolarHBondContact O-N 3.39Å |
| 321 | I | 75.3 | Confident | 76.8 | Confident | 14 Ų | 14 | 72.9 Ų | 72.9 | 7% | 0.072 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -60.4 | -34.1 | -174.6 | -161.6 | 64.8 | 0 | 0 | 0 | 112.2 | W33 Y305 T309 N316 W318 Q323 I324 Y325 | W33-I321 HydrophobicContact CE3-CG2 3.83Å; W33-I321 HydrophobicContact CH2-CG2 3.94Å; W33-I321 HydrophobicContact CZ3-CG2 3.2Å; Y305-I321 HydrophobicContact CD2-CD1 4.37Å; Y305-I321 HydrophobicContact CE2-CD1 3.63Å; Y305-I321 HydrophobicContact CE2-CG1 3.8Å; T309-I321 HydrophobicContact CG2-CD1 4.36Å; N316-I321 VanDerWaalsContact O-CG2 3.32Å; N316-I321 WeakPolarHBondContact O-CG2 3.32Å; W318-I321 VanDerWaalsContact O-CG2 3.28Å; W318-I321 WeakPolarHBondContact O-CG2 3.3Å; W318-I321 PolarHBondContact O-N 3.19Å; I321-Q323 VanDerWaalsContact C-N 3.34Å; I321-Q323 PolarHBondContact O-N 3.38Å; I321-I324 PolarHBondContact O-N 3.1Å; I321-Y325 PolarHBondContact O-N 3.24Å |
| 322 | Q | 70.3 | Confident | 77.3 | Confident | 18 Ų | 18 | 68.1 Ų | 68.1 | 8% | 0.084 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -60.8 | -40.1 | 176.2 | 168.6 | 164.7 | 25 | 0 | 0 | 112.5 | L34 Y320 L326 | L34-Q322 HydrophobicContact CD2-CB 3.41Å; L34-Q322 VanDerWaalsContact CD2-CB 3.41Å; L34-Q322 HydrophobicContact CD2-CG 3.28Å; L34-Q322 HydrophobicContact CG-CG 4.47Å; Y320-Q322 PolarHBondContact O-N 2.79Å; Q322-L326 HydrophobicContact CG-CD1 4.13Å; Q322-L326 WeakPolarHBondContact O-CB 3.36Å; Q322-L326 VanDerWaalsContact O-CG 3.29Å; Q322-L326 WeakPolarHBondContact O-CG 3.29Å; Q322-L326 PolarHBondContact O-N 3.08Å |
| 323 | Q | 77.6 | Confident | 77.8 | Confident | 41 Ų | 41 | 61.6 Ų | 61.6 | 19% | 0.192 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -70.5 | -38.4 | 178.1 | -60.2 | -53.5 | -56.7 | 0 | 0 | 111.3 | Y320 I321 Y325 L326 A327 | Y320-Q323 PolarHBondContact O-N 2.92Å; I321-Q323 VanDerWaalsContact C-N 3.34Å; I321-Q323 PolarHBondContact O-N 3.38Å; Q323-Y325 VanDerWaalsContact C-N 3.35Å; Q323-L326 PolarHBondContact O-N 2.9Å; Q323-A327 WeakPolarHBondContact O-CB 3.35Å; Q323-A327 PolarHBondContact O-N 3.42Å |
| 324 | I | 83.4 | Confident | 78.9 | Confident | 87 Ų | 87 | 57.2 Ų | 57.2 | 45% | 0.446 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -63 | -45.8 | 176.8 | -62.4 | 172.4 | 0 | 0 | 0 | 109.5 | Y305 Y320 I321 A327 S328 | Y305-I324 HydrophobicContact CD2-CG2 4.08Å; Y320-I324 PolarHBondContact O-N 3.39Å; I321-I324 PolarHBondContact O-N 3.1Å; I324-A327 PolarHBondContact O-N 3.47Å; I324-S328 WeakPolarHBondContact O-CB 3.32Å; I324-S328 PolarHBondContact O-N 2.7Å; I324-S328 PolarHBondContact O-OG 2.97Å |
| 325 | Y | 80 | Confident | 79.9 | Confident | 11 Ų | 11 | 51.5 Ų | 51.5 | 4% | 0.043 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -60.5 | -50.2 | 175.3 | 171.7 | -110.6 | 0 | 0 | 0 | 112.3 | V30 L34 Y302 Y305 I321 Q323 A327 S328 F329 | V30-Y325 HydrophobicContact CB-CD2 3.91Å; V30-Y325 HydrophobicContact CB-CE1 4.03Å; V30-Y325 HydrophobicContact CB-CE2 3.32Å; V30-Y325 HydrophobicContact CB-CG 4.42Å; V30-Y325 HydrophobicContact CG1-CD1 3.61Å; V30-Y325 HydrophobicContact CG1-CD2 3.1Å; V30-Y325 HydrophobicContact CG1-CE1 3.61Å; V30-Y325 HydrophobicContact CG1-CE2 3.08Å; V30-Y325 HydrophobicContact CG1-CG 3.33Å; V30-Y325 HydrophobicContact CG2-CD2 4.29Å; V30-Y325 HydrophobicContact CG2-CE2 3.73Å; L34-Y325 HydrophobicContact CD1-CD1 3.85Å; L34-Y325 HydrophobicContact CD1-CE1 3.99Å; L34-Y325 HydrophobicContact CG-CD1 4.32Å; Y302-Y325 HydrophobicContact CE2-CE2 4.12Å; Y305-Y325 HydrophobicContact CD1-CD2 4.21Å; Y305-Y325 AromaticContact CE1-CD2 3.87Å; Y305-Y325 HydrophobicContact CE1-CD2 3.87Å; Y305-Y325 HydrophobicContact CE1-CG 4.44Å; I321-Y325 PolarHBondContact O-N 3.24Å; Q323-Y325 VanDerWaalsContact C-N 3.35Å; Y325-A327 PolarHBondContact O-N 2.73Å; Y325-S328 PolarHBondContact O-N 2.78Å; Y325-F329 HydrophobicContact CD2-CB 4.37Å; Y325-F329 HydrophobicContact CE1-CB 4.44Å; Y325-F329 HydrophobicContact CE2-CB 3.96Å; Y325-F329 HydrophobicContact CE2-CG 4.39Å; Y325-F329 VanDerWaalsContact O-CB 3.23Å; Y325-F329 WeakPolarHBondContact O-CB 3.29Å; Y325-F329 PolarHBondContact O-N 3.35Å |
| 326 | L | 79.6 | Confident | 81 | Confident | 12 Ų | 12 | 48.9 Ų | 48.9 | 6% | 0.063 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -58.8 | -37.2 | 179.7 | -74.6 | 171.8 | 0 | 0 | 0 | 111.7 | W75 Y79 Q322 Q323 W330 | W75-L326 HydrophobicContact CD2-CB 4.44Å; W75-L326 HydrophobicContact CH2-CB 4.3Å; W75-L326 HydrophobicContact CZ2-CB 3.98Å; Y79-L326 PolarHBondContact OH-O 3.33Å; Q322-L326 HydrophobicContact CG-CD1 4.13Å; Q322-L326 WeakPolarHBondContact O-CB 3.36Å; Q322-L326 VanDerWaalsContact O-CG 3.29Å; Q322-L326 WeakPolarHBondContact O-CG 3.29Å; Q322-L326 PolarHBondContact O-N 3.08Å; Q323-L326 PolarHBondContact O-N 2.9Å; L326-W330 WeakPolarHBondContact O-CB 3.48Å; L326-W330 PolarHBondContact O-N 2.99Å |
| 327 | A | 87.7 | Confident | 82.3 | Confident | 43 Ų | 43 | 49.1 Ų | 49.1 | 36% | 0.355 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -70.8 | -47.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | W75 Q323 I324 Y325 F329 W330 L331 | W75-A327 HydrophobicContact CH2-CB 3.85Å; W75-A327 HydrophobicContact CZ2-CB 4.34Å; Q323-A327 WeakPolarHBondContact O-CB 3.35Å; Q323-A327 PolarHBondContact O-N 3.42Å; I324-A327 PolarHBondContact O-N 3.47Å; Y325-A327 PolarHBondContact O-N 2.73Å; A327-F329 VanDerWaalsContact C-N 3.35Å; A327-F329 PolarHBondContact O-N 3.39Å; A327-W330 PolarHBondContact O-N 2.93Å; A327-L331 WeakPolarHBondContact O-CB 3.43Å; A327-L331 PolarHBondContact O-N 2.88Å |
| 328 | S | 89.1 | Confident | 83.6 | Confident | 13 Ų | 13 | 43.3 Ų | 43.3 | 9% | 0.091 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -63.1 | -40.9 | 177.3 | -66.3 | 0 | 0 | 0 | 0 | 111.9 | I324 Y325 L331 A332 | I324-S328 WeakPolarHBondContact O-CB 3.32Å; I324-S328 PolarHBondContact O-N 2.7Å; I324-S328 PolarHBondContact O-OG 2.97Å; Y325-S328 PolarHBondContact O-N 2.78Å; S328-L331 PolarHBondContact O-N 3.19Å; S328-A332 WeakPolarHBondContact O-CB 3.47Å; S328-A332 PolarHBondContact O-N 3.26Å |
| 329 | F | 85.3 | Confident | 84.5 | Confident | 12 Ų | 12 | 36.1 Ų | 36.1 | 5% | 0.053 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -67.6 | -43.6 | 176 | -175.5 | -119.5 | 0 | 0 | 0 | 111.3 | Y79 N129 Y302 Y325 A327 L331 A332 M333 | Y79-F329 AromaticContact CE1-CD1 3.73Å; Y79-F329 HydrophobicContact CE1-CD1 3.73Å; Y79-F329 AromaticContact CE1-CE1 3.91Å; Y79-F329 HydrophobicContact CE1-CE1 3.91Å; Y79-F329 AromaticContact CZ-CD1 3.89Å; Y79-F329 VanDerWaalsContact OH-CD1 3.23Å; Y79-F329 WeakPolarHBondContact OH-CD1 3.32Å; N129-F329 HydrophobicContact CB-CE1 3.93Å; N129-F329 HydrophobicContact CB-CZ 4.16Å; N129-F329 WeakPolarHBondContact ND2-CZ 3.29Å; Y302-F329 HydrophobicContact CD2-CB 4.44Å; Y302-F329 HydrophobicContact CD2-CD2 4.19Å; Y302-F329 HydrophobicContact CE2-CB 4.48Å; Y302-F329 AromaticContact CE2-CD2 3.65Å; Y302-F329 HydrophobicContact CE2-CD2 3.65Å; Y302-F329 HydrophobicContact CE2-CE2 4.44Å; Y325-F329 HydrophobicContact CD2-CB 4.37Å; Y325-F329 HydrophobicContact CE1-CB 4.44Å; Y325-F329 HydrophobicContact CE2-CB 3.96Å; Y325-F329 HydrophobicContact CE2-CG 4.39Å; Y325-F329 VanDerWaalsContact O-CB 3.23Å; Y325-F329 WeakPolarHBondContact O-CB 3.29Å; Y325-F329 PolarHBondContact O-N 3.35Å; A327-F329 VanDerWaalsContact C-N 3.35Å; A327-F329 PolarHBondContact O-N 3.39Å; F329-L331 VanDerWaalsContact C-N 3.29Å; F329-L331 PolarHBondContact O-N 3.01Å; F329-A332 PolarHBondContact O-N 3.13Å; F329-M333 HydrophobicContact CD1-CG 4.33Å; F329-M333 HydrophobicContact CD2-CG 4.12Å; F329-M333 HydrophobicContact CD2-SD 4.23Å; F329-M333 HydrophobicContact CE1-CG 3.91Å; F329-M333 HydrophobicContact CE2-CG 3.71Å; F329-M333 HydrophobicContact CE2-SD 3.5Å; F329-M333 VanDerWaalsContact CE2-SD 3.5Å; F329-M333 HydrophobicContact CG-CG 4.41Å; F329-M333 HydrophobicContact CZ-CE 4.43Å; F329-M333 HydrophobicContact CZ-CG 3.57Å; F329-M333 HydrophobicContact CZ-SD 3.71Å; F329-M333 VanDerWaalsContact O-CG 3.32Å; F329-M333 WeakPolarHBondContact O-CG 3.46Å; F329-M333 PolarHBondContact O-N 3.26Å |
| 330 | W | 89.1 | Confident | 85.7 | Confident | 67 Ų | 67 | 29.9 Ų | 29.9 | 25% | 0.254 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -58.6 | -44.8 | 176.1 | 178.2 | 84.9 | 0 | 0 | 0 | 111.1 | W75 A78 Y79 V82 L326 A327 M333 S334 | W75-W330 HydrophobicContact CH2-CB 4.49Å; W75-W330 HydrophobicContact CZ3-CB 3.71Å; W75-W330 AromaticContact CZ3-CG 3.89Å; W75-W330 HydrophobicContact CZ3-CG 3.89Å; A78-W330 PolarHBondContact O-NE1 3.4Å; A78-W330 VanDerWaalsContact O-NE1 3.09Å; Y79-W330 AromaticContact CD2-CD1 3.88Å; Y79-W330 HydrophobicContact CE1-CB 4.21Å; Y79-W330 HydrophobicContact CE2-CB 3.88Å; Y79-W330 AromaticContact CE2-CD1 3.9Å; Y79-W330 HydrophobicContact CE2-CG 4.28Å; Y79-W330 WeakPolarHBondContact OH-CA 3.43Å; Y79-W330 WeakPolarHBondContact OH-CB 3.23Å; Y79-W330 PolarHBondContact OH-N 3.45Å; V82-W330 HydrophobicContact CG2-CZ2 4.27Å; L326-W330 WeakPolarHBondContact O-CB 3.48Å; L326-W330 PolarHBondContact O-N 2.99Å; A327-W330 PolarHBondContact O-N 2.93Å; W330-M333 PolarHBondContact O-N 3.06Å; W330-S334 WeakPolarHBondContact O-CB 3.49Å; W330-S334 PolarHBondContact O-N 3.35Å |
| 331 | L | 92.5 | Very high | 86.5 | Confident | 43 Ų | 43 | 26.1 Ų | 26.1 | 23% | 0.225 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -63.5 | -43.7 | 177.8 | -171.1 | 71.8 | 0 | 0 | 0 | 111.4 | C298 P301 A327 S328 F329 M333 S334 | C298-L331 HydrophobicContact CB-CG 4.44Å; C298-L331 WeakPolarHBondContact CB-O 3.29Å; P301-L331 HydrophobicContact CG-CD2 3.75Å; A327-L331 WeakPolarHBondContact O-CB 3.43Å; A327-L331 PolarHBondContact O-N 2.88Å; S328-L331 PolarHBondContact O-N 3.19Å; F329-L331 VanDerWaalsContact C-N 3.29Å; F329-L331 PolarHBondContact O-N 3.01Å; L331-M333 PolarHBondContact O-N 3.45Å; L331-S334 WeakPolarHBondContact O-CB 3.42Å; L331-S334 PolarHBondContact O-N 3.28Å; L331-S334 PolarHBondContact O-OG 2.88Å |
| 332 | A | 90.1 | Very high | 87.1 | Confident | 0 Ų | 0 | 26.2 Ų | 26.2 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -59.5 | -46.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | C298 W299 Y302 S328 F329 S334 S335 | C298-A332 WeakPolarHBondContact O-CA 3.09Å; C298-A332 PolarHBondContact O-N 3.04Å; W299-A332 HydrophobicContact CD2-CB 4.25Å; W299-A332 HydrophobicContact CE3-CB 4.2Å; W299-A332 HydrophobicContact CH2-CB 4.38Å; W299-A332 HydrophobicContact CZ2-CB 4.47Å; W299-A332 HydrophobicContact CZ3-CB 4.27Å; Y302-A332 HydrophobicContact CD2-CB 4.35Å; Y302-A332 HydrophobicContact CG-CB 4.17Å; S328-A332 WeakPolarHBondContact O-CB 3.47Å; S328-A332 PolarHBondContact O-N 3.26Å; F329-A332 PolarHBondContact O-N 3.13Å; A332-S334 VanDerWaalsContact C-N 3.3Å; A332-S334 PolarHBondContact O-N 2.85Å; A332-S335 VanDerWaalsContact O-CB 3.29Å; A332-S335 WeakPolarHBondContact O-CB 3.31Å; A332-S335 PolarHBondContact O-N 2.66Å; A332-S335 PolarHBondContact O-OG 3.3Å |
| 333 | M | 89 | Confident | 87.7 | Confident | 3 Ų | 3 | 25.7 Ų | 25.7 | 2% | 0.015 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -67.4 | -31.3 | 178.7 | -60.1 | -40.1 | -77.3 | 0 | 0 | 112.5 | V82 M121 T126 F329 W330 L331 S335 T336 | V82-M333 HydrophobicContact CG1-CB 4.3Å; M121-M333 HydrophobicContact CE-CE 3.95Å; M121-M333 HydrophobicContact CG-CE 3.79Å; M121-M333 HydrophobicContact SD-CE 4.01Å; T126-M333 HydrophobicContact CG2-CB 4.35Å; T126-M333 HydrophobicContact CG2-CG 4.32Å; T126-M333 WeakPolarHBondContact OG1-CE 3.23Å; F329-M333 HydrophobicContact CD1-CG 4.33Å; F329-M333 HydrophobicContact CD2-CG 4.12Å; F329-M333 HydrophobicContact CD2-SD 4.23Å; F329-M333 HydrophobicContact CE1-CG 3.91Å; F329-M333 HydrophobicContact CE2-CG 3.71Å; F329-M333 HydrophobicContact CE2-SD 3.5Å; F329-M333 VanDerWaalsContact CE2-SD 3.5Å; F329-M333 HydrophobicContact CG-CG 4.41Å; F329-M333 HydrophobicContact CZ-CE 4.43Å; F329-M333 HydrophobicContact CZ-CG 3.57Å; F329-M333 HydrophobicContact CZ-SD 3.71Å; F329-M333 VanDerWaalsContact O-CG 3.32Å; F329-M333 WeakPolarHBondContact O-CG 3.46Å; F329-M333 PolarHBondContact O-N 3.26Å; W330-M333 PolarHBondContact O-N 3.06Å; L331-M333 PolarHBondContact O-N 3.45Å; M333-S335 PolarHBondContact O-N 3.35Å; M333-S335 VanDerWaalsContact O-N 3.14Å; M333-T336 PolarHBondContact O-N 2.78Å; M333-T336 PolarHBondContact O-OG1 2.95Å |
| 334 | S | 92.1 | Very high | 88.1 | Confident | 0 Ų | 0 | 25.5 Ų | 25.5 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -59.8 | -23.1 | 176 | 81.3 | 0 | 0 | 0 | 0 | 113.3 | W330 L331 A332 T336 M337 Y338 | W330-S334 WeakPolarHBondContact O-CB 3.49Å; W330-S334 PolarHBondContact O-N 3.35Å; L331-S334 WeakPolarHBondContact O-CB 3.42Å; L331-S334 PolarHBondContact O-N 3.28Å; L331-S334 PolarHBondContact O-OG 2.88Å; A332-S334 VanDerWaalsContact C-N 3.3Å; A332-S334 PolarHBondContact O-N 2.85Å; S334-T336 PolarHBondContact O-N 3.49Å; S334-T336 VanDerWaalsContact O-N 3.1Å; S334-M337 WeakPolarHBondContact O-CG 3.4Å; S334-M337 PolarHBondContact O-N 3.34Å; S334-Y338 VanDerWaalsContact O-CD2 3.23Å; S334-Y338 WeakPolarHBondContact O-CD2 3.39Å; S334-Y338 VanDerWaalsContact O-CE2 3.28Å; S334-Y338 WeakPolarHBondContact O-CE2 3.44Å; S334-Y338 VanDerWaalsContact OG-CE2 3.29Å; S334-Y338 WeakPolarHBondContact OG-CE2 3.36Å; S334-Y338 PolarHBondContact OG-OH 3.13Å |
| 335 | S | 91.9 | Very high | 88.1 | Confident | 10 Ų | 10 | 25.1 Ų | 25.1 | 7% | 0.07 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -54.4 | -32.3 | 175.5 | 66.9 | 0 | 0 | 0 | 0 | 113.3 | W299 A332 M333 M337 | W299-S335 PolarHBondContact NE1-OG 3.44Å; A332-S335 VanDerWaalsContact O-CB 3.29Å; A332-S335 WeakPolarHBondContact O-CB 3.31Å; A332-S335 PolarHBondContact O-N 2.66Å; A332-S335 PolarHBondContact O-OG 3.3Å; M333-S335 PolarHBondContact O-N 3.35Å; M333-S335 VanDerWaalsContact O-N 3.14Å; S335-M337 VanDerWaalsContact C-N 3.35Å; S335-M337 PolarHBondContact O-N 3.36Å |
| 336 | T | 90.8 | Very high | 87.8 | Confident | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -70.4 | -24.9 | -179.9 | 61.8 | 0 | 0 | 0 | 0 | 114.2 | A86 N90 D118 M121 M333 S334 | A86-T336 VanDerWaalsContact CB-OG1 3.3Å; A86-T336 WeakPolarHBondContact CB-OG1 3.37Å; N90-T336 PolarHBondContact ND2-O 2.84Å; D118-T336 HydrophobicContact CB-CG2 4.04Å; M121-T336 HydrophobicContact CE-CG2 3.17Å; M333-T336 PolarHBondContact O-N 2.78Å; M333-T336 PolarHBondContact O-OG1 2.95Å; S334-T336 PolarHBondContact O-N 3.49Å; S334-T336 VanDerWaalsContact O-N 3.1Å |
| 337 | M | 92.8 | Very high | 87.8 | Confident | 19 Ų | 19 | 28.6 Ų | 28.6 | 9% | 0.094 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -85.5 | -24.7 | 179.5 | 61.3 | 160 | 173.2 | 0 | 0 | 113.1 | V82 V85 A86 S334 S335 I341 | V82-M337 HydrophobicContact CG2-CE 3.96Å; V82-M337 HydrophobicContact CG2-SD 4.19Å; V85-M337 HydrophobicContact CB-CB 4.04Å; V85-M337 HydrophobicContact CG1-CB 3.78Å; A86-M337 HydrophobicContact CB-CB 4.28Å; S334-M337 WeakPolarHBondContact O-CG 3.4Å; S334-M337 PolarHBondContact O-N 3.34Å; S335-M337 VanDerWaalsContact C-N 3.35Å; S335-M337 PolarHBondContact O-N 3.36Å; M337-I341 WeakPolarHBondContact O-CD1 3.29Å; M337-I341 WeakPolarHBondContact O-CG1 3.49Å |
| 338 | Y | 91.7 | Very high | 87.4 | Confident | 62 Ų | 62 | 32.8 Ų | 32.8 | 24% | 0.243 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -72.8 | -29.6 | -176.6 | -57.8 | -50 | 0 | 0 | 0 | 113.1 | T294 S334 I341 I342 | T294-Y338 HydrophobicContact CG2-CD2 3.34Å; T294-Y338 HydrophobicContact CG2-CE2 4.06Å; T294-Y338 HydrophobicContact CG2-CG 3.91Å; S334-Y338 VanDerWaalsContact O-CD2 3.23Å; S334-Y338 WeakPolarHBondContact O-CD2 3.39Å; S334-Y338 VanDerWaalsContact O-CE2 3.28Å; S334-Y338 WeakPolarHBondContact O-CE2 3.44Å; S334-Y338 VanDerWaalsContact OG-CE2 3.29Å; S334-Y338 WeakPolarHBondContact OG-CE2 3.36Å; S334-Y338 PolarHBondContact OG-OH 3.13Å; Y338-I341 WeakPolarHBondContact O-CB 3.29Å; Y338-I341 PolarHBondContact O-N 3.24Å; Y338-I341 VanDerWaalsContact O-N 3.15Å; Y338-I342 WeakPolarHBondContact O-CB 3.43Å; Y338-I342 WeakPolarHBondContact O-CG1 3.48Å; Y338-I342 PolarHBondContact O-N 2.9Å |
| 339 | N | 88.9 | Confident | 87 | Confident | 13 Ų | 13 | 36.8 Ų | 36.8 | 7% | 0.07 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -55.7 | -56.1 | -176.4 | -72.3 | -25 | 0 | 0 | 0 | 112.7 | D118 I341 I342 Y343 | D118-N339 PolarHBondContact OD2-ND2 3.33Å; N339-I341 VanDerWaalsContact C-N 3.32Å; N339-I341 PolarHBondContact O-N 3.2Å; N339-I342 PolarHBondContact O-N 3.4Å; N339-Y343 HydrophobicContact CB-CE2 4.11Å; N339-Y343 WeakPolarHBondContact O-CD2 3.48Å; N339-Y343 PolarHBondContact O-N 3.39Å |
| 340 | P | 88.9 | Confident | 86.8 | Confident | 4 Ų | 4 | 36.2 Ų | 36.2 | 3% | 0.026 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -56.4 | -40.5 | 173.6 | -26.6 | 34 | 0 | 0 | 0 | 114.4 | G89 N90 V93 Y343 C344 F354 | G89-P340 VanDerWaalsContact C-CG 3.43Å; N90-P340 HydrophobicContact CB-CG 4.39Å; N90-P340 WeakPolarHBondContact OD1-CG 3.45Å; V93-P340 HydrophobicContact CG2-CB 3.98Å; V93-P340 HydrophobicContact CG2-CG 4.16Å; P340-Y343 PolarHBondContact O-N 3.24Å; P340-C344 WeakPolarHBondContact O-CB 3.48Å; P340-C344 PolarHBondContact O-N 2.89Å; P340-F354 HydrophobicContact CB-CZ 4.12Å |
| 341 | I | 89.8 | Confident | 86.6 | Confident | 77 Ų | 77 | 38.1 Ų | 38.1 | 40% | 0.395 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -63 | -48 | -179.2 | -61.3 | 171.1 | 0 | 0 | 0 | 109.7 | V85 M337 Y338 N339 Y343 C344 C345 | V85-I341 HydrophobicContact CG1-CD1 4.34Å; M337-I341 WeakPolarHBondContact O-CD1 3.29Å; M337-I341 WeakPolarHBondContact O-CG1 3.49Å; Y338-I341 WeakPolarHBondContact O-CB 3.29Å; Y338-I341 PolarHBondContact O-N 3.24Å; Y338-I341 VanDerWaalsContact O-N 3.15Å; N339-I341 VanDerWaalsContact C-N 3.32Å; N339-I341 PolarHBondContact O-N 3.2Å; I341-Y343 VanDerWaalsContact C-N 3.32Å; I341-Y343 PolarHBondContact O-N 3.17Å; I341-C344 PolarHBondContact O-N 3.32Å; I341-C345 PolarHBondContact O-N 3.12Å; I341-C345 PolarHBondContact O-SG 3.46Å |
| 342 | I | 87.9 | Confident | 86.1 | Confident | 16 Ų | 16 | 36.1 Ų | 36.1 | 8% | 0.082 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -60.2 | -43.9 | 178.1 | -65.9 | 166 | 0 | 0 | 0 | 110.3 | M287 I290 V291 Y338 N339 C345 L346 | M287-I342 HydrophobicContact CG-CG2 3.91Å; I290-I342 HydrophobicContact CG2-CD1 4.3Å; V291-I342 HydrophobicContact CB-CD1 4.47Å; V291-I342 HydrophobicContact CG2-CB 4.41Å; V291-I342 HydrophobicContact CG2-CD1 3.89Å; V291-I342 HydrophobicContact CG2-CG2 3.7Å; Y338-I342 WeakPolarHBondContact O-CB 3.43Å; Y338-I342 WeakPolarHBondContact O-CG1 3.48Å; Y338-I342 PolarHBondContact O-N 2.9Å; N339-I342 PolarHBondContact O-N 3.4Å; I342-C345 PolarHBondContact O-N 3.31Å; I342-L346 HydrophobicContact CG2-CD1 3.8Å; I342-L346 WeakPolarHBondContact O-CB 3.23Å; I342-L346 PolarHBondContact O-N 2.87Å |
| 343 | Y | 84.5 | Confident | 85.7 | Confident | 6 Ų | 6 | 36.1 Ų | 36.1 | 2% | 0.024 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -64.9 | -40.2 | 177.9 | -56.4 | -26.4 | 0 | 0 | 0 | 112.5 | V93 L111 L114 M287 N339 P340 I341 N347 | V93-Y343 HydrophobicContact CG1-CD2 4.41Å; V93-Y343 HydrophobicContact CG2-CD2 4.2Å; L111-Y343 HydrophobicContact CD2-CE1 4.03Å; L111-Y343 HydrophobicContact CD2-CE2 3.91Å; L111-Y343 VanDerWaalsContact CD2-CZ 3.49Å; L111-Y343 VanDerWaalsContact CD2-OH 3.3Å; L111-Y343 WeakPolarHBondContact CD2-OH 3.08Å; L114-Y343 WeakPolarHBondContact CD2-OH 3.33Å; M287-Y343 HydrophobicContact CE-CD1 3.75Å; M287-Y343 HydrophobicContact CE-CE1 3.96Å; M287-Y343 HydrophobicContact SD-CD1 4.47Å; N339-Y343 HydrophobicContact CB-CE2 4.11Å; N339-Y343 WeakPolarHBondContact O-CD2 3.48Å; N339-Y343 PolarHBondContact O-N 3.39Å; P340-Y343 PolarHBondContact O-N 3.24Å; I341-Y343 VanDerWaalsContact C-N 3.32Å; I341-Y343 PolarHBondContact O-N 3.17Å; Y343-N347 WeakPolarHBondContact O-CB 3.31Å; Y343-N347 PolarHBondContact O-N 3.04Å |
| 344 | C | 85.3 | Confident | 85.5 | Confident | 37 Ų | 37 | 36.8 Ų | 36.8 | 25% | 0.25 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -64.1 | -44.5 | 176.8 | -171.9 | 0 | 0 | 0 | 0 | 112.1 | P340 I341 R351 F354 | P340-C344 WeakPolarHBondContact O-CB 3.48Å; P340-C344 PolarHBondContact O-N 2.89Å; I341-C344 PolarHBondContact O-N 3.32Å; C344-R351 WeakPolarHBondContact O-CB 3.12Å; C344-F354 HydrophobicContact CB-CD2 3.68Å; C344-F354 HydrophobicContact CB-CE2 3.79Å; C344-F354 HydrophobicContact CB-CG 4.3Å; C344-F354 HydrophobicContact CB-CZ 4.47Å |
| 345 | C | 82.4 | Confident | 85.1 | Confident | 79 Ų | 79 | 39.9 Ų | 39.9 | 53% | 0.534 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -71.8 | -39.3 | -178.2 | -66.8 | 0 | 0 | 0 | 0 | 112.8 | I341 I342 | I341-C345 PolarHBondContact O-N 3.12Å; I341-C345 PolarHBondContact O-SG 3.46Å; I342-C345 PolarHBondContact O-N 3.31Å |
| 346 | L | 75.4 | Confident | 84.6 | Confident | 47 Ų | 47 | 43.2 Ų | 43.2 | 25% | 0.246 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -101.2 | -24.6 | -165.9 | -59.7 | -179.4 | 0 | 0 | 0 | 113.7 | K283 M287 I290 I342 | K283-L346 WeakPolarHBondContact CE-O 3.47Å; K283-L346 PolarHBondContact NZ-O 3.44Å; K283-L346 VanDerWaalsContact NZ-O 3.08Å; M287-L346 HydrophobicContact CB-CB 3.97Å; M287-L346 HydrophobicContact CB-CD1 3.46Å; M287-L346 VanDerWaalsContact CB-CD1 3.46Å; M287-L346 HydrophobicContact CB-CG 4.33Å; M287-L346 HydrophobicContact CG-CB 3.95Å; M287-L346 HydrophobicContact CG-CD1 3.68Å; M287-L346 HydrophobicContact CG-CG 4.44Å; M287-L346 HydrophobicContact SD-CB 3.75Å; I290-L346 HydrophobicContact CD1-CD1 4.05Å; I342-L346 HydrophobicContact CG2-CD1 3.8Å; I342-L346 WeakPolarHBondContact O-CB 3.23Å; I342-L346 PolarHBondContact O-N 2.87Å |
| 347 | N | 79.1 | Confident | 84.2 | Confident | 50 Ų | 50 | 43.9 Ų | 43.9 | 27% | 0.267 | 21% | 0.207 | S | C | . | . | trans | -109.3 | 113.8 | -179.6 | -169.6 | -35.3 | 0 | 0 | 0 | 112.5 | Y343 R349 F350 R351 | Y343-N347 WeakPolarHBondContact O-CB 3.31Å; Y343-N347 PolarHBondContact O-N 3.04Å; N347-R349 VanDerWaalsContact C-N 3.26Å; N347-R349 PolarHBondContact O-N 3.22Å; N347-R349 PolarHBondContact OD1-N 3.3Å; N347-F350 HydrophobicContact CB-CB 4.17Å; N347-F350 HydrophobicContact CB-CD2 3.78Å; N347-F350 HydrophobicContact CB-CG 4.46Å; N347-F350 WeakPolarHBondContact ND2-CD2 3.45Å; N347-F350 PolarHBondContact O-N 3.48Å; N347-F350 VanDerWaalsContact O-N 3.17Å; N347-R351 PolarHBondContact O-N 2.91Å | ||
| 348 | K | 78.8 | Confident | 83.7 | Confident | 130 Ų | 130 | 46.6 Ų | 46.6 | 57% | 0.565 | 22% | 0.218 | S | C | * | . | H | α-helix | trans | -55.8 | -37.8 | -177.9 | -66.6 | -175.2 | 179.5 | -177 | 0 | 112.7 | R351 A352 | K348-R351 PolarHBondContact O-N 2.94Å; K348-A352 PolarHBondContact O-N 3.4Å |
| 349 | R | 80.2 | Confident | 83.1 | Confident | 97 Ų | 97 | 50.7 Ų | 50.7 | 37% | 0.366 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -72.2 | -40.5 | -179.8 | -65.3 | -175.1 | -174.9 | 160.1 | 5.8 | 112.3 | M103 N347 A352 G353 E373 | M103-R349 HydrophobicContact CE-CB 4.05Å; M103-R349 HydrophobicContact SD-CB 4.01Å; N347-R349 VanDerWaalsContact C-N 3.26Å; N347-R349 PolarHBondContact O-N 3.22Å; N347-R349 PolarHBondContact OD1-N 3.3Å; R349-A352 PolarHBondContact O-N 2.95Å; R349-G353 PolarHBondContact O-N 3.36Å; R349-E373 IonicContact NE-OE2 2.76Å |
| 350 | F | 81.2 | Confident | 82.5 | Confident | 1 Ų | 1 | 60.8 Ų | 60.8 | 0% | 0.004 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -64.4 | -43.9 | 173 | -82.6 | -79.8 | 0 | 0 | 0 | 110.5 | V93 I96 I97 M103 L111 N347 A352 G353 F354 | V93-F350 HydrophobicContact CG1-CE1 4.17Å; I96-F350 HydrophobicContact CD1-CD1 4.44Å; I96-F350 HydrophobicContact CG2-CD1 4.11Å; I96-F350 HydrophobicContact CG2-CE1 4.29Å; I97-F350 HydrophobicContact CD1-CE1 3.94Å; I97-F350 HydrophobicContact CD1-CZ 3.85Å; I97-F350 HydrophobicContact CG1-CE1 3.81Å; I97-F350 HydrophobicContact CG1-CZ 3.89Å; M103-F350 HydrophobicContact CE-CD2 4.02Å; M103-F350 HydrophobicContact CE-CE1 4.37Å; M103-F350 HydrophobicContact CE-CE2 3.73Å; M103-F350 HydrophobicContact CE-CG 4.47Å; M103-F350 HydrophobicContact CE-CZ 3.92Å; L111-F350 HydrophobicContact CD1-CE2 4.02Å; L111-F350 HydrophobicContact CD1-CZ 3.82Å; N347-F350 HydrophobicContact CB-CB 4.17Å; N347-F350 HydrophobicContact CB-CD2 3.78Å; N347-F350 HydrophobicContact CB-CG 4.46Å; N347-F350 WeakPolarHBondContact ND2-CD2 3.45Å; N347-F350 PolarHBondContact O-N 3.48Å; N347-F350 VanDerWaalsContact O-N 3.17Å; F350-A352 VanDerWaalsContact C-N 3.32Å; F350-A352 PolarHBondContact O-N 3.34Å; F350-G353 CarbonylContact O-C 3.52Å; F350-G353 WeakPolarHBondContact O-CA 3.43Å; F350-G353 PolarHBondContact O-N 3.33Å; F350-F354 HydrophobicContact CB-CD2 4.37Å; F350-F354 HydrophobicContact CB-CE2 4.38Å; F350-F354 WeakPolarHBondContact O-CD2 3.4Å; F350-F354 PolarHBondContact O-N 2.9Å |
| 351 | R | 84.7 | Confident | 82 | Confident | 107 Ų | 107 | 63 Ų | 63 | 40% | 0.404 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -55.3 | -45.3 | 175.7 | -165.6 | 169.3 | 63.7 | -179.1 | 5 | 112.7 | C344 N347 K348 G353 F354 K355 | C344-R351 WeakPolarHBondContact O-CB 3.12Å; N347-R351 PolarHBondContact O-N 2.91Å; K348-R351 PolarHBondContact O-N 2.94Å; R351-G353 VanDerWaalsContact C-N 3.34Å; R351-G353 PolarHBondContact O-N 2.98Å; R351-F354 PolarHBondContact O-N 3.46Å; R351-K355 WeakPolarHBondContact O-CG 3.47Å; R351-K355 PolarHBondContact O-N 3.14Å |
| 352 | A | 83.1 | Confident | 81 | Confident | 1 Ų | 1 | 64.8 Ų | 64.8 | 1% | 0.008 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -60.4 | -43 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | K348 R349 F350 K355 R356 D370 L374 | K348-A352 PolarHBondContact O-N 3.4Å; R349-A352 PolarHBondContact O-N 2.95Å; F350-A352 VanDerWaalsContact C-N 3.32Å; F350-A352 PolarHBondContact O-N 3.34Å; A352-K355 PolarHBondContact O-N 2.96Å; A352-R356 PolarHBondContact O-N 2.65Å; A352-D370 HydrophobicContact CB-CB 3.74Å; A352-L374 HydrophobicContact CB-CD1 4.21Å; A352-L374 HydrophobicContact CB-CG 4.21Å |
| 353 | G | 81.8 | Confident | 80.3 | Confident | 0 Ų | 0 | 73.4 Ų | 73.4 | 0% | 0 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -60.4 | -43.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | R349 F350 R351 R356 A357 | R349-G353 PolarHBondContact O-N 3.36Å; F350-G353 CarbonylContact O-C 3.52Å; F350-G353 WeakPolarHBondContact O-CA 3.43Å; F350-G353 PolarHBondContact O-N 3.33Å; R351-G353 VanDerWaalsContact C-N 3.34Å; R351-G353 PolarHBondContact O-N 2.98Å; G353-R356 WeakPolarHBondContact O-CB 3.31Å; G353-R356 PolarHBondContact O-N 3.3Å; G353-A357 PolarHBondContact O-N 3.41Å |
| 354 | F | 83.6 | Confident | 79.8 | Confident | 16 Ų | 16 | 75.7 Ų | 75.7 | 7% | 0.07 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -63.8 | -45.1 | 175.9 | -84.1 | -75.2 | 0 | 0 | 0 | 111.7 | I92 V93 I96 P340 C344 F350 R351 R356 A357 F358 | I92-F354 HydrophobicContact CB-CD1 4.45Å; I92-F354 HydrophobicContact CB-CE1 3.94Å; I92-F354 HydrophobicContact CD1-CE1 4.47Å; I92-F354 HydrophobicContact CG2-CD1 3.54Å; I92-F354 HydrophobicContact CG2-CE1 3.41Å; I92-F354 VanDerWaalsContact CG2-CE1 3.41Å; I92-F354 HydrophobicContact CG2-CG 4.38Å; I92-F354 HydrophobicContact CG2-CZ 4.16Å; V93-F354 HydrophobicContact CG2-CE2 4.35Å; V93-F354 HydrophobicContact CG2-CZ 3.81Å; I96-F354 HydrophobicContact CD1-CD1 4.44Å; I96-F354 HydrophobicContact CD1-CD2 3.93Å; I96-F354 HydrophobicContact CD1-CE2 4.09Å; I96-F354 HydrophobicContact CD1-CG 4.1Å; I96-F354 HydrophobicContact CD1-CZ 4.43Å; P340-F354 HydrophobicContact CB-CZ 4.12Å; C344-F354 HydrophobicContact CB-CD2 3.68Å; C344-F354 HydrophobicContact CB-CE2 3.79Å; C344-F354 HydrophobicContact CB-CG 4.3Å; C344-F354 HydrophobicContact CB-CZ 4.47Å; F350-F354 HydrophobicContact CB-CD2 4.37Å; F350-F354 HydrophobicContact CB-CE2 4.38Å; F350-F354 WeakPolarHBondContact O-CD2 3.4Å; F350-F354 PolarHBondContact O-N 2.9Å; R351-F354 PolarHBondContact O-N 3.46Å; F354-R356 VanDerWaalsContact C-N 3.25Å; F354-R356 PolarHBondContact O-N 2.76Å; F354-A357 CarbonylContact O-C 3.17Å; F354-A357 WeakPolarHBondContact O-CA 3.4Å; F354-A357 WeakPolarHBondContact O-CB 3.43Å; F354-A357 PolarHBondContact O-N 2.8Å; F354-F358 AromaticContact CD1-CE2 4Å; F354-F358 HydrophobicContact CD1-CE2 4Å; F354-F358 VanDerWaalsContact O-CD2 3.26Å; F354-F358 WeakPolarHBondContact O-CD2 3.31Å; F354-F358 PolarHBondContact O-N 3.4Å |
| 355 | K | 84.4 | Confident | 79 | Confident | 65 Ų | 65 | 82.2 Ų | 82.2 | 28% | 0.283 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -58.5 | -40 | 174.4 | -70.5 | -179.4 | 177.3 | -172.7 | 0 | 111.9 | R351 A352 A357 F358 R359 I364 V366 D370 | R351-K355 WeakPolarHBondContact O-CG 3.47Å; R351-K355 PolarHBondContact O-N 3.14Å; A352-K355 PolarHBondContact O-N 2.96Å; K355-A357 VanDerWaalsContact C-N 3.35Å; K355-F358 CarbonylContact O-C 3.52Å; K355-F358 PolarHBondContact O-N 2.9Å; K355-R359 PolarHBondContact O-N 3.2Å; K355-I364 HydrophobicContact CB-CG2 3.89Å; K355-I364 HydrophobicContact CG-CG2 4.05Å; K355-V366 HydrophobicContact CB-CG2 4.04Å; K355-V366 VanDerWaalsContact O-CG2 3.29Å; K355-V366 WeakPolarHBondContact O-CG2 3.5Å; K355-D370 WeakPolarHBondContact CD-OD2 3.32Å; K355-D370 IonicContact NZ-OD1 3.76Å; K355-D370 IonicContact NZ-OD2 2.81Å; K355-D370 PolarHBondContact NZ-OD2 3.31Å |
| 356 | R | 82.6 | Confident | 78.4 | Confident | 80 Ų | 80 | 80.5 Ų | 80.5 | 30% | 0.302 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -63.5 | -40.9 | 173.9 | -176.2 | 177.1 | 179.1 | 145.1 | -0.1 | 112 | W95 A352 G353 F354 F358 R359 L374 | W95-R356 HydrophobicContact CH2-CG 4.38Å; A352-R356 PolarHBondContact O-N 2.65Å; G353-R356 WeakPolarHBondContact O-CB 3.31Å; G353-R356 PolarHBondContact O-N 3.3Å; F354-R356 VanDerWaalsContact C-N 3.25Å; F354-R356 PolarHBondContact O-N 2.76Å; R356-F358 PolarHBondContact O-N 3.16Å; R356-R359 WeakPolarHBondContact O-CD 3.2Å; R356-R359 VanDerWaalsContact O-CG 3.25Å; R356-R359 WeakPolarHBondContact O-CG 3.42Å; R356-L374 HydrophobicContact CB-CD1 4.48Å |
| 357 | A | 81.3 | Confident | 78.3 | Confident | 14 Ų | 14 | 80.6 Ų | 80.6 | 12% | 0.116 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -66.9 | -24.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | I92 W95 G353 F354 K355 W360 | I92-A357 HydrophobicContact CG2-CB 3.86Å; W95-A357 HydrophobicContact CE3-CB 4.32Å; W95-A357 HydrophobicContact CZ3-CB 3.87Å; G353-A357 PolarHBondContact O-N 3.41Å; F354-A357 CarbonylContact O-C 3.17Å; F354-A357 WeakPolarHBondContact O-CA 3.4Å; F354-A357 WeakPolarHBondContact O-CB 3.43Å; F354-A357 PolarHBondContact O-N 2.8Å; K355-A357 VanDerWaalsContact C-N 3.35Å; A357-W360 PolarHBondContact O-NE1 2.96Å |
| 358 | F | 83.4 | Confident | 77.6 | Confident | 76 Ų | 76 | 82.5 Ų | 82.5 | 33% | 0.333 | 39% | 0.387 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -113.3 | 26.6 | -179.3 | -67.9 | -72.4 | 0 | 0 | 0 | 114.2 | I92 F354 K355 R356 W360 C361 I364 | I92-F358 HydrophobicContact CD1-CE1 4.31Å; I92-F358 HydrophobicContact CD1-CE2 3.83Å; I92-F358 HydrophobicContact CD1-CZ 3.51Å; F354-F358 AromaticContact CD1-CE2 4Å; F354-F358 HydrophobicContact CD1-CE2 4Å; F354-F358 VanDerWaalsContact O-CD2 3.26Å; F354-F358 WeakPolarHBondContact O-CD2 3.31Å; F354-F358 PolarHBondContact O-N 3.4Å; K355-F358 CarbonylContact O-C 3.52Å; K355-F358 PolarHBondContact O-N 2.9Å; R356-F358 PolarHBondContact O-N 3.16Å; F358-W360 PolarHBondContact O-N 3.43Å; F358-C361 WeakPolarHBondContact O-CB 3.26Å; F358-C361 PolarHBondContact O-N 3.34Å; F358-I364 HydrophobicContact CB-CD1 3.36Å; F358-I364 HydrophobicContact CG-CD1 4.11Å |
| 359 | R | 78.4 | Confident | 76.8 | Confident | 148 Ų | 148 | 84.9 Ų | 84.9 | 56% | 0.558 | 39% | 0.394 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.7 | -17 | 177.8 | -79.1 | 176.8 | 78.7 | 179.3 | 7.1 | 116.6 | K355 R356 V366 | K355-R359 PolarHBondContact O-N 3.2Å; R356-R359 WeakPolarHBondContact O-CD 3.2Å; R356-R359 VanDerWaalsContact O-CG 3.25Å; R356-R359 WeakPolarHBondContact O-CG 3.42Å; R359-V366 HydrophobicContact CG-CB 4.32Å; R359-V366 HydrophobicContact CG-CG2 3.34Å |
| 360 | W | 75.2 | Confident | 76.6 | Confident | 225 Ų | 225 | 81.1 Ų | 81.1 | 85% | 0.852 | 38% | 0.381 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.7 | -8.8 | -172.6 | 27 | -43.8 | 0 | 0 | 0 | 110 | A357 F358 | A357-W360 PolarHBondContact O-NE1 2.96Å; F358-W360 PolarHBondContact O-N 3.43Å |
| 361 | C | 79 | Confident | 76 | Confident | 50 Ų | 50 | 84 Ų | 84 | 34% | 0.338 | 40% | 0.395 | S | S | . | . | S | Bend | trans | -85.5 | 131.3 | 169.4 | -62 | 0 | 0 | 0 | 0 | 110.3 | F358 F363 I364 | F358-C361 WeakPolarHBondContact O-CB 3.26Å; F358-C361 PolarHBondContact O-N 3.34Å; C361-F363 PolarHBondContact O-N 3.15Å; C361-F363 VanDerWaalsContact O-N 3.09Å; C361-I364 HydrophobicContact CB-CD1 4.13Å; C361-I364 HydrophobicContact CB-CG1 4.47Å; C361-I364 PolarHBondContact O-N 3.29Å; C361-I364 VanDerWaalsContact O-N 3.17Å |
| 362 | P | 69.3 | Low | 75 | Confident | 116 Ų | 116 | 84.2 Ų | 84.2 | 75% | 0.753 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.7 | -20.4 | -175 | 23.9 | -32.8 | 0 | 0 | 0 | 113.9 | ||
| 363 | F | 73.1 | Confident | 74.5 | Confident | 196 Ų | 196 | 87.9 Ų | 87.9 | 86% | 0.86 | 42% | 0.42 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.9 | -3.8 | -178.8 | -57.3 | -72.8 | 0 | 0 | 0 | 114.5 | C361 | C361-F363 PolarHBondContact O-N 3.15Å; C361-F363 VanDerWaalsContact O-N 3.09Å |
| 364 | I | 74.1 | Confident | 74 | Confident | 55 Ų | 55 | 88.5 Ų | 88.5 | 28% | 0.282 | 42% | 0.424 | S | S | . | . | trans | -117.2 | 98 | -171.3 | -64.4 | 171.1 | 0 | 0 | 0 | 110.3 | K355 F358 C361 | K355-I364 HydrophobicContact CB-CG2 3.89Å; K355-I364 HydrophobicContact CG-CG2 4.05Å; F358-I364 HydrophobicContact CB-CD1 3.36Å; F358-I364 HydrophobicContact CG-CD1 4.11Å; C361-I364 HydrophobicContact CB-CD1 4.13Å; C361-I364 HydrophobicContact CB-CG1 4.47Å; C361-I364 PolarHBondContact O-N 3.29Å; C361-I364 VanDerWaalsContact O-N 3.17Å | ||
| 365 | Q | 67.9 | Low | 73.1 | Confident | 174 Ų | 174 | 93.5 Ų | 93.5 | 81% | 0.813 | 45% | 0.445 | S | S | * | . | trans | -83.9 | 116.9 | 170.7 | -68.9 | -174.7 | -18.5 | 0 | 0 | 110.2 | S367 | Q365-S367 PolarHBondContact O-N 3.13Š| ||
| 366 | V | 70.9 | Confident | 71.7 | Confident | 43 Ų | 43 | 93.5 Ų | 93.5 | 26% | 0.261 | 45% | 0.451 | S | S | . | . | trans | -79.7 | 114.7 | 169.2 | 173.9 | 0 | 0 | 0 | 0 | 108.5 | K355 R359 | K355-V366 HydrophobicContact CB-CG2 4.04Å; K355-V366 VanDerWaalsContact O-CG2 3.29Å; K355-V366 WeakPolarHBondContact O-CG2 3.5Å; R359-V366 HydrophobicContact CG-CB 4.32Å; R359-V366 HydrophobicContact CG-CG2 3.34Å | ||
| 367 | S | 72.4 | Confident | 70.1 | Confident | 48 Ų | 48 | 95.6 Ų | 95.6 | 34% | 0.336 | 47% | 0.473 | S | S | . | . | trans | -79.3 | 149.6 | 174.2 | -177.5 | 0 | 0 | 0 | 0 | 110.4 | Q365 Y369 D370 E371 | Q365-S367 PolarHBondContact O-N 3.13Å; S367-Y369 PolarHBondContact O-N 3.46Å; S367-Y369 PolarHBondContact OG-N 3.33Å; S367-D370 PolarHBondContact N-OD2 3.08Å; S367-D370 WeakPolarHBondContact O-CB 3.34Å; S367-D370 PolarHBondContact O-N 2.86Å; S367-E371 PolarHBondContact O-N 3.19Å | ||
| 368 | S | 63.8 | Low | 68.2 | Low | 90 Ų | 90 | 104.3 Ų | 104.3 | 63% | 0.629 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -54.5 | -30 | 170.4 | 43.5 | 0 | 0 | 0 | 0 | 112.5 | E371 L372 | S368-E371 PolarHBondContact O-N 2.79Å; S368-L372 PolarHBondContact O-N 2.7Å |
| 369 | Y | 63.7 | Low | 65.8 | Low | 180 Ų | 180 | 110.3 Ų | 110.3 | 71% | 0.706 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -64.4 | -38.5 | 172.7 | -74.3 | -83.5 | 0 | 0 | 0 | 113.6 | S367 E371 L372 E373 | S367-Y369 PolarHBondContact O-N 3.46Å; S367-Y369 PolarHBondContact OG-N 3.33Å; Y369-E371 VanDerWaalsContact C-N 3.29Å; Y369-E371 PolarHBondContact O-N 3.23Å; Y369-L372 PolarHBondContact O-N 3.21Å; Y369-E373 PolarHBondContact O-N 3.42Å |
| 370 | D | 74.1 | Confident | 63.6 | Low | 19 Ų | 19 | 109.1 Ų | 109.1 | 10% | 0.102 | 53% | 0.529 | C | S | . | . | H | α-helix | trans | -67.4 | -35.5 | 178.4 | -69.3 | -48.2 | 0 | 0 | 0 | 110.4 | A352 K355 S367 L374 | A352-D370 HydrophobicContact CB-CB 3.74Å; K355-D370 WeakPolarHBondContact CD-OD2 3.32Å; K355-D370 IonicContact NZ-OD1 3.76Å; K355-D370 IonicContact NZ-OD2 2.81Å; K355-D370 PolarHBondContact NZ-OD2 3.31Å; S367-D370 PolarHBondContact N-OD2 3.08Å; S367-D370 WeakPolarHBondContact O-CB 3.34Å; S367-D370 PolarHBondContact O-N 2.86Å; D370-L374 WeakPolarHBondContact O-CG 3.5Å; D370-L374 PolarHBondContact O-N 2.86Å |
| 371 | E | 70.4 | Confident | 61.9 | Low | 61 Ų | 61 | 104.3 Ų | 104.3 | 29% | 0.285 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -71.1 | -36.1 | 175.5 | -150 | 178.6 | 168.2 | 0 | 0 | 112.1 | S367 S368 Y369 L374 K375 | S367-E371 PolarHBondContact O-N 3.19Å; S368-E371 PolarHBondContact O-N 2.79Å; Y369-E371 VanDerWaalsContact C-N 3.29Å; Y369-E371 PolarHBondContact O-N 3.23Å; E371-L374 PolarHBondContact O-N 3.22Å; E371-K375 HydrophobicContact CG-CD 4.1Å; E371-K375 VanDerWaalsContact O-CB 3.23Å; E371-K375 WeakPolarHBondContact O-CB 3.34Å; E371-K375 WeakPolarHBondContact O-CG 3.19Å; E371-K375 PolarHBondContact O-N 3.05Å; E371-K375 VanDerWaalsContact OE1-CE 3.29Å; E371-K375 WeakPolarHBondContact OE1-CE 3.27Å; E371-K375 IonicContact OE1-NZ 2.68Å; E371-K375 PolarHBondContact OE1-NZ 3.2Å |
| 372 | L | 63.1 | Low | 59.9 | Low | 112 Ų | 112 | 106.7 Ų | 106.7 | 59% | 0.586 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -65.8 | -42.1 | 176.9 | -153.2 | 83.2 | 0 | 0 | 0 | 112.4 | S368 Y369 L374 K375 T376 | S368-L372 PolarHBondContact O-N 2.7Å; Y369-L372 PolarHBondContact O-N 3.21Å; L372-L374 VanDerWaalsContact C-N 3.28Å; L372-L374 PolarHBondContact O-N 2.87Å; L372-K375 PolarHBondContact O-N 3.33Å; L372-T376 PolarHBondContact O-N 3.21Å; L372-T376 PolarHBondContact O-OG1 3.3Å |
| 373 | E | 72.8 | Confident | 58.4 | Low | 78 Ų | 78 | 112.9 Ų | 112.9 | 36% | 0.364 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -58.7 | -38.9 | 175.2 | -85.6 | -76.6 | 173.8 | 0 | 0 | 112.2 | R102 R349 Y369 | R102-E373 PolarHBondContact NH1-O 3.49Å; R349-E373 IonicContact NE-OE2 2.76Å; Y369-E373 PolarHBondContact O-N 3.42Å |
| 374 | L | 70.1 | Confident | 56.4 | Low | 13 Ų | 13 | 112.2 Ų | 112.2 | 7% | 0.068 | 55% | 0.548 | C | S | . | . | H | α-helix | trans | -77.8 | -29.9 | 176.9 | -69.4 | 166.7 | 0 | 0 | 0 | 113 | A352 R356 D370 E371 L372 | A352-L374 HydrophobicContact CB-CD1 4.21Å; A352-L374 HydrophobicContact CB-CG 4.21Å; R356-L374 HydrophobicContact CB-CD1 4.48Å; D370-L374 WeakPolarHBondContact O-CG 3.5Å; D370-L374 PolarHBondContact O-N 2.86Å; E371-L374 PolarHBondContact O-N 3.22Å; L372-L374 VanDerWaalsContact C-N 3.28Å; L372-L374 PolarHBondContact O-N 2.87Å |
| 375 | K | 66.2 | Low | 54.4 | Low | 120 Ų | 120 | 114.9 Ų | 114.9 | 52% | 0.522 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -95.3 | -20.4 | -173.4 | -82.5 | -178.9 | 171 | 168.7 | 0 | 116.2 | E371 L372 T377 | E371-K375 HydrophobicContact CG-CD 4.1Å; E371-K375 VanDerWaalsContact O-CB 3.23Å; E371-K375 WeakPolarHBondContact O-CB 3.34Å; E371-K375 WeakPolarHBondContact O-CG 3.19Å; E371-K375 PolarHBondContact O-N 3.05Å; E371-K375 VanDerWaalsContact OE1-CE 3.29Å; E371-K375 WeakPolarHBondContact OE1-CE 3.27Å; E371-K375 IonicContact OE1-NZ 2.68Å; E371-K375 PolarHBondContact OE1-NZ 3.2Å; L372-K375 PolarHBondContact O-N 3.33Å; K375-T377 VanDerWaalsContact C-N 3.34Å; K375-T377 PolarHBondContact O-N 3.31Å; K375-T377 PolarHBondContact O-OG1 3.07Å |
| 376 | T | 54.2 | Low | 52.9 | Low | 65 Ų | 65 | 111.2 Ų | 111.2 | 40% | 0.399 | 57% | 0.565 | S | S | . | * | trans | -53 | 92.5 | -166.4 | -33.3 | 0 | 0 | 0 | 0 | 113.6 | R102 L372 | R102-T376 VanDerWaalsContact NH1-CB 3.27Å; R102-T376 PolarHBondContact NH1-OG1 3.08Å; R102-T376 VanDerWaalsContact NH1-OG1 3.1Å; L372-T376 PolarHBondContact O-N 3.21Å; L372-T376 PolarHBondContact O-OG1 3.3Å | ||
| 377 | T | 47.9 | Very low | 51.4 | Low | 124 Ų | 124 | 115.7 Ų | 115.7 | 76% | 0.761 | 59% | 0.587 | S | S | * | * | trans | -93 | 117.3 | 162.4 | 29.8 | 0 | 0 | 0 | 0 | 106.3 | K375 | K375-T377 VanDerWaalsContact C-N 3.34Å; K375-T377 PolarHBondContact O-N 3.31Å; K375-T377 PolarHBondContact O-OG1 3.07Å | ||
| 378 | R | 42.9 | Very low | 49.5 | Very low | 197 Ų | 197 | 124 Ų | 124 | 74% | 0.743 | 61% | 0.613 | S | S | * | * | trans | 53 | 107.9 | 167.1 | -60.1 | -178.1 | -166 | 159.5 | 2.9 | 115.9 | H380 | R378-H380 PolarHBondContact O-N 3.25Š| ||
| 379 | F | 32.1 | Very low | 48 | Very low | 203 Ų | 203 | 126.2 Ų | 126.2 | 89% | 0.89 | 62% | 0.622 | S | S | * | * | -60.8 | 112.1 | 126.3 | -111.9 | -96.3 | 0 | 0 | 0 | 105.7 | P381 | F379-P381 VanDerWaalsContact O-CD 3.27Å; F379-P381 WeakPolarHBondContact O-CD 3.42Å | |||
| 380 | H | 31.8 | Very low | 46.5 | Very low | 122 Ų | 122 | 124.1 Ų | 124.1 | 57% | 0.565 | 63% | 0.628 | S | S | * | * | trans | -62.7 | 118.3 | 166.2 | -110.9 | -89.1 | 0 | 0 | 0 | 107.5 | R378 T382 | R378-H380 PolarHBondContact O-N 3.25Å; H380-T382 PolarHBondContact ND1-OG1 3.07Å; H380-T382 PolarHBondContact O-N 2.93Å; H380-T382 VanDerWaalsContact O-N 3.07Å | ||
| 381 | P | 40.2 | Very low | 44.4 | Very low | 125 Ų | 125 | 128.3 Ų | 128.3 | 81% | 0.812 | 66% | 0.659 | S | S | * | * | trans | -80.1 | 79.2 | 159 | 32 | -23.9 | 0 | 0 | 0 | 106 | F379 | F379-P381 VanDerWaalsContact O-CD 3.27Å; F379-P381 WeakPolarHBondContact O-CD 3.42Å | ||
| 382 | T | 36.8 | Very low | 42.6 | Very low | 100 Ų | 100 | 135.8 Ų | 135.8 | 61% | 0.613 | 68% | 0.684 | S | S | * | * | trans | -152.7 | 69.6 | 174 | -17.5 | 0 | 0 | 0 | 0 | 110.9 | H380 | H380-T382 PolarHBondContact ND1-OG1 3.07Å; H380-T382 PolarHBondContact O-N 2.93Å; H380-T382 VanDerWaalsContact O-N 3.07Å | ||
| 383 | R | 38.1 | Very low | 41 | Very low | 246 Ų | 246 | 139.5 Ų | 139.5 | 93% | 0.928 | 70% | 0.701 | S | S | * | * | trans | 159.9 | 85.5 | 137.2 | -95.6 | -171.3 | 162.1 | -158.6 | -2.5 | 110.6 | ||||
| 384 | Q | 31.6 | Very low | 38.8 | Very low | 182 Ų | 182 | 143.5 Ų | 143.5 | 85% | 0.85 | 72% | 0.72 | S | S | * | * | trans | -155.4 | 93.5 | 136.8 | -102.5 | 172.1 | -5.8 | 0 | 0 | 103 | ||||
| 385 | S | 31.3 | Very low | 36.9 | Very low | 110 Ų | 110 | 148.2 Ų | 148.2 | 77% | 0.769 | 75% | 0.753 | S | S | * | * | 32.3 | 118.5 | 102.1 | 59.9 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 386 | S | 36.4 | Very low | 35.1 | Very low | 97 Ų | 97 | 148.4 Ų | 148.4 | 68% | 0.678 | 77% | 0.765 | S | S | * | * | cis | 175.4 | 148 | 25.9 | 165 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 387 | L | 39 | Very low | 33.8 | Very low | 137 Ų | 137 | 151.1 Ų | 151.1 | 72% | 0.717 | 78% | 0.781 | S | S | * | * | trans | 68.8 | 107.5 | 164.2 | -63.9 | 152.7 | 0 | 0 | 0 | 117.4 | ||||
| 388 | Y | 32.6 | Very low | 32.9 | Very low | 224 Ų | 224 | 151 Ų | 151 | 88% | 0.878 | 78% | 0.78 | S | S | * | * | -168.8 | 105.6 | 106.2 | -88.9 | -71.5 | 0 | 0 | 0 | 107.8 | V390 | Y388-V390 PolarHBondContact O-N 3.24Š| |||
| 389 | T | 32.7 | Very low | 32.2 | Very low | 135 Ų | 135 | 147.5 Ų | 147.5 | 83% | 0.828 | 78% | 0.78 | S | S | * | * | trans | -67.7 | 109.9 | 170.4 | -49.4 | 0 | 0 | 0 | 0 | 108.2 | S391 | T389-S391 PolarHBondContact O-N 3.21Š| ||
| 390 | V | 31.4 | Very low | 32 | Very low | 136 Ų | 136 | 147 Ų | 147 | 82% | 0.824 | 78% | 0.778 | S | S | * | * | trans | -75.9 | 101.9 | 167.8 | 174.7 | 0 | 0 | 0 | 0 | 107 | Y388 | Y388-V390 PolarHBondContact O-N 3.24Š| ||
| 391 | S | 31.6 | Very low | 31.9 | Very low | 107 Ų | 107 | 148.5 Ų | 148.5 | 75% | 0.748 | 79% | 0.79 | S | S | * | * | trans | -70 | 131.3 | 168.1 | -172 | 0 | 0 | 0 | 0 | 109.3 | T389 M393 | T389-S391 PolarHBondContact O-N 3.21Å; S391-M393 PolarHBondContact O-N 3.34Å | ||
| 392 | R | 31.2 | Very low | 31.8 | Very low | 219 Ų | 219 | 147.4 Ų | 147.4 | 83% | 0.826 | 78% | 0.783 | S | S | * | * | trans | -65.6 | 118.8 | 179 | -176.5 | 178.5 | 177.3 | 162.5 | -3.4 | 109.3 | E394 | R392-E394 PolarHBondContact O-N 3.45Š| ||
| 393 | M | 29.6 | Very low | 31.4 | Very low | 190 Ų | 190 | 149.2 Ų | 149.2 | 94% | 0.936 | 79% | 0.789 | S | S | * | * | trans | -78.8 | 106.8 | 172.6 | -165 | 161.4 | 142.1 | 0 | 0 | 108 | S391 | S391-M393 PolarHBondContact O-N 3.34Š| ||
| 394 | E | 27.7 | Very low | 31 | Very low | 162 Ų | 162 | 144.5 Ų | 144.5 | 76% | 0.757 | 78% | 0.782 | S | S | * | * | trans | -73.8 | 123.6 | 170.1 | -79.6 | -178.1 | 156.2 | 0 | 0 | 109.6 | R392 V396 | R392-E394 PolarHBondContact O-N 3.45Å; E394-V396 PolarHBondContact O-N 3.4Å | ||
| 395 | S | 29.3 | Very low | 30.9 | Very low | 111 Ų | 111 | 139.6 Ų | 139.6 | 78% | 0.776 | 78% | 0.781 | S | S | * | * | trans | -75.6 | 107.3 | 169 | 51.5 | 0 | 0 | 0 | 0 | 109.3 | T397 | S395-T397 PolarHBondContact O-N 3.45Š| ||
| 396 | V | 28.7 | Very low | 30.7 | Very low | 125 Ų | 125 | 141.8 Ų | 141.8 | 76% | 0.758 | 78% | 0.784 | S | S | * | * | trans | -84.1 | 108.1 | 167.5 | 177.8 | 0 | 0 | 0 | 0 | 108.3 | E394 V398 | E394-V396 PolarHBondContact O-N 3.4Å; V396-V398 PolarHBondContact O-N 3.45Å | ||
| 397 | T | 26.9 | Very low | 30.9 | Very low | 121 Ų | 121 | 142.7 Ų | 142.7 | 74% | 0.742 | 79% | 0.787 | S | S | * | * | trans | -72.9 | 113.6 | 167.8 | -33.7 | 0 | 0 | 0 | 0 | 107.9 | S395 V399 | S395-T397 PolarHBondContact O-N 3.45Å; T397-V399 PolarHBondContact O-N 3.41Å | ||
| 398 | V | 29.3 | Very low | 30.4 | Very low | 122 Ų | 122 | 140 Ų | 140 | 74% | 0.739 | 78% | 0.784 | S | S | * | * | trans | -83.1 | 109.5 | 174.3 | -175 | 0 | 0 | 0 | 0 | 108 | V396 | V396-V398 PolarHBondContact O-N 3.45Š| ||
| 399 | V | 28.4 | Very low | 30.2 | Very low | 123 Ų | 123 | 138.6 Ų | 138.6 | 75% | 0.745 | 78% | 0.783 | S | S | * | * | trans | -84.1 | 126.6 | 168.1 | 176.4 | 0 | 0 | 0 | 0 | 107.6 | T397 | T397-V399 PolarHBondContact O-N 3.41Š| ||
| 400 | F | 27.6 | Very low | 29.9 | Very low | 192 Ų | 192 | 137.5 Ų | 137.5 | 84% | 0.842 | 78% | 0.781 | S | S | * | * | trans | -81.8 | 134.2 | 171.8 | -114.5 | -93.6 | 0 | 0 | 0 | 109.2 | ||||
| 401 | D | 28.9 | Very low | 29.7 | Very low | 154 Ų | 154 | 136 Ų | 136 | 82% | 0.824 | 78% | 0.776 | S | S | * | * | trans | -140.3 | 136.4 | 156.8 | -124.9 | -29.6 | 0 | 0 | 0 | 108.8 | ||||
| 402 | P | 39 | Very low | 29.6 | Very low | 102 Ų | 102 | 141.6 Ų | 141.6 | 66% | 0.662 | 78% | 0.781 | S | S | * | * | trans | -100.2 | 135.4 | -176.2 | 35.7 | -25.8 | 0 | 0 | 0 | 111.3 | ||||
| 403 | N | 29 | Very low | 29.4 | Very low | 138 Ų | 138 | 139.8 Ų | 139.8 | 74% | 0.738 | 78% | 0.779 | S | S | * | * | 172.8 | 147.6 | 120.9 | -117.8 | 17.7 | 0 | 0 | 0 | 114.2 | |||||
| 404 | D | 29.9 | Very low | 29.3 | Very low | 147 Ų | 147 | 140.8 Ų | 140.8 | 79% | 0.786 | 78% | 0.778 | S | S | * | * | trans | 71.3 | 121.4 | 144.8 | -65.6 | -30.6 | 0 | 0 | 0 | 122.3 | ||||
| 405 | G | 28.3 | Very low | 29.2 | Very low | 79 Ų | 79 | 144.5 Ų | 144.5 | 81% | 0.814 | 79% | 0.785 | S | S | * | * | trans | 127.6 | 71 | 136.9 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 406 | D | 27 | Very low | 29 | Very low | 156 Ų | 156 | 144 Ų | 144 | 83% | 0.834 | 79% | 0.789 | S | S | * | * | trans | -67.1 | 164 | 149.3 | -114.3 | -20.2 | 0 | 0 | 0 | 109.4 | ||||
| 407 | P | 41.5 | Very low | 29.1 | Very low | 117 Ų | 117 | 143.8 Ų | 143.8 | 76% | 0.76 | 79% | 0.787 | S | S | * | * | cis | -147.1 | 175.1 | 29.4 | 38.3 | -16.1 | 0 | 0 | 0 | 118.2 | ||||
| 408 | A | 28.4 | Very low | 29.3 | Very low | 79 Ų | 79 | 143.9 Ų | 143.9 | 65% | 0.653 | 79% | 0.79 | S | S | * | * | trans | 108.7 | 109.5 | 132.1 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 409 | K | 28.3 | Very low | 29.2 | Very low | 196 Ų | 196 | 149.6 Ų | 149.6 | 85% | 0.852 | 80% | 0.798 | S | S | * | * | 99.1 | 109.1 | 124.7 | -79 | 179.3 | -179.7 | 177.5 | 0 | 121.7 | |||||
| 410 | S | 26 | Very low | 29.3 | Very low | 112 Ų | 112 | 150.8 Ų | 150.8 | 78% | 0.783 | 80% | 0.8 | S | S | * | * | trans | 74.9 | 140.1 | 132.9 | 115.4 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 411 | S | 26.9 | Very low | 29.5 | Very low | 104 Ų | 104 | 148.1 Ų | 148.1 | 73% | 0.727 | 80% | 0.802 | S | S | * | * | cis | -171.7 | 159 | 13.7 | 38.5 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 412 | R | 28.9 | Very low | 29.6 | Very low | 225 Ų | 225 | 145.9 Ų | 145.9 | 85% | 0.849 | 80% | 0.798 | S | S | * | * | trans | 87.2 | 104 | 145.5 | -109.4 | 176 | -179 | 172.4 | -0.8 | 122.7 | ||||
| 413 | K | 28 | Very low | 29.1 | Very low | 181 Ų | 181 | 145.6 Ų | 145.6 | 79% | 0.787 | 81% | 0.805 | S | S | * | * | 60.9 | 105.7 | 124 | -78.2 | -174.6 | 174.2 | -177.7 | 0 | 121.4 | |||||
| 414 | K | 26.7 | Very low | 29.1 | Very low | 211 Ų | 211 | 147.7 Ų | 147.7 | 92% | 0.917 | 82% | 0.816 | S | S | * | * | 36.4 | 115.2 | 119.1 | -69.8 | -174.3 | 176.8 | -177 | 0 | 119 | |||||
| 415 | R | 25.6 | Very low | 29 | Very low | 239 Ų | 239 | 144.1 Ų | 144.1 | 90% | 0.902 | 81% | 0.814 | S | S | * | * | -150.9 | 116.6 | 127.1 | -155.1 | 173.7 | -169.7 | -161.5 | 2.4 | 110.3 | |||||
| 416 | A | 26.2 | Very low | 28.8 | Very low | 102 Ų | 102 | 147 Ų | 147 | 84% | 0.843 | 82% | 0.82 | S | S | * | * | trans | -99 | 137.7 | 168.5 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 417 | V | 30.1 | Very low | 28.9 | Very low | 119 Ų | 119 | 145.3 Ų | 145.3 | 72% | 0.721 | 82% | 0.82 | S | S | * | * | trans | -132.9 | 129.9 | 160.6 | 174.9 | 0 | 0 | 0 | 0 | 105.2 | ||||
| 418 | P | 30.9 | Very low | 28.6 | Very low | 124 Ų | 124 | 150.2 Ų | 150.2 | 81% | 0.805 | 82% | 0.824 | S | S | * | * | trans | -79.3 | 137.1 | -178.6 | 31.8 | -30.1 | 0 | 0 | 0 | 110 | ||||
| 419 | R | 27.9 | Very low | 28.7 | Very low | 241 Ų | 241 | 156.6 Ų | 156.6 | 91% | 0.909 | 84% | 0.837 | S | S | * | * | trans | -119.3 | 123.1 | 163.1 | -88.5 | -176.1 | 174.4 | 166.1 | -1.6 | 108.2 | ||||
| 420 | D | 30.3 | Very low | 28.9 | Very low | 149 Ų | 149 | 153.7 Ų | 153.7 | 80% | 0.797 | 83% | 0.831 | S | S | * | * | trans | -50.8 | 148.1 | 169.6 | -68.8 | -53.3 | 0 | 0 | 0 | 112.7 | ||||
| 421 | P | 32.4 | Very low | 29.1 | Very low | 136 Ų | 136 | 154.1 Ų | 154.1 | 88% | 0.883 | 83% | 0.834 | S | S | * | * | trans | -110 | 90.4 | 150.8 | 32.8 | -19.2 | 0 | 0 | 0 | 108.6 | ||||
| 422 | S | 29.5 | Very low | 29.3 | Very low | 106 Ų | 106 | 159.2 Ų | 159.2 | 74% | 0.741 | 84% | 0.843 | S | S | * | * | trans | -127.3 | 141.8 | 155.8 | 63.2 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 423 | A | 29.3 | Very low | 29.2 | Very low | 97 Ų | 97 | 154 Ų | 154 | 80% | 0.802 | 84% | 0.841 | S | S | * | * | trans | 88.2 | 93.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 424 | N | 29.6 | Very low | 29.2 | Very low | 181 Ų | 181 | 150 Ų | 150 | 97% | 0.968 | 84% | 0.841 | S | S | * | * | -100.7 | 116.9 | 127.3 | -106.6 | -10.2 | 0 | 0 | 0 | 107 | |||||
| 425 | G | 26.6 | Very low | 29.1 | Very low | 72 Ų | 72 | 145.3 Ų | 145.3 | 74% | 0.742 | 84% | 0.835 | S | S | * | * | trans | -88.2 | 161.9 | -172.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 426 | C | 25.1 | Very low | 29.2 | Very low | 140 Ų | 140 | 140.7 Ų | 140.7 | 95% | 0.946 | 83% | 0.833 | S | S | * | * | trans | -136.7 | 106.9 | 138.8 | -152.5 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 427 | S | 29.4 | Very low | 29.3 | Very low | 120 Ų | 120 | 142.2 Ų | 142.2 | 84% | 0.839 | 83% | 0.832 | S | S | * | * | trans | -105.4 | 129.1 | 177.1 | -155.2 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 428 | R | 34.2 | Very low | 29.1 | Very low | 221 Ų | 221 | 141.5 Ų | 141.5 | 83% | 0.834 | 83% | 0.833 | S | S | * | * | trans | -66.1 | 148.9 | 166.5 | -97.3 | 176.7 | 164.9 | 165.2 | -5 | 110.5 | ||||
| 429 | K | 30.2 | Very low | 28.8 | Very low | 212 Ų | 212 | 139.8 Ų | 139.8 | 92% | 0.922 | 82% | 0.824 | S | S | * | * | trans | -152.8 | 131 | 139.8 | -106.5 | 178.4 | -173.7 | -177.4 | 0 | 111.4 | ||||
| 430 | D | 32.4 | Very low | 28.7 | Very low | 136 Ų | 136 | 138 Ų | 138 | 73% | 0.727 | 82% | 0.823 | S | S | * | * | trans | -82.7 | 160.8 | 178.5 | -65.1 | -60 | 0 | 0 | 0 | 113.6 | ||||
| 431 | S | 30.3 | Very low | 28.5 | Very low | 121 Ų | 121 | 138.4 Ų | 138.4 | 85% | 0.846 | 82% | 0.824 | S | S | * | * | trans | -167.5 | 103.3 | 138.5 | -60 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 432 | K | 31.1 | Very low | 28.4 | Very low | 211 Ų | 211 | 137 Ų | 137 | 92% | 0.917 | 82% | 0.817 | S | S | * | * | 65.8 | 110.8 | 88 | -88.9 | -171.1 | 178 | 179.6 | 0 | 118.2 | |||||
| 433 | S | 26.7 | Very low | 28.3 | Very low | 115 Ų | 115 | 137.3 Ų | 137.3 | 80% | 0.804 | 82% | 0.819 | S | S | * | * | -154.7 | 106.5 | 128 | 72.9 | 0 | 0 | 0 | 0 | 108.8 | |||||
| 434 | A | 27.9 | Very low | 28.7 | Very low | 96 Ų | 96 | 137.3 Ų | 137.3 | 79% | 0.793 | 81% | 0.811 | S | S | * | * | 79.2 | 104.7 | 103.5 | 0 | 0 | 0 | 0 | 0 | 115.7 | |||||
| 435 | S | 25.5 | Very low | 28.5 | Very low | 113 Ų | 113 | 139.4 Ų | 139.4 | 79% | 0.79 | 81% | 0.807 | S | S | * | * | trans | -171.9 | 106.7 | 130.2 | 31 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 436 | T | 27.4 | Very low | 28.8 | Very low | 142 Ų | 142 | 141.9 Ų | 141.9 | 87% | 0.871 | 81% | 0.808 | S | S | * | * | trans | 54.3 | 117.8 | 132.5 | -20.5 | 0 | 0 | 0 | 0 | 122 | ||||
| 437 | T | 28.5 | Very low | 28.9 | Very low | 134 Ų | 134 | 140.5 Ų | 140.5 | 82% | 0.822 | 80% | 0.8 | S | S | * | * | trans | -60.9 | 149.1 | 170.1 | -26.1 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 438 | S | 25.9 | Very low | 29.1 | Very low | 104 Ų | 104 | 140.6 Ų | 140.6 | 73% | 0.727 | 80% | 0.795 | S | S | * | * | trans | 168.3 | 91.3 | 137.6 | 165.4 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 439 | S | 25.5 | Very low | 28.9 | Very low | 89 Ų | 89 | 136.7 Ų | 136.7 | 62% | 0.622 | 79% | 0.791 | S | S | * | * | 65.5 | 110.9 | 91.2 | 56.9 | 0 | 0 | 0 | 0 | 117.3 | |||||
| 440 | F | 25.3 | Very low | 29 | Very low | 203 Ų | 203 | 134.1 Ų | 134.1 | 89% | 0.89 | 78% | 0.782 | S | S | * | * | 91.3 | 139.9 | 128.5 | -86.6 | -101.4 | 0 | 0 | 0 | 122.3 | |||||
| 441 | I | 26.6 | Very low | 28.9 | Very low | 157 Ų | 157 | 137 Ų | 137 | 81% | 0.805 | 78% | 0.784 | S | S | * | * | trans | 104.8 | 116.7 | 150.3 | -42.3 | -159.9 | 0 | 0 | 0 | 118.9 | ||||
| 442 | S | 29.7 | Very low | 29 | Very low | 108 Ų | 108 | 140.7 Ų | 140.7 | 76% | 0.755 | 81% | 0.81 | S | S | * | * | trans | -60.7 | 146.6 | 167.8 | -165.4 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 443 | S | 26.6 | Very low | 28.9 | Very low | 111 Ų | 111 | 137.2 Ų | 137.2 | 78% | 0.776 | 80% | 0.804 | S | S | * | * | trans | -155.5 | 125.1 | 153.7 | -162.1 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 444 | P | 37.8 | Very low | 29 | Very low | 97 Ų | 97 | 138.3 Ų | 138.3 | 63% | 0.63 | 80% | 0.804 | S | S | * | * | trans | -92.5 | 141.1 | 149.1 | 34.2 | -24.4 | 0 | 0 | 0 | 108.9 | ||||
| 445 | Y | 26.8 | Very low | 29.1 | Very low | 225 Ų | 225 | 140.7 Ų | 140.7 | 88% | 0.882 | 81% | 0.805 | S | S | * | * | trans | -178.9 | 139 | 142.4 | -106.1 | -75.6 | 0 | 0 | 0 | 111.9 | ||||
| 446 | T | 32.7 | Very low | 29.3 | Very low | 124 Ų | 124 | 142.3 Ų | 142.3 | 76% | 0.761 | 81% | 0.806 | S | S | * | * | trans | -80.8 | 142 | 169.7 | 39.2 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 447 | S | 27.3 | Very low | 29.4 | Very low | 111 Ų | 111 | 142.3 Ų | 142.3 | 78% | 0.776 | 80% | 0.802 | S | S | * | * | trans | -175.2 | 125.3 | 147.5 | 59.2 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 448 | V | 33.3 | Very low | 29.5 | Very low | 123 Ų | 123 | 142.9 Ų | 142.9 | 75% | 0.745 | 80% | 0.8 | S | S | * | * | 60.6 | 134.7 | 53.1 | -169.1 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 449 | D | 29.8 | Very low | 29.7 | Very low | 139 Ų | 139 | 145.6 Ų | 145.6 | 74% | 0.743 | 81% | 0.806 | S | S | * | * | trans | 93.1 | 112.8 | 179.4 | -54.8 | -30.3 | 0 | 0 | 0 | 115.3 | ||||
| 450 | E | 30.8 | Very low | 30 | Very low | 157 Ų | 157 | 150 Ų | 150 | 73% | 0.734 | 82% | 0.82 | S | S | * | * | cis | 80.2 | 132.4 | 45.5 | -143.2 | -177.4 | 162.9 | 0 | 0 | 113.8 | ||||
| 451 | Y | 31.6 | Very low | 30.4 | Very low | 197 Ų | 197 | 145.6 Ų | 145.6 | 77% | 0.773 | 81% | 0.814 | S | S | * | * | trans | 77.4 | 101 | 175 | -75.4 | -86.5 | 0 | 0 | 0 | 121.6 | ||||
| 452 | S | 32 | Very low | 30.8 | Very low | 198 Ų | 198 | 144.5 Ų | 144.5 | 100% | 1.385 | 82% | 0.815 | S | S | * | * | -169.2 | 0 | 100.8 | -74.5 | 0 | 0 | 0 | 0 | 111.5 |
Retrieved 452 of 452 residues in 581.5 ms
(Link to these results)