| 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 | 52.5 | Low | 72 | Confident | 222 Ų | 222 | 124.3 Ų | 124.3 | 100% | 1.094 | 66% | 0.657 | S | S | * | * | 0 | 91.7 | 0 | -75.1 | 176 | -170.8 | 0 | 0 | 106.4 | |||||
| 2 | L | 54.2 | Low | 72.9 | Confident | 160 Ų | 160 | 129.4 Ų | 129.4 | 84% | 0.838 | 66% | 0.661 | S | S | * | * | trans | -94.3 | 94.1 | 160.8 | -80.1 | 157.2 | 0 | 0 | 0 | 103.5 | E4 | L2-E4 PolarHBondContact O-N 2.97Š| ||
| 3 | V | 67.7 | Low | 73.8 | Confident | 87 Ų | 87 | 128.9 Ų | 128.9 | 53% | 0.527 | 65% | 0.654 | S | S | . | * | trans | -78.5 | 105.9 | 172.3 | 179.3 | 0 | 0 | 0 | 0 | 104.7 | G5 Y6 | V3-G5 PolarHBondContact O-N 3.35Å; V3-Y6 HydrophobicContact CG1-CD2 4.06Å; V3-Y6 HydrophobicContact CG1-CE2 4.27Å | ||
| 4 | E | 60.5 | Low | 74.3 | Confident | 196 Ų | 196 | 127.7 Ų | 127.7 | 92% | 0.916 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.9 | 121.1 | 177.9 | -68.1 | -179.7 | 167.4 | 0 | 0 | 109.4 | L2 | L2-E4 PolarHBondContact O-N 2.97Š|
| 5 | G | 78.1 | Confident | 74.8 | Confident | 77 Ų | 77 | 122.8 Ų | 122.8 | 79% | 0.794 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 117.8 | -3.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 117.2 | V3 | V3-G5 PolarHBondContact O-N 3.35Š|
| 6 | Y | 73.8 | Confident | 75.3 | Confident | 134 Ų | 134 | 123.9 Ų | 123.9 | 53% | 0.525 | 63% | 0.626 | S | S | . | * | S | Bend | trans | -101.3 | 134.5 | 171.8 | -78 | -88.7 | 0 | 0 | 0 | 111.5 | V3 Q10 | V3-Y6 HydrophobicContact CG1-CD2 4.06Å; V3-Y6 HydrophobicContact CG1-CE2 4.27Å; Y6-Q10 HydrophobicContact CD1-CG 4.36Å |
| 7 | P | 82.2 | Confident | 75.7 | Confident | 75 Ų | 75 | 122.5 Ų | 122.5 | 49% | 0.487 | 62% | 0.62 | S | S | . | * | trans | -61.5 | 140.2 | 173.1 | 24.3 | -30.4 | 0 | 0 | 0 | 110.5 | E9 Q10 I11 | P7-E9 PolarHBondContact O-N 3.3Å; P7-E9 VanDerWaalsContact O-N 3.09Å; P7-Q10 HydrophobicContact CG-CB 4.04Å; P7-Q10 WeakPolarHBondContact O-CB 3.36Å; P7-Q10 PolarHBondContact O-N 3.34Å; P7-I11 PolarHBondContact O-N 2.84Å | ||
| 8 | D | 80.2 | Confident | 76.1 | Confident | 115 Ų | 115 | 120.6 Ų | 120.6 | 62% | 0.615 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -52.5 | -36.6 | -173.5 | -70.6 | -15.6 | 0 | 0 | 0 | 113.1 | Q10 I11 W12 | D8-Q10 VanDerWaalsContact C-N 3.29Å; D8-Q10 PolarHBondContact O-N 3.14Å; D8-I11 PolarHBondContact O-N 2.85Å; D8-W12 PolarHBondContact O-N 3.44Å; D8-W12 VanDerWaalsContact O-N 3.1Å |
| 9 | E | 82.6 | Confident | 76.5 | Confident | 157 Ų | 157 | 118.6 Ų | 118.6 | 73% | 0.734 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -60.9 | -35.8 | 177.1 | -76.9 | 167.1 | 161.7 | 0 | 0 | 112.8 | P7 W12 Q13 | P7-E9 PolarHBondContact O-N 3.3Å; P7-E9 VanDerWaalsContact O-N 3.09Å; E9-W12 PolarHBondContact O-N 3.43Å; E9-Q13 WeakPolarHBondContact O-CB 3.49Å; E9-Q13 WeakPolarHBondContact O-CG 3.27Å; E9-Q13 PolarHBondContact O-N 3.16Å |
| 10 | Q | 81.2 | Confident | 76.8 | Confident | 94 Ų | 94 | 115.2 Ų | 115.2 | 44% | 0.439 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -75.6 | -30.6 | -179.9 | -162.4 | 166 | 0.9 | 0 | 0 | 111.7 | Y6 P7 D8 Q14 | Y6-Q10 HydrophobicContact CD1-CG 4.36Å; P7-Q10 HydrophobicContact CG-CB 4.04Å; P7-Q10 WeakPolarHBondContact O-CB 3.36Å; P7-Q10 PolarHBondContact O-N 3.34Å; D8-Q10 VanDerWaalsContact C-N 3.29Å; D8-Q10 PolarHBondContact O-N 3.14Å; Q10-Q14 WeakPolarHBondContact O-CB 3.47Å; Q10-Q14 PolarHBondContact O-N 2.88Å; Q10-Q14 VanDerWaalsContact O-N 3.07Å |
| 11 | I | 79.3 | Confident | 76.8 | Confident | 50 Ų | 50 | 115.8 Ų | 115.8 | 26% | 0.256 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -65.8 | -46.3 | 172.3 | -61.6 | 173.3 | 0 | 0 | 0 | 109.7 | P7 D8 Q14 V15 | P7-I11 PolarHBondContact O-N 2.84Å; D8-I11 PolarHBondContact O-N 2.85Å; I11-Q14 PolarHBondContact O-N 3.11Å; I11-V15 WeakPolarHBondContact O-CB 3.29Å; I11-V15 VanDerWaalsContact O-CG2 3.26Å; I11-V15 WeakPolarHBondContact O-CG2 3.38Å; I11-V15 PolarHBondContact O-N 3.38Å |
| 12 | W | 82.7 | Confident | 78.2 | Confident | 186 Ų | 186 | 109.7 Ų | 109.7 | 71% | 0.705 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -66.6 | -41.2 | 179.1 | -74 | 112.6 | 0 | 0 | 0 | 112.7 | D8 E9 Q14 V15 E16 | D8-W12 PolarHBondContact O-N 3.44Å; D8-W12 VanDerWaalsContact O-N 3.1Å; E9-W12 PolarHBondContact O-N 3.43Å; W12-Q14 VanDerWaalsContact C-N 3.35Å; W12-Q14 PolarHBondContact O-N 3.33Å; W12-V15 PolarHBondContact O-N 2.99Å; W12-E16 WeakPolarHBondContact O-CB 3.41Å; W12-E16 PolarHBondContact O-N 3.23Å |
| 13 | Q | 84.2 | Confident | 79.3 | Confident | 123 Ų | 123 | 107.2 Ų | 107.2 | 58% | 0.575 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -60.5 | -42.5 | 174.1 | -77.5 | 178 | -2.5 | 0 | 0 | 112.3 | E9 E16 L17 | E9-Q13 WeakPolarHBondContact O-CB 3.49Å; E9-Q13 WeakPolarHBondContact O-CG 3.27Å; E9-Q13 PolarHBondContact O-N 3.16Å; Q13-E16 PolarHBondContact O-N 2.96Å; Q13-L17 WeakPolarHBondContact O-CB 3.38Å; Q13-L17 PolarHBondContact O-N 2.8Å |
| 14 | Q | 80.6 | Confident | 79.9 | Confident | 112 Ų | 112 | 108.7 Ų | 108.7 | 52% | 0.523 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -66.7 | -39.6 | 177.9 | -165.6 | 70.2 | 14 | 0 | 0 | 111.7 | Q10 I11 W12 L17 L18 | Q10-Q14 WeakPolarHBondContact O-CB 3.47Å; Q10-Q14 PolarHBondContact O-N 2.88Å; Q10-Q14 VanDerWaalsContact O-N 3.07Å; I11-Q14 PolarHBondContact O-N 3.11Å; W12-Q14 VanDerWaalsContact C-N 3.35Å; W12-Q14 PolarHBondContact O-N 3.33Å; Q14-L17 PolarHBondContact O-N 2.89Å; Q14-L18 HydrophobicContact CG-CD1 4.28Å; Q14-L18 WeakPolarHBondContact O-CB 3.46Å; Q14-L18 VanDerWaalsContact O-CG 3.27Å; Q14-L18 WeakPolarHBondContact O-CG 3.16Å; Q14-L18 PolarHBondContact O-N 2.81Å |
| 15 | V | 81.8 | Confident | 80.8 | Confident | 54 Ų | 54 | 101.6 Ų | 101.6 | 33% | 0.327 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65.4 | -40.4 | 175.1 | 169.8 | 0 | 0 | 0 | 0 | 110.9 | I11 W12 L18 N19 | I11-V15 WeakPolarHBondContact O-CB 3.29Å; I11-V15 VanDerWaalsContact O-CG2 3.26Å; I11-V15 WeakPolarHBondContact O-CG2 3.38Å; I11-V15 PolarHBondContact O-N 3.38Å; W12-V15 PolarHBondContact O-N 2.99Å; V15-L18 PolarHBondContact O-N 3.43Å; V15-N19 WeakPolarHBondContact CG1-ND2 3.18Å; V15-N19 WeakPolarHBondContact O-CB 3.3Å; V15-N19 PolarHBondContact O-N 2.97Å; V15-N19 PolarHBondContact O-ND2 3.07Å |
| 16 | E | 83.7 | Confident | 81 | Confident | 140 Ų | 140 | 105.5 Ų | 105.5 | 65% | 0.654 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.1 | -44.3 | 176.3 | -170.9 | 170 | -162.5 | 0 | 0 | 111.7 | W12 Q13 N19 S20 | W12-E16 WeakPolarHBondContact O-CB 3.41Å; W12-E16 PolarHBondContact O-N 3.23Å; Q13-E16 PolarHBondContact O-N 2.96Å; E16-N19 PolarHBondContact O-N 3.32Å; E16-S20 WeakPolarHBondContact O-CB 3.24Å; E16-S20 PolarHBondContact O-N 3.14Å |
| 17 | L | 81.8 | Confident | 81.4 | Confident | 100 Ų | 100 | 103.9 Ų | 103.9 | 52% | 0.524 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.1 | -49 | 173.8 | -93.1 | 158.6 | 0 | 0 | 0 | 112.2 | Q13 Q14 N19 S20 Q21 | Q13-L17 WeakPolarHBondContact O-CB 3.38Å; Q13-L17 PolarHBondContact O-N 2.8Å; Q14-L17 PolarHBondContact O-N 2.89Å; L17-N19 VanDerWaalsContact C-N 3.34Å; L17-N19 PolarHBondContact O-N 3.48Å; L17-S20 PolarHBondContact O-N 2.85Å; L17-S20 PolarHBondContact O-OG 2.91Å; L17-Q21 PolarHBondContact O-N 2.87Å |
| 18 | L | 82.3 | Confident | 81.2 | Confident | 89 Ų | 89 | 108.2 Ų | 108.2 | 47% | 0.466 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65.7 | -37.4 | 178.2 | -71.8 | 170.2 | 0 | 0 | 0 | 112.1 | Q14 V15 N22 | Q14-L18 HydrophobicContact CG-CD1 4.28Å; Q14-L18 WeakPolarHBondContact O-CB 3.46Å; Q14-L18 VanDerWaalsContact O-CG 3.27Å; Q14-L18 WeakPolarHBondContact O-CG 3.16Å; Q14-L18 PolarHBondContact O-N 2.81Å; V15-L18 PolarHBondContact O-N 3.43Å; L18-N22 PolarHBondContact O-N 3.39Å; L18-N22 PolarHBondContact O-ND2 3.26Å |
| 19 | N | 84 | Confident | 81.2 | Confident | 83 Ų | 83 | 107.3 Ų | 107.3 | 44% | 0.444 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -72.8 | -33.5 | 177.7 | -75.8 | -18.1 | 0 | 0 | 0 | 112.2 | V15 E16 L17 Q21 N22 L23 | V15-N19 WeakPolarHBondContact CG1-ND2 3.18Å; V15-N19 WeakPolarHBondContact O-CB 3.3Å; V15-N19 PolarHBondContact O-N 2.97Å; V15-N19 PolarHBondContact O-ND2 3.07Å; E16-N19 PolarHBondContact O-N 3.32Å; L17-N19 VanDerWaalsContact C-N 3.34Å; L17-N19 PolarHBondContact O-N 3.48Å; N19-Q21 PolarHBondContact O-N 3.15Å; N19-N22 CarbonylContact O-C 3.59Å; N19-N22 PolarHBondContact O-N 2.88Å; N19-L23 VanDerWaalsContact O-CB 3.3Å; N19-L23 WeakPolarHBondContact O-CB 3.24Å; N19-L23 PolarHBondContact O-N 2.93Å |
| 20 | S | 81.9 | Confident | 81.1 | Confident | 49 Ų | 49 | 104.6 Ų | 104.6 | 34% | 0.343 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.7 | -43.4 | 178.4 | 73.8 | 0 | 0 | 0 | 0 | 112.1 | E16 L17 L23 Q24 | E16-S20 WeakPolarHBondContact O-CB 3.24Å; E16-S20 PolarHBondContact O-N 3.14Å; L17-S20 PolarHBondContact O-N 2.85Å; L17-S20 PolarHBondContact O-OG 2.91Å; S20-L23 PolarHBondContact O-N 3.37Å; S20-Q24 WeakPolarHBondContact O-CG 3.32Å; S20-Q24 PolarHBondContact O-N 2.98Å; S20-Q24 VanDerWaalsContact O-N 3.08Å |
| 21 | Q | 78.3 | Confident | 80.9 | Confident | 129 Ų | 129 | 106.1 Ų | 106.1 | 60% | 0.603 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -66.6 | -42 | 177.1 | -65.2 | -178.3 | 0.9 | 0 | 0 | 111.5 | L17 N19 L23 Q24 S25 | L17-Q21 PolarHBondContact O-N 2.87Å; N19-Q21 PolarHBondContact O-N 3.15Å; Q21-L23 VanDerWaalsContact C-N 3.35Å; Q21-Q24 PolarHBondContact O-N 3.19Å; Q21-S25 PolarHBondContact O-N 3.43Å |
| 22 | N | 82 | Confident | 80.9 | Confident | 94 Ų | 94 | 107.8 Ų | 107.8 | 50% | 0.503 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -69.4 | -30.9 | 176.1 | -73.5 | -39 | 0 | 0 | 0 | 112.8 | L18 N19 S25 R26 | L18-N22 PolarHBondContact O-N 3.39Å; L18-N22 PolarHBondContact O-ND2 3.26Å; N19-N22 CarbonylContact O-C 3.59Å; N19-N22 PolarHBondContact O-N 2.88Å; N22-S25 WeakPolarHBondContact CA-OG 3.41Å; N22-S25 PolarHBondContact O-OG 3.07Å; N22-R26 WeakPolarHBondContact O-CB 3.45Å; N22-R26 WeakPolarHBondContact O-CG 3.31Å; N22-R26 PolarHBondContact O-N 3.35Å |
| 23 | L | 76.8 | Confident | 80.5 | Confident | 107 Ų | 107 | 101.2 Ų | 101.2 | 56% | 0.56 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -68 | -43.1 | 174.8 | -109.2 | 140.7 | 0 | 0 | 0 | 111 | N19 S20 Q21 S25 R26 L27 | N19-L23 VanDerWaalsContact O-CB 3.3Å; N19-L23 WeakPolarHBondContact O-CB 3.24Å; N19-L23 PolarHBondContact O-N 2.93Å; S20-L23 PolarHBondContact O-N 3.37Å; Q21-L23 VanDerWaalsContact C-N 3.35Å; L23-S25 PolarHBondContact O-N 2.75Å; L23-R26 PolarHBondContact O-N 2.87Å; L23-L27 WeakPolarHBondContact O-CB 3.3Å; L23-L27 WeakPolarHBondContact O-CG 3.4Å; L23-L27 PolarHBondContact O-N 3.36Å |
| 24 | Q | 79.5 | Confident | 79.9 | Confident | 118 Ų | 118 | 97.3 Ų | 97.3 | 55% | 0.551 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -63.3 | -40.8 | 176.8 | -71.9 | -177.5 | 4.9 | 0 | 0 | 112.3 | S20 Q21 L27 R28 | S20-Q24 WeakPolarHBondContact O-CG 3.32Å; S20-Q24 PolarHBondContact O-N 2.98Å; S20-Q24 VanDerWaalsContact O-N 3.08Å; Q21-Q24 PolarHBondContact O-N 3.19Å; Q24-L27 PolarHBondContact O-N 2.77Å; Q24-R28 PolarHBondContact O-N 3.36Å |
| 25 | S | 80.1 | Confident | 79.3 | Confident | 48 Ų | 48 | 96.5 Ų | 96.5 | 34% | 0.336 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -66.4 | -41.6 | 175.9 | 60.9 | 0 | 0 | 0 | 0 | 111.9 | Q21 N22 L23 R28 E29 | Q21-S25 PolarHBondContact O-N 3.43Å; N22-S25 WeakPolarHBondContact CA-OG 3.41Å; N22-S25 PolarHBondContact O-OG 3.07Å; L23-S25 PolarHBondContact O-N 2.75Å; S25-R28 PolarHBondContact O-N 3.49Å; S25-E29 PolarHBondContact O-N 2.65Å; S25-E29 VanDerWaalsContact O-N 3.09Å |
| 26 | R | 81 | Confident | 78.5 | Confident | 159 Ų | 159 | 99.5 Ų | 99.5 | 60% | 0.6 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -66.2 | -35.9 | 176.3 | -69.4 | -71.9 | 174.6 | -174.8 | 0.1 | 113.3 | N22 L23 E29 V30 | N22-R26 WeakPolarHBondContact O-CB 3.45Å; N22-R26 WeakPolarHBondContact O-CG 3.31Å; N22-R26 PolarHBondContact O-N 3.35Å; L23-R26 PolarHBondContact O-N 2.87Å; R26-E29 WeakPolarHBondContact CD-OE2 3.47Å; R26-E29 IonicContact CZ-OE2 2.81Å; R26-E29 IonicContact NE-OE2 2.82Å; R26-E29 IonicContact NH1-OE2 2.73Å; R26-E29 PolarHBondContact NH1-OE2 3.17Å; R26-E29 PolarHBondContact O-N 2.82Å; R26-V30 WeakPolarHBondContact O-CG2 3.33Å; R26-V30 PolarHBondContact O-N 2.83Å |
| 27 | L | 82.6 | Confident | 77.3 | Confident | 100 Ų | 100 | 99 Ų | 99 | 52% | 0.524 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.6 | -42.7 | 174.4 | -77.9 | 168.8 | 0 | 0 | 0 | 111.5 | L23 Q24 E29 V30 E31 | L23-L27 WeakPolarHBondContact O-CB 3.3Å; L23-L27 WeakPolarHBondContact O-CG 3.4Å; L23-L27 PolarHBondContact O-N 3.36Å; Q24-L27 PolarHBondContact O-N 2.77Å; L27-E29 PolarHBondContact O-N 3.5Å; L27-V30 PolarHBondContact O-N 3.47Å; L27-V30 VanDerWaalsContact O-N 3.16Å; L27-E31 WeakPolarHBondContact O-CG 3.11Å; L27-E31 PolarHBondContact O-N 2.97Å |
| 28 | R | 77.8 | Confident | 76.1 | Confident | 166 Ų | 166 | 98.7 Ų | 98.7 | 63% | 0.626 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63.2 | -38.9 | 174 | -67.9 | -175.6 | -156.5 | 159.2 | 6.2 | 112.7 | Q24 S25 V30 E31 T32 | Q24-R28 PolarHBondContact O-N 3.36Å; S25-R28 PolarHBondContact O-N 3.49Å; R28-V30 VanDerWaalsContact C-N 3.29Å; R28-V30 PolarHBondContact O-N 3.38Å; R28-E31 PolarHBondContact O-N 3.43Å; R28-T32 WeakPolarHBondContact O-CB 3.37Å; R28-T32 WeakPolarHBondContact O-CG2 3.43Å; R28-T32 PolarHBondContact O-N 3.44Å; R28-T32 PolarHBondContact O-OG1 2.84Å |
| 29 | E | 81.6 | Confident | 74.4 | Confident | 96 Ų | 96 | 102.2 Ų | 102.2 | 45% | 0.449 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -60.8 | -38.5 | 173.5 | -73 | 176.9 | -174.4 | 0 | 0 | 111.7 | S25 R26 L27 T32 A33 | S25-E29 PolarHBondContact O-N 2.65Å; S25-E29 VanDerWaalsContact O-N 3.09Å; R26-E29 WeakPolarHBondContact CD-OE2 3.47Å; R26-E29 IonicContact CZ-OE2 2.81Å; R26-E29 IonicContact NE-OE2 2.82Å; R26-E29 IonicContact NH1-OE2 2.73Å; R26-E29 PolarHBondContact NH1-OE2 3.17Å; R26-E29 PolarHBondContact O-N 2.82Å; L27-E29 PolarHBondContact O-N 3.5Å; E29-T32 WeakPolarHBondContact CA-OG1 3.49Å; E29-T32 PolarHBondContact O-OG1 3.28Å; E29-A33 WeakPolarHBondContact O-CB 3.35Å; E29-A33 PolarHBondContact O-N 3.47Å; E29-A33 VanDerWaalsContact O-N 3.08Å |
| 30 | V | 80.1 | Confident | 72.9 | Confident | 99 Ų | 99 | 103.2 Ų | 103.2 | 60% | 0.6 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -71.7 | -41.2 | 177.4 | 172.9 | 0 | 0 | 0 | 0 | 111.7 | R26 L27 R28 A33 A34 | R26-V30 WeakPolarHBondContact O-CG2 3.33Å; R26-V30 PolarHBondContact O-N 2.83Å; L27-V30 PolarHBondContact O-N 3.47Å; L27-V30 VanDerWaalsContact O-N 3.16Å; R28-V30 VanDerWaalsContact C-N 3.29Å; R28-V30 PolarHBondContact O-N 3.38Å; V30-A33 PolarHBondContact O-N 3.43Å; V30-A34 WeakPolarHBondContact O-CB 3.35Å; V30-A34 PolarHBondContact O-N 2.89Å |
| 31 | E | 77 | Confident | 71.3 | Confident | 127 Ų | 127 | 109.6 Ų | 109.6 | 59% | 0.593 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -62 | -46.6 | 175.9 | -75.4 | 175.7 | 171.5 | 0 | 0 | 111.7 | L27 R28 A33 A34 V35 | L27-E31 WeakPolarHBondContact O-CG 3.11Å; L27-E31 PolarHBondContact O-N 2.97Å; R28-E31 PolarHBondContact O-N 3.43Å; E31-A33 VanDerWaalsContact C-N 3.35Å; E31-A33 PolarHBondContact O-N 3.08Å; E31-A34 PolarHBondContact O-N 3.09Å; E31-V35 WeakPolarHBondContact O-CG2 3.44Å; E31-V35 PolarHBondContact O-N 3.08Å |
| 32 | T | 78.2 | Confident | 69.7 | Low | 85 Ų | 85 | 113 Ų | 113 | 52% | 0.521 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -63.6 | -39.3 | 177.1 | 51 | 0 | 0 | 0 | 0 | 112.1 | R28 E29 V35 N36 | R28-T32 WeakPolarHBondContact O-CB 3.37Å; R28-T32 WeakPolarHBondContact O-CG2 3.43Å; R28-T32 PolarHBondContact O-N 3.44Å; R28-T32 PolarHBondContact O-OG1 2.84Å; E29-T32 WeakPolarHBondContact CA-OG1 3.49Å; E29-T32 PolarHBondContact O-OG1 3.28Å; T32-V35 PolarHBondContact O-N 3.12Å; T32-N36 PolarHBondContact O-N 3.03Å; T32-N36 VanDerWaalsContact O-N 3.16Å; T32-N36 PolarHBondContact O-ND2 2.96Å |
| 33 | A | 74.8 | Confident | 67.8 | Low | 47 Ų | 47 | 114.8 Ų | 114.8 | 39% | 0.388 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -65.6 | -36.9 | 173 | 0 | 0 | 0 | 0 | 0 | 112.8 | E29 V30 E31 N36 L37 | E29-A33 WeakPolarHBondContact O-CB 3.35Å; E29-A33 PolarHBondContact O-N 3.47Å; E29-A33 VanDerWaalsContact O-N 3.08Å; V30-A33 PolarHBondContact O-N 3.43Å; E31-A33 VanDerWaalsContact C-N 3.35Å; E31-A33 PolarHBondContact O-N 3.08Å; A33-N36 PolarHBondContact O-N 3.04Å; A33-L37 WeakPolarHBondContact O-CG 3.47Å; A33-L37 PolarHBondContact O-N 3.36Å; A33-L37 VanDerWaalsContact O-N 3.08Å |
| 34 | A | 72 | Confident | 66.2 | Low | 41 Ų | 41 | 117.8 Ų | 117.8 | 34% | 0.339 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -69.1 | -37.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | V30 E31 L37 N38 | V30-A34 WeakPolarHBondContact O-CB 3.35Å; V30-A34 PolarHBondContact O-N 2.89Å; E31-A34 PolarHBondContact O-N 3.09Å; A34-L37 PolarHBondContact O-N 2.89Å; A34-N38 WeakPolarHBondContact O-CB 3.12Å; A34-N38 VanDerWaalsContact O-CG 3.32Å; A34-N38 PolarHBondContact O-N 2.93Å; A34-N38 PolarHBondContact O-ND2 3.02Å; A34-N38 VanDerWaalsContact O-ND2 3.16Å |
| 35 | V | 68.3 | Low | 64.2 | Low | 96 Ų | 96 | 118.7 Ų | 118.7 | 58% | 0.582 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -62.9 | -43.9 | 173.5 | 173.6 | 0 | 0 | 0 | 0 | 110.7 | E31 T32 L37 N38 F39 | E31-V35 WeakPolarHBondContact O-CG2 3.44Å; E31-V35 PolarHBondContact O-N 3.08Å; T32-V35 PolarHBondContact O-N 3.12Å; V35-L37 VanDerWaalsContact C-N 3.32Å; V35-L37 PolarHBondContact O-N 2.95Å; V35-N38 PolarHBondContact O-N 3.2Å; V35-F39 PolarHBondContact O-N 3.4Å |
| 36 | N | 64.3 | Low | 62.1 | Low | 117 Ų | 117 | 122 Ų | 122 | 63% | 0.626 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -63.8 | -34.7 | 177.4 | -71 | -19.1 | 0 | 0 | 0 | 112.9 | T32 A33 | T32-N36 PolarHBondContact O-N 3.03Å; T32-N36 VanDerWaalsContact O-N 3.16Å; T32-N36 PolarHBondContact O-ND2 2.96Å; A33-N36 PolarHBondContact O-N 3.04Å |
| 37 | L | 58.1 | Low | 59.7 | Low | 129 Ų | 129 | 121 Ų | 121 | 68% | 0.675 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -73.4 | -31 | 175.5 | -74.6 | 166.2 | 0 | 0 | 0 | 113.1 | A33 A34 V35 | A33-L37 WeakPolarHBondContact O-CG 3.47Å; A33-L37 PolarHBondContact O-N 3.36Å; A33-L37 VanDerWaalsContact O-N 3.08Å; A34-L37 PolarHBondContact O-N 2.89Å; V35-L37 VanDerWaalsContact C-N 3.32Å; V35-L37 PolarHBondContact O-N 2.95Å |
| 38 | N | 57.7 | Low | 57.7 | Low | 93 Ų | 93 | 119.4 Ų | 119.4 | 50% | 0.497 | 65% | 0.651 | S | S | . | * | H | α-helix | trans | -83.7 | -23 | 179.5 | -72.7 | -32.4 | 0 | 0 | 0 | 113.3 | A34 V35 | A34-N38 WeakPolarHBondContact O-CB 3.12Å; A34-N38 VanDerWaalsContact O-CG 3.32Å; A34-N38 PolarHBondContact O-N 2.93Å; A34-N38 PolarHBondContact O-ND2 3.02Å; A34-N38 VanDerWaalsContact O-ND2 3.16Å; V35-N38 PolarHBondContact O-N 3.2Å |
| 39 | F | 45.6 | Very low | 55.8 | Low | 163 Ų | 163 | 120.6 Ų | 120.6 | 72% | 0.715 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -72.9 | -33.4 | 173.8 | -161.1 | -99.3 | 0 | 0 | 0 | 111.8 | V35 K41 | V35-F39 PolarHBondContact O-N 3.4Å; F39-K41 PolarHBondContact O-N 3.3Å |
| 40 | S | 52.4 | Low | 53.6 | Low | 105 Ų | 105 | 124 Ų | 124 | 73% | 0.734 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.4 | 2.2 | 179.4 | -166.6 | 0 | 0 | 0 | 0 | 115 | ||
| 41 | K | 49.5 | Very low | 51.8 | Low | 183 Ų | 183 | 124.9 Ų | 124.9 | 80% | 0.796 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.5 | 12.5 | -172.9 | -155.5 | 170.7 | -179.6 | 178.9 | 0 | 114.1 | F39 | F39-K41 PolarHBondContact O-N 3.3Š|
| 42 | R | 44.3 | Very low | 50.1 | Low | 199 Ų | 199 | 125.6 Ų | 125.6 | 75% | 0.751 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -109.1 | 1.4 | -177.2 | -76.9 | -169.2 | 174.7 | 117 | -4.6 | 115.7 | ||
| 43 | D | 42.9 | Very low | 48.4 | Very low | 133 Ų | 133 | 125.8 Ų | 125.8 | 71% | 0.711 | 70% | 0.703 | S | S | * | * | trans | -113.9 | 84.3 | 178.3 | -56 | -33.2 | 0 | 0 | 0 | 109.9 | ||||
| 44 | D | 43 | Very low | 46.7 | Very low | 169 Ų | 169 | 132 Ų | 132 | 90% | 0.904 | 73% | 0.725 | S | S | * | * | trans | -171.4 | 89.9 | 156.7 | -96.1 | -26.7 | 0 | 0 | 0 | 110.4 | ||||
| 45 | V | 36.6 | Very low | 45.2 | Very low | 138 Ų | 138 | 137.5 Ų | 137.5 | 84% | 0.836 | 75% | 0.747 | S | S | * | * | trans | -136.1 | 120.2 | 169.8 | 171 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 46 | C | 36.2 | Very low | 43.9 | Very low | 116 Ų | 116 | 137.9 Ų | 137.9 | 78% | 0.784 | 75% | 0.754 | S | S | * | * | trans | 158.9 | 110.1 | 155.6 | -93.7 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 47 | T | 31.3 | Very low | 42.7 | Very low | 139 Ų | 139 | 137.2 Ų | 137.2 | 85% | 0.853 | 77% | 0.765 | S | S | * | * | 67.2 | 124 | 80.4 | 60.6 | 0 | 0 | 0 | 0 | 116.3 | |||||
| 48 | G | 39.3 | Very low | 41.8 | Very low | 67 Ų | 67 | 136.1 Ų | 136.1 | 69% | 0.691 | 77% | 0.768 | S | S | * | * | trans | 131.2 | 103.6 | 168.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 49 | E | 38.3 | Very low | 41.2 | Very low | 191 Ų | 191 | 138 Ų | 138 | 89% | 0.893 | 78% | 0.778 | S | S | * | * | 62.5 | 143.1 | 86.3 | -72.7 | -179.6 | -178.1 | 0 | 0 | 114 | |||||
| 50 | E | 36.1 | Very low | 41.2 | Very low | 168 Ų | 168 | 138.3 Ų | 138.3 | 79% | 0.785 | 78% | 0.782 | S | S | * | * | cis | -167.1 | -178.3 | -22 | -118.4 | -173.2 | -171.5 | 0 | 0 | 105.1 | ||||
| 51 | T | 40.9 | Very low | 40.7 | Very low | 116 Ų | 116 | 140.7 Ų | 140.7 | 71% | 0.712 | 79% | 0.786 | S | S | * | * | trans | 85.6 | 135.6 | 165.9 | 100.5 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 52 | D | 41.8 | Very low | 40.3 | Very low | 143 Ų | 143 | 136.6 Ų | 136.6 | 77% | 0.765 | 79% | 0.786 | S | S | * | * | cis | -156 | 141.5 | 23 | -84.1 | -58.8 | 0 | 0 | 0 | 114 | ||||
| 53 | A | 42.5 | Very low | 40.2 | Very low | 89 Ų | 89 | 137 Ų | 137 | 74% | 0.736 | 79% | 0.794 | S | S | * | * | trans | 36.1 | 116.8 | 137.7 | 0 | 0 | 0 | 0 | 0 | 124.5 | ||||
| 54 | E | 39.6 | Very low | 40.1 | Very low | 178 Ų | 178 | 139.4 Ų | 139.4 | 83% | 0.832 | 80% | 0.798 | S | S | * | * | 37.5 | 129.2 | 123.8 | -53 | -164.1 | 165.8 | 0 | 0 | 122.9 | |||||
| 55 | L | 41.3 | Very low | 40 | Very low | 156 Ų | 156 | 139.1 Ų | 139.1 | 82% | 0.817 | 80% | 0.796 | S | S | * | * | -179.8 | 128.5 | 107.2 | -95.8 | 158 | 0 | 0 | 0 | 114.9 | |||||
| 56 | S | 39.3 | Very low | 40.1 | Very low | 103 Ų | 103 | 138 Ų | 138 | 72% | 0.72 | 79% | 0.79 | S | S | * | * | trans | 62.1 | 104.5 | 142 | 69.6 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 57 | A | 39.5 | Very low | 40.1 | Very low | 104 Ų | 104 | 140.8 Ų | 140.8 | 86% | 0.86 | 80% | 0.795 | S | S | * | * | 41.1 | 118.3 | 121.5 | 0 | 0 | 0 | 0 | 0 | 122 | |||||
| 58 | S | 40.6 | Very low | 40.4 | Very low | 105 Ų | 105 | 138.6 Ų | 138.6 | 73% | 0.734 | 79% | 0.791 | S | S | * | * | -175 | 126.5 | 103.2 | -129.8 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 59 | D | 43.4 | Very low | 40.3 | Very low | 134 Ų | 134 | 139.7 Ų | 139.7 | 72% | 0.717 | 79% | 0.794 | S | S | * | * | trans | 66.2 | 120.7 | 135.6 | -66 | -39 | 0 | 0 | 0 | 124.4 | ||||
| 60 | Q | 46.1 | Very low | 40.6 | Very low | 168 Ų | 168 | 135.4 Ų | 135.4 | 79% | 0.785 | 79% | 0.785 | S | S | * | * | trans | 108.6 | 126.7 | 136.6 | -73.2 | 171 | 29.1 | 0 | 0 | 119.7 | ||||
| 61 | D | 42.2 | Very low | 40.8 | Very low | 155 Ų | 155 | 132.8 Ų | 132.8 | 83% | 0.829 | 78% | 0.78 | S | S | * | * | trans | 90.9 | 65.1 | 160.6 | -56.5 | -19.9 | 0 | 0 | 0 | 119.9 | ||||
| 62 | A | 40.2 | Very low | 41 | Very low | 97 Ų | 97 | 133.2 Ų | 133.2 | 80% | 0.802 | 78% | 0.783 | S | S | * | * | trans | -98.8 | 100.7 | 154.4 | 0 | 0 | 0 | 0 | 0 | 111 | K64 | A62-K64 PolarHBondContact O-N 3.16Å; A62-K64 VanDerWaalsContact O-N 3.07Å | ||
| 63 | K | 42.7 | Very low | 41.4 | Very low | 209 Ų | 209 | 133.8 Ų | 133.8 | 91% | 0.909 | 79% | 0.785 | S | S | * | * | trans | -70.2 | 92 | 163 | -77.3 | 176.4 | 176.6 | 173.5 | 0 | 109.6 | ||||
| 64 | K | 41.9 | Very low | 41.9 | Very low | 183 Ų | 183 | 134.9 Ų | 134.9 | 80% | 0.796 | 79% | 0.788 | S | S | * | * | trans | -90.9 | 104 | 155.8 | -89.2 | 179.3 | 175 | 177.1 | 0 | 107.7 | A62 T66 | A62-K64 PolarHBondContact O-N 3.16Å; A62-K64 VanDerWaalsContact O-N 3.07Å; K64-T66 VanDerWaalsContact C-N 3.32Å; K64-T66 PolarHBondContact O-N 3.16Å; K64-T66 VanDerWaalsContact O-N 3.12Å | ||
| 65 | N | 39.5 | Very low | 42.4 | Very low | 163 Ų | 163 | 134.8 Ų | 134.8 | 87% | 0.872 | 79% | 0.787 | S | S | * | * | trans | -76.4 | 94.2 | 160.5 | -91.2 | 5.9 | 0 | 0 | 0 | 107.6 | ||||
| 66 | T | 40.2 | Very low | 42.8 | Very low | 114 Ų | 114 | 131.6 Ų | 131.6 | 70% | 0.699 | 78% | 0.778 | S | S | * | * | trans | -61.7 | 138.6 | 161.8 | 40.2 | 0 | 0 | 0 | 0 | 110.1 | K64 A68 | K64-T66 VanDerWaalsContact C-N 3.32Å; K64-T66 PolarHBondContact O-N 3.16Å; K64-T66 VanDerWaalsContact O-N 3.12Å; T66-A68 PolarHBondContact O-N 3.08Å; T66-A68 VanDerWaalsContact O-N 3.14Å | ||
| 67 | I | 35.9 | Very low | 43.8 | Very low | 174 Ų | 174 | 134.4 Ų | 134.4 | 89% | 0.892 | 78% | 0.783 | S | S | * | * | trans | -55.9 | 111 | 169.7 | -64.3 | 157.7 | 0 | 0 | 0 | 107.8 | ||||
| 68 | A | 36.5 | Very low | 44.5 | Very low | 94 Ų | 94 | 134.9 Ų | 134.9 | 78% | 0.777 | 78% | 0.775 | S | S | * | * | trans | -119.6 | 88.4 | 171 | 0 | 0 | 0 | 0 | 0 | 107.4 | T66 | T66-A68 PolarHBondContact O-N 3.08Å; T66-A68 VanDerWaalsContact O-N 3.14Å | ||
| 69 | A | 37.4 | Very low | 44.8 | Very low | 90 Ų | 90 | 135.3 Ų | 135.3 | 74% | 0.744 | 77% | 0.769 | S | S | * | * | trans | -96 | 82.5 | 158.8 | 0 | 0 | 0 | 0 | 0 | 106.5 | T71 | A69-T71 PolarHBondContact O-N 2.93Š| ||
| 70 | S | 44.6 | Very low | 45.4 | Very low | 100 Ų | 100 | 136.3 Ų | 136.3 | 70% | 0.699 | 78% | 0.775 | S | S | * | * | trans | -82.3 | 96.8 | 163.8 | 70.1 | 0 | 0 | 0 | 0 | 107.3 | T72 | S70-T72 VanDerWaalsContact C-N 3.29Å; S70-T72 PolarHBondContact O-N 3.48Å | ||
| 71 | T | 41.2 | Very low | 46 | Very low | 113 Ų | 113 | 136.3 Ų | 136.3 | 69% | 0.693 | 77% | 0.774 | S | S | * | * | trans | -69.7 | 93.7 | 162.9 | -52.3 | 0 | 0 | 0 | 0 | 107 | A69 L73 | A69-T71 PolarHBondContact O-N 2.93Å; T71-L73 HydrophobicContact CG2-CD2 4.26Å; T71-L73 HydrophobicContact CG2-CG 3.92Å; T71-L73 PolarHBondContact O-N 3.45Å | ||
| 72 | T | 45.1 | Very low | 46.8 | Very low | 125 Ų | 125 | 137.5 Ų | 137.5 | 77% | 0.767 | 77% | 0.773 | S | S | * | * | trans | -68.6 | 90.1 | 159.6 | 47.3 | 0 | 0 | 0 | 0 | 106.8 | S70 S74 | S70-T72 VanDerWaalsContact C-N 3.29Å; S70-T72 PolarHBondContact O-N 3.48Å; T72-S74 PolarHBondContact O-N 3.3Å; T72-S74 VanDerWaalsContact O-N 3.08Å | ||
| 73 | L | 50.5 | Low | 47.4 | Very low | 155 Ų | 155 | 141.3 Ų | 141.3 | 81% | 0.812 | 77% | 0.771 | S | S | * | * | trans | -64.3 | 103.1 | 163.6 | -77.2 | 163.1 | 0 | 0 | 0 | 106.8 | T71 H75 | T71-L73 HydrophobicContact CG2-CD2 4.26Å; T71-L73 HydrophobicContact CG2-CG 3.92Å; T71-L73 PolarHBondContact O-N 3.45Å; L73-H75 PolarHBondContact O-N 2.92Å | ||
| 74 | S | 51.5 | Low | 48.6 | Very low | 113 Ų | 113 | 135.6 Ų | 135.6 | 79% | 0.79 | 75% | 0.751 | S | S | * | * | trans | -59.5 | 123.9 | 166.7 | 48.3 | 0 | 0 | 0 | 0 | 108.8 | T72 S76 | T72-S74 PolarHBondContact O-N 3.3Å; T72-S74 VanDerWaalsContact O-N 3.08Å; S74-S76 PolarHBondContact O-N 3.19Å | ||
| 75 | H | 50.6 | Low | 49.7 | Very low | 175 Ų | 175 | 134.1 Ų | 134.1 | 81% | 0.81 | 75% | 0.745 | S | S | * | * | trans | -24.1 | 121.2 | 174.8 | -140.7 | -54.5 | 0 | 0 | 0 | 113.7 | L73 I77 | L73-H75 PolarHBondContact O-N 2.92Å; H75-I77 PolarHBondContact O-N 3.21Å | ||
| 76 | S | 51 | Low | 51.3 | Low | 90 Ų | 90 | 132.1 Ų | 132.1 | 63% | 0.629 | 73% | 0.73 | S | S | * | * | trans | -63.7 | 120.3 | 163.3 | 56.5 | 0 | 0 | 0 | 0 | 107.7 | S74 V78 | S74-S76 PolarHBondContact O-N 3.19Å; S76-V78 PolarHBondContact O-N 2.99Å | ||
| 77 | I | 58.5 | Low | 52.7 | Low | 161 Ų | 161 | 132.7 Ų | 132.7 | 83% | 0.826 | 73% | 0.725 | S | S | * | * | trans | -91.7 | 33.1 | -177.1 | -159.3 | 157.2 | 0 | 0 | 0 | 111.5 | H75 | H75-I77 PolarHBondContact O-N 3.21Š| ||
| 78 | V | 54.6 | Low | 54.3 | Low | 115 Ų | 115 | 129.4 Ų | 129.4 | 70% | 0.697 | 71% | 0.707 | S | S | * | * | trans | -107.1 | 103.8 | 175.4 | -84.9 | 0 | 0 | 0 | 0 | 107 | S76 D80 | S76-V78 PolarHBondContact O-N 2.99Å; V78-D80 PolarHBondContact O-N 2.83Å | ||
| 79 | D | 47.6 | Very low | 56.2 | Low | 113 Ų | 113 | 130.5 Ų | 130.5 | 60% | 0.604 | 70% | 0.696 | S | S | * | * | trans | -53.8 | 119.4 | -174.5 | -78.6 | -51.1 | 0 | 0 | 0 | 113.1 | Q81 | D79-Q81 HydrophobicContact CB-CB 4.18Å; D79-Q81 HydrophobicContact CB-CG 4.4Å; D79-Q81 PolarHBondContact O-N 3.21Å | ||
| 80 | D | 55.5 | Low | 58 | Low | 156 Ų | 156 | 132.3 Ų | 132.3 | 83% | 0.834 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.9 | 17.8 | 161.5 | -65.9 | -31.8 | 0 | 0 | 0 | 112.3 | V78 | V78-D80 PolarHBondContact O-N 2.83Š|
| 81 | Q | 59.8 | Low | 59.5 | Low | 167 Ų | 167 | 133.5 Ų | 133.5 | 78% | 0.78 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.4 | 3.8 | 177.1 | -59 | -166.5 | 0.2 | 0 | 0 | 113.2 | D79 | D79-Q81 HydrophobicContact CB-CB 4.18Å; D79-Q81 HydrophobicContact CB-CG 4.4Å; D79-Q81 PolarHBondContact O-N 3.21Å |
| 82 | F | 57.4 | Low | 61 | Low | 181 Ų | 181 | 130.8 Ų | 130.8 | 79% | 0.794 | 67% | 0.671 | S | S | * | * | S | Bend | trans | -101.9 | 3.9 | -175.5 | -127.3 | -91.1 | 0 | 0 | 0 | 115.1 | ||
| 83 | F | 53.8 | Low | 62.3 | Low | 176 Ų | 176 | 128.8 Ų | 128.8 | 77% | 0.772 | 66% | 0.656 | S | S | * | * | trans | -114.2 | 69.3 | 177.9 | -68.1 | -76.9 | 0 | 0 | 0 | 110.9 | F85 | F83-F85 PolarHBondContact O-N 2.9Š| ||
| 84 | N | 67.3 | Low | 63.1 | Low | 90 Ų | 90 | 124.9 Ų | 124.9 | 48% | 0.481 | 64% | 0.638 | S | S | . | * | trans | -81.8 | 110.3 | 166 | -151.5 | 5 | 0 | 0 | 0 | 108.1 | E86 E87 M88 | N84-E86 PolarHBondContact O-N 3.41Å; N84-E87 HydrophobicContact CB-CB 4.35Å; N84-E87 HydrophobicContact CB-CG 4.31Å; N84-E87 PolarHBondContact O-N 2.73Å; N84-M88 PolarHBondContact O-N 3.12Å | ||
| 85 | F | 66.3 | Low | 63.7 | Low | 151 Ų | 151 | 123.7 Ų | 123.7 | 66% | 0.662 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -58.3 | -33.6 | -173.2 | -140 | -93.1 | 0 | 0 | 0 | 111.9 | F83 E87 M88 E89 | F83-F85 PolarHBondContact O-N 2.9Å; F85-E87 PolarHBondContact O-N 3.39Å; F85-M88 HydrophobicContact CD2-CE 4.27Å; F85-M88 HydrophobicContact CE2-CE 4.07Å; F85-M88 HydrophobicContact CZ-CE 4.24Å; F85-M88 PolarHBondContact O-N 3.17Å; F85-E89 PolarHBondContact O-N 3.35Å; F85-E89 VanDerWaalsContact O-N 3.1Å |
| 86 | E | 71.7 | Confident | 64.2 | Low | 121 Ų | 121 | 122.7 Ų | 122.7 | 57% | 0.565 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -63.1 | -33.6 | 173.3 | -111.5 | 83.6 | -170.5 | 0 | 0 | 114.1 | N84 Q90 | N84-E86 PolarHBondContact O-N 3.41Å; E86-Q90 VanDerWaalsContact O-CG 3.28Å; E86-Q90 WeakPolarHBondContact O-CG 3.33Å; E86-Q90 PolarHBondContact O-N 3.12Å; E86-Q90 VanDerWaalsContact O-N 3.12Å |
| 87 | E | 71.1 | Confident | 64.7 | Low | 127 Ų | 127 | 126.3 Ų | 126.3 | 59% | 0.593 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -77.6 | -31.2 | 179.2 | -76.5 | 179.9 | 167.8 | 0 | 0 | 111.5 | N84 F85 F91 | N84-E87 HydrophobicContact CB-CB 4.35Å; N84-E87 HydrophobicContact CB-CG 4.31Å; N84-E87 PolarHBondContact O-N 2.73Å; F85-E87 PolarHBondContact O-N 3.39Å; E87-F91 WeakPolarHBondContact O-CB 3.25Å; E87-F91 PolarHBondContact O-N 3.49Å |
| 88 | M | 68.4 | Low | 64.6 | Low | 104 Ų | 104 | 123 Ų | 123 | 51% | 0.512 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -71.2 | -36.1 | 173.6 | -170.9 | 170.3 | 63.2 | 0 | 0 | 112.1 | N84 F85 F91 A92 | N84-M88 PolarHBondContact O-N 3.12Å; F85-M88 HydrophobicContact CD2-CE 4.27Å; F85-M88 HydrophobicContact CE2-CE 4.07Å; F85-M88 HydrophobicContact CZ-CE 4.24Å; F85-M88 PolarHBondContact O-N 3.17Å; M88-F91 PolarHBondContact O-N 3.41Å; M88-A92 PolarHBondContact O-N 3.27Å |
| 89 | E | 76.1 | Confident | 64.3 | Low | 118 Ų | 118 | 124 Ų | 124 | 55% | 0.551 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -68.5 | -40.7 | 174.6 | -164.1 | 168.4 | -155 | 0 | 0 | 111.3 | F85 F91 A92 D93 | F85-E89 PolarHBondContact O-N 3.35Å; F85-E89 VanDerWaalsContact O-N 3.1Å; E89-F91 VanDerWaalsContact C-N 3.31Å; E89-F91 PolarHBondContact O-N 3.48Å; E89-A92 PolarHBondContact O-N 2.91Å; E89-D93 PolarHBondContact O-N 3.45Å |
| 90 | Q | 76.6 | Confident | 64.2 | Low | 128 Ų | 128 | 121.8 Ų | 121.8 | 60% | 0.598 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -65.4 | -32 | 172.3 | -71.7 | 175.3 | 36.7 | 0 | 0 | 113 | E86 T94 | E86-Q90 VanDerWaalsContact O-CG 3.28Å; E86-Q90 WeakPolarHBondContact O-CG 3.33Å; E86-Q90 PolarHBondContact O-N 3.12Å; E86-Q90 VanDerWaalsContact O-N 3.12Å; Q90-T94 WeakPolarHBondContact O-CB 3.26Å; Q90-T94 WeakPolarHBondContact O-CG2 3.09Å; Q90-T94 PolarHBondContact O-N 3.41Å; Q90-T94 VanDerWaalsContact O-N 3.09Å; Q90-T94 PolarHBondContact O-OG1 2.94Å |
| 91 | F | 74.5 | Confident | 63.5 | Low | 125 Ų | 125 | 119.3 Ų | 119.3 | 55% | 0.548 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -70.9 | -40 | 173.7 | -173.9 | -100 | 0 | 0 | 0 | 112.4 | E87 M88 E89 T94 Q95 | E87-F91 WeakPolarHBondContact O-CB 3.25Å; E87-F91 PolarHBondContact O-N 3.49Å; M88-F91 PolarHBondContact O-N 3.41Å; E89-F91 VanDerWaalsContact C-N 3.31Å; E89-F91 PolarHBondContact O-N 3.48Å; F91-T94 VanDerWaalsContact CA-OG1 3.29Å; F91-T94 WeakPolarHBondContact CA-OG1 3.42Å; F91-T94 PolarHBondContact O-N 3.05Å; F91-T94 PolarHBondContact O-OG1 2.76Å; F91-Q95 HydrophobicContact CD1-CG 4.24Å; F91-Q95 HydrophobicContact CE1-CG 3.78Å; F91-Q95 HydrophobicContact CE2-CG 4.38Å; F91-Q95 HydrophobicContact CZ-CG 3.87Å; F91-Q95 WeakPolarHBondContact O-CB 3.49Å; F91-Q95 WeakPolarHBondContact O-CG 3.28Å; F91-Q95 PolarHBondContact O-N 3.02Å |
| 92 | A | 72.9 | Confident | 62.4 | Low | 56 Ų | 56 | 116.3 Ų | 116.3 | 46% | 0.463 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -62.7 | -43.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | M88 E89 T94 Q95 E96 | M88-A92 PolarHBondContact O-N 3.27Å; E89-A92 PolarHBondContact O-N 2.91Å; A92-T94 VanDerWaalsContact C-N 3.33Å; A92-T94 PolarHBondContact O-N 3.19Å; A92-Q95 PolarHBondContact O-N 2.85Å; A92-E96 PolarHBondContact O-N 2.95Å |
| 93 | D | 72.4 | Confident | 61.3 | Low | 83 Ų | 83 | 117 Ų | 117 | 44% | 0.444 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -67.3 | -30.3 | 177.7 | -79.5 | -3.5 | 0 | 0 | 0 | 113.5 | E89 K97 | E89-D93 PolarHBondContact O-N 3.45Å; D93-K97 WeakPolarHBondContact O-CG 3.34Å; D93-K97 PolarHBondContact O-N 3.43Å |
| 94 | T | 68.6 | Low | 60.4 | Low | 73 Ų | 73 | 117.2 Ų | 117.2 | 45% | 0.448 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -78.4 | -37.1 | 176.2 | 44.3 | 0 | 0 | 0 | 0 | 111.7 | Q90 F91 A92 K97 V98 | Q90-T94 WeakPolarHBondContact O-CB 3.26Å; Q90-T94 WeakPolarHBondContact O-CG2 3.09Å; Q90-T94 PolarHBondContact O-N 3.41Å; Q90-T94 VanDerWaalsContact O-N 3.09Å; Q90-T94 PolarHBondContact O-OG1 2.94Å; F91-T94 VanDerWaalsContact CA-OG1 3.29Å; F91-T94 WeakPolarHBondContact CA-OG1 3.42Å; F91-T94 PolarHBondContact O-N 3.05Å; F91-T94 PolarHBondContact O-OG1 2.76Å; A92-T94 VanDerWaalsContact C-N 3.33Å; A92-T94 PolarHBondContact O-N 3.19Å; T94-K97 PolarHBondContact O-N 2.91Å; T94-V98 WeakPolarHBondContact O-CB 3.45Å; T94-V98 WeakPolarHBondContact O-CG2 3.29Å; T94-V98 PolarHBondContact O-N 3.16Å |
| 95 | Q | 63.6 | Low | 59.3 | Low | 87 Ų | 87 | 122.2 Ų | 122.2 | 41% | 0.407 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -66.2 | -35.4 | 171.7 | -77.9 | -72.3 | -39 | 0 | 0 | 112.4 | F91 A92 K97 V98 N99 | F91-Q95 HydrophobicContact CD1-CG 4.24Å; F91-Q95 HydrophobicContact CE1-CG 3.78Å; F91-Q95 HydrophobicContact CE2-CG 4.38Å; F91-Q95 HydrophobicContact CZ-CG 3.87Å; F91-Q95 WeakPolarHBondContact O-CB 3.49Å; F91-Q95 WeakPolarHBondContact O-CG 3.28Å; F91-Q95 PolarHBondContact O-N 3.02Å; A92-Q95 PolarHBondContact O-N 2.85Å; Q95-K97 VanDerWaalsContact C-N 3.33Å; Q95-K97 PolarHBondContact O-N 2.92Å; Q95-V98 PolarHBondContact O-N 2.92Å; Q95-N99 PolarHBondContact O-N 3.36Å; Q95-N99 VanDerWaalsContact O-N 3.17Å; Q95-N99 PolarHBondContact O-ND2 3.08Å |
| 96 | E | 61.6 | Low | 58 | Low | 155 Ų | 155 | 122.8 Ų | 122.8 | 72% | 0.724 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -69.8 | -30.1 | 175.4 | -137.7 | 179.9 | -161.6 | 0 | 0 | 112.3 | A92 | A92-E96 PolarHBondContact O-N 2.95Å |
| 97 | K | 60.3 | Low | 56.6 | Low | 165 Ų | 165 | 124.1 Ų | 124.1 | 72% | 0.717 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -79.3 | -26.7 | 173.3 | -77.7 | 172.3 | -176.9 | 160.4 | 0 | 114.1 | D93 T94 Q95 | D93-K97 WeakPolarHBondContact O-CG 3.34Å; D93-K97 PolarHBondContact O-N 3.43Å; T94-K97 PolarHBondContact O-N 2.91Å; Q95-K97 VanDerWaalsContact C-N 3.33Å; Q95-K97 PolarHBondContact O-N 2.92Å |
| 98 | V | 57 | Low | 55.2 | Low | 91 Ų | 91 | 125 Ų | 125 | 55% | 0.552 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -84.3 | -24.7 | -179.2 | 173.3 | 0 | 0 | 0 | 0 | 112.1 | T94 Q95 G100 T101 | T94-V98 WeakPolarHBondContact O-CB 3.45Å; T94-V98 WeakPolarHBondContact O-CG2 3.29Å; T94-V98 PolarHBondContact O-N 3.16Å; Q95-V98 PolarHBondContact O-N 2.92Å; V98-G100 PolarHBondContact O-N 2.87Å; V98-G100 VanDerWaalsContact O-N 3.08Å; V98-T101 PolarHBondContact O-N 3.07Å |
| 99 | N | 47.2 | Very low | 54.3 | Low | 136 Ų | 136 | 128.7 Ų | 128.7 | 73% | 0.727 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71 | 2 | 174.5 | -81.2 | -25.3 | 0 | 0 | 0 | 115.2 | Q95 | Q95-N99 PolarHBondContact O-N 3.36Å; Q95-N99 VanDerWaalsContact O-N 3.17Å; Q95-N99 PolarHBondContact O-ND2 3.08Å |
| 100 | G | 46.6 | Very low | 52.7 | Low | 68 Ų | 68 | 126.4 Ų | 126.4 | 70% | 0.701 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.7 | -0.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 115.8 | V98 | V98-G100 PolarHBondContact O-N 2.87Å; V98-G100 VanDerWaalsContact O-N 3.08Å |
| 101 | T | 39.8 | Very low | 51.3 | Low | 103 Ų | 103 | 127.7 Ų | 127.7 | 63% | 0.632 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -132.1 | 108.1 | -172.1 | 5.9 | 0 | 0 | 0 | 0 | 111.3 | V98 K103 | V98-T101 PolarHBondContact O-N 3.07Å; T101-K103 PolarHBondContact O-N 3.35Å |
| 102 | S | 36.4 | Very low | 49.8 | Very low | 105 Ų | 105 | 127.9 Ų | 127.9 | 73% | 0.734 | 68% | 0.678 | S | S | * | * | trans | 12 | 97 | 154.7 | 53.8 | 0 | 0 | 0 | 0 | 117.9 | E104 | S102-E104 PolarHBondContact O-N 3.37Š| ||
| 103 | K | 35.1 | Very low | 48.8 | Very low | 196 Ų | 196 | 132.3 Ų | 132.3 | 85% | 0.852 | 69% | 0.69 | S | S | * | * | 14.5 | 94.8 | 118.9 | -161.2 | 179.6 | -161.7 | 171.3 | 0 | 115.4 | T101 | T101-K103 PolarHBondContact O-N 3.35Š| |||
| 104 | E | 35.9 | Very low | 47.9 | Very low | 179 Ų | 179 | 136.3 Ų | 136.3 | 84% | 0.836 | 71% | 0.705 | S | S | * | * | trans | 169.7 | 149.3 | 146 | -93 | 154.1 | -156.6 | 0 | 0 | 107.4 | S102 | S102-E104 PolarHBondContact O-N 3.37Š| ||
| 105 | E | 42.8 | Very low | 47.3 | Very low | 195 Ų | 195 | 137.5 Ų | 137.5 | 91% | 0.911 | 71% | 0.709 | S | S | * | * | trans | 90.8 | 51.7 | 178.9 | -48.8 | -179.4 | -178.3 | 0 | 0 | 116.3 | ||||
| 106 | L | 39.6 | Very low | 47 | Very low | 163 Ų | 163 | 136.9 Ų | 136.9 | 85% | 0.853 | 71% | 0.709 | S | S | * | * | trans | -85.2 | 114.3 | 141.5 | -83.5 | 157.6 | 0 | 0 | 0 | 106.2 | ||||
| 107 | D | 41.3 | Very low | 47.2 | Very low | 150 Ų | 150 | 132.8 Ų | 132.8 | 80% | 0.802 | 70% | 0.697 | S | S | * | * | trans | 170.4 | 3.4 | 151.6 | -85.3 | -10.6 | 0 | 0 | 0 | 114.9 | Y109 | D107-Y109 PolarHBondContact O-N 3.39Š| ||
| 108 | D | 43.5 | Very low | 47.8 | Very low | 144 Ų | 144 | 129.3 Ų | 129.3 | 77% | 0.77 | 69% | 0.686 | S | S | * | * | trans | -104.5 | 56.9 | -173.9 | -78.7 | -1.9 | 0 | 0 | 0 | 114.8 | ||||
| 109 | Y | 48.4 | Very low | 48.4 | Very low | 182 Ų | 182 | 130.1 Ų | 130.1 | 71% | 0.714 | 69% | 0.685 | S | S | * | * | trans | -142 | 42.2 | 158.5 | -78.4 | -73.9 | 0 | 0 | 0 | 112.7 | D107 L111 | D107-Y109 PolarHBondContact O-N 3.39Å; Y109-L111 PolarHBondContact O-N 3.39Å | ||
| 110 | A | 42.9 | Very low | 49.9 | Very low | 70 Ų | 70 | 127.5 Ų | 127.5 | 58% | 0.579 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.3 | 34.7 | 168.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 111 | L | 47.4 | Very low | 51.6 | Low | 155 Ų | 155 | 128.3 Ų | 128.3 | 81% | 0.812 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -145.3 | 30.2 | -177 | -148.9 | 74.1 | 0 | 0 | 0 | 113.4 | Y109 | Y109-L111 PolarHBondContact O-N 3.39Š|
| 112 | F | 41.9 | Very low | 53.7 | Low | 130 Ų | 130 | 128.1 Ų | 128.1 | 57% | 0.57 | 66% | 0.66 | S | S | * | * | trans | -144.8 | 52.8 | 160 | -78 | -85.3 | 0 | 0 | 0 | 108.2 | E114 D115 D116 | F112-E114 PolarHBondContact O-N 3.08Å; F112-D115 PolarHBondContact O-N 3.12Å; F112-D116 PolarHBondContact O-N 2.85Å | ||
| 113 | E | 51.6 | Low | 56.1 | Low | 149 Ų | 149 | 130.2 Ų | 130.2 | 70% | 0.696 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64 | -12.5 | -164.6 | -70.7 | -179.3 | 145.9 | 0 | 0 | 115.3 | S117 | E113-S117 PolarHBondContact O-OG 3.31Š|
| 114 | E | 54.1 | Low | 58.6 | Low | 166 Ų | 166 | 128.9 Ų | 128.9 | 78% | 0.776 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.3 | -28.3 | 174.4 | -65.5 | -173.7 | 167.9 | 0 | 0 | 113.5 | F112 N118 | F112-E114 PolarHBondContact O-N 3.08Å; E114-N118 PolarHBondContact O-ND2 3.24Å; E114-N118 VanDerWaalsContact O-ND2 3.07Å |
| 115 | D | 55.8 | Low | 61.2 | Low | 98 Ų | 98 | 128.2 Ų | 128.2 | 52% | 0.524 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -87.8 | -35.5 | -174 | -73.9 | -30.4 | 0 | 0 | 0 | 113.1 | F112 N118 M119 | F112-D115 PolarHBondContact O-N 3.12Å; D115-N118 PolarHBondContact O-N 3.04Å; D115-M119 PolarHBondContact O-N 2.83Å |
| 116 | D | 56.6 | Low | 63.5 | Low | 75 Ų | 75 | 122.1 Ų | 122.1 | 40% | 0.401 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -70.6 | -35.1 | 176.4 | -72.4 | -23.8 | 0 | 0 | 0 | 112.2 | F112 N118 M119 V120 | F112-D116 PolarHBondContact O-N 2.85Å; D116-N118 VanDerWaalsContact C-N 3.26Å; D116-N118 PolarHBondContact O-N 3.19Å; D116-M119 PolarHBondContact O-N 3.28Å; D116-V120 WeakPolarHBondContact O-CG2 3.35Å; D116-V120 PolarHBondContact O-N 3.16Å |
| 117 | S | 66.2 | Low | 66.1 | Low | 68 Ų | 68 | 118.6 Ų | 118.6 | 48% | 0.476 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -59 | -40.2 | 173.1 | -65.7 | 0 | 0 | 0 | 0 | 111.4 | E113 C121 | E113-S117 PolarHBondContact O-OG 3.31Å; S117-C121 VanDerWaalsContact O-CB 3.29Å; S117-C121 WeakPolarHBondContact O-CB 3.47Å; S117-C121 PolarHBondContact O-N 2.75Å; S117-C121 PolarHBondContact O-SG 2.93Å |
| 118 | N | 72.5 | Confident | 68.6 | Low | 92 Ų | 92 | 119.2 Ų | 119.2 | 49% | 0.492 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -68.5 | -41.8 | 177.7 | -74.5 | -31.5 | 0 | 0 | 0 | 111.8 | E114 D115 D116 C121 Q122 | E114-N118 PolarHBondContact O-ND2 3.24Å; E114-N118 VanDerWaalsContact O-ND2 3.07Å; D115-N118 PolarHBondContact O-N 3.04Å; D116-N118 VanDerWaalsContact C-N 3.26Å; D116-N118 PolarHBondContact O-N 3.19Å; N118-C121 PolarHBondContact O-N 3.01Å; N118-Q122 VanDerWaalsContact O-CG 3.28Å; N118-Q122 WeakPolarHBondContact O-CG 3.34Å; N118-Q122 PolarHBondContact O-N 2.7Å |
| 119 | M | 69.7 | Low | 71 | Confident | 109 Ų | 109 | 116.1 Ų | 116.1 | 54% | 0.537 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -63 | -47.1 | 177.6 | -75 | -94.6 | 72.3 | 0 | 0 | 112.1 | D115 D116 C121 Q122 F123 | D115-M119 PolarHBondContact O-N 2.83Å; D116-M119 PolarHBondContact O-N 3.28Å; M119-C121 PolarHBondContact O-N 3.44Å; M119-Q122 WeakPolarHBondContact O-CB 3.22Å; M119-Q122 PolarHBondContact O-N 3.26Å; M119-Q122 VanDerWaalsContact O-N 3.15Å; M119-F123 PolarHBondContact O-N 3.23Å |
| 120 | V | 79.1 | Confident | 73.3 | Confident | 81 Ų | 81 | 112.9 Ų | 112.9 | 49% | 0.491 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -62.6 | -44 | 177.3 | 173.8 | 0 | 0 | 0 | 0 | 110.6 | D116 Q122 F123 Y124 | D116-V120 WeakPolarHBondContact O-CG2 3.35Å; D116-V120 PolarHBondContact O-N 3.16Å; V120-Q122 VanDerWaalsContact C-N 3.27Å; V120-Q122 PolarHBondContact O-N 3.37Å; V120-F123 PolarHBondContact O-N 2.84Å; V120-Y124 HydrophobicContact CG1-CD2 3.69Å; V120-Y124 HydrophobicContact CG1-CE2 3.48Å; V120-Y124 VanDerWaalsContact CG1-CE2 3.48Å; V120-Y124 VanDerWaalsContact O-CD2 3.23Å; V120-Y124 WeakPolarHBondContact O-CD2 3.36Å; V120-Y124 PolarHBondContact O-N 2.94Å |
| 121 | C | 82.7 | Confident | 75.7 | Confident | 85 Ų | 85 | 116.3 Ų | 116.3 | 57% | 0.574 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -59.7 | -37 | 174.6 | -74.5 | 0 | 0 | 0 | 0 | 112.6 | S117 N118 M119 R125 | S117-C121 VanDerWaalsContact O-CB 3.29Å; S117-C121 WeakPolarHBondContact O-CB 3.47Å; S117-C121 PolarHBondContact O-N 2.75Å; S117-C121 PolarHBondContact O-SG 2.93Å; N118-C121 PolarHBondContact O-N 3.01Å; M119-C121 PolarHBondContact O-N 3.44Å; C121-R125 WeakPolarHBondContact O-CB 3.48Å; C121-R125 PolarHBondContact O-N 2.98Å |
| 122 | Q | 84.6 | Confident | 77.9 | Confident | 99 Ų | 99 | 113.5 Ų | 113.5 | 46% | 0.463 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -67.3 | -42.7 | 175.2 | -74.4 | -178.2 | 32 | 0 | 0 | 112.1 | N118 M119 V120 R125 V126 | N118-Q122 VanDerWaalsContact O-CG 3.28Å; N118-Q122 WeakPolarHBondContact O-CG 3.34Å; N118-Q122 PolarHBondContact O-N 2.7Å; M119-Q122 WeakPolarHBondContact O-CB 3.22Å; M119-Q122 PolarHBondContact O-N 3.26Å; M119-Q122 VanDerWaalsContact O-N 3.15Å; V120-Q122 VanDerWaalsContact C-N 3.27Å; V120-Q122 PolarHBondContact O-N 3.37Å; Q122-R125 WeakPolarHBondContact O-CA 3.5Å; Q122-R125 VanDerWaalsContact O-CB 3.32Å; Q122-R125 WeakPolarHBondContact O-CB 3.36Å; Q122-R125 PolarHBondContact O-N 3.27Å; Q122-R125 VanDerWaalsContact O-N 3.1Å; Q122-V126 WeakPolarHBondContact O-CG2 3.45Å; Q122-V126 PolarHBondContact O-N 3.25Å |
| 123 | F | 85.3 | Confident | 80.3 | Confident | 149 Ų | 149 | 114 Ų | 114 | 65% | 0.654 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -61.1 | -46.9 | 177.5 | -123.2 | -78.5 | 0 | 0 | 0 | 111.9 | M119 V120 R125 V126 I127 | M119-F123 PolarHBondContact O-N 3.23Å; V120-F123 PolarHBondContact O-N 2.84Å; F123-R125 PolarHBondContact O-N 3.23Å; F123-V126 PolarHBondContact O-N 3.43Å; F123-V126 VanDerWaalsContact O-N 3.15Å; F123-I127 HydrophobicContact CD1-CD1 4.35Å; F123-I127 WeakPolarHBondContact O-CG1 3.41Å; F123-I127 PolarHBondContact O-N 3.15Å; F123-I127 VanDerWaalsContact O-N 3.07Å |
| 124 | Y | 88.4 | Confident | 82.3 | Confident | 167 Ų | 167 | 114.3 Ų | 114.3 | 66% | 0.655 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -60.4 | -35.2 | 173.4 | -79.5 | -69.4 | 0 | 0 | 0 | 112.3 | V120 R128 | V120-Y124 HydrophobicContact CG1-CD2 3.69Å; V120-Y124 HydrophobicContact CG1-CE2 3.48Å; V120-Y124 VanDerWaalsContact CG1-CE2 3.48Å; V120-Y124 VanDerWaalsContact O-CD2 3.23Å; V120-Y124 WeakPolarHBondContact O-CD2 3.36Å; V120-Y124 PolarHBondContact O-N 2.94Å; Y124-R128 WeakPolarHBondContact O-CB 3.47Å; Y124-R128 PolarHBondContact O-N 2.77Å; Y124-R128 VanDerWaalsContact O-N 3.11Å |
| 125 | R | 91.4 | Very high | 84.2 | Confident | 165 Ų | 165 | 108.8 Ų | 108.8 | 62% | 0.623 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -64.9 | -42.8 | 173.9 | -172.1 | 177.1 | 83.9 | 162.8 | 3.6 | 112.1 | C121 Q122 F123 R128 L129 | C121-R125 WeakPolarHBondContact O-CB 3.48Å; C121-R125 PolarHBondContact O-N 2.98Å; Q122-R125 WeakPolarHBondContact O-CA 3.5Å; Q122-R125 VanDerWaalsContact O-CB 3.32Å; Q122-R125 WeakPolarHBondContact O-CB 3.36Å; Q122-R125 PolarHBondContact O-N 3.27Å; Q122-R125 VanDerWaalsContact O-N 3.1Å; F123-R125 PolarHBondContact O-N 3.23Å; R125-R128 PolarHBondContact O-N 2.96Å; R125-L129 HydrophobicContact CG-CD1 4.02Å; R125-L129 HydrophobicContact CG-CG 4.5Å; R125-L129 WeakPolarHBondContact O-CB 3.44Å; R125-L129 VanDerWaalsContact O-CG 3.29Å; R125-L129 WeakPolarHBondContact O-CG 3.31Å; R125-L129 PolarHBondContact O-N 3.14Å |
| 126 | V | 91.2 | Very high | 85.9 | Confident | 68 Ų | 68 | 110.1 Ų | 110.1 | 41% | 0.412 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -62.5 | -51 | 179.3 | 172.4 | 0 | 0 | 0 | 0 | 110.4 | Q122 F123 R128 L129 E130 | Q122-V126 WeakPolarHBondContact O-CG2 3.45Å; Q122-V126 PolarHBondContact O-N 3.25Å; F123-V126 PolarHBondContact O-N 3.43Å; F123-V126 VanDerWaalsContact O-N 3.15Å; V126-R128 VanDerWaalsContact C-N 3.3Å; V126-R128 PolarHBondContact O-N 3.01Å; V126-L129 PolarHBondContact O-N 3.26Å; V126-L129 VanDerWaalsContact O-N 3.07Å; V126-E130 HydrophobicContact CG1-CG 4.32Å; V126-E130 WeakPolarHBondContact O-CG 3.45Å; V126-E130 PolarHBondContact O-N 3.18Å |
| 127 | I | 93 | Very high | 87.6 | Confident | 88 Ų | 88 | 113.7 Ų | 113.7 | 45% | 0.451 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -58.1 | -44.5 | 179.3 | -65.3 | 169.7 | 0 | 0 | 0 | 110.9 | F123 L129 E130 E131 | F123-I127 HydrophobicContact CD1-CD1 4.35Å; F123-I127 WeakPolarHBondContact O-CG1 3.41Å; F123-I127 PolarHBondContact O-N 3.15Å; F123-I127 VanDerWaalsContact O-N 3.07Å; I127-L129 VanDerWaalsContact C-N 3.34Å; I127-L129 PolarHBondContact O-N 2.91Å; I127-E130 PolarHBondContact O-N 3.45Å; I127-E131 PolarHBondContact O-N 3.27Å |
| 128 | R | 94.2 | Very high | 88.9 | Confident | 163 Ų | 163 | 113.8 Ų | 113.8 | 62% | 0.615 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -59.7 | -43 | 176.4 | -179.5 | -176.9 | 163.9 | -164.4 | -8.3 | 112.2 | Y124 R125 V126 E132 | Y124-R128 WeakPolarHBondContact O-CB 3.47Å; Y124-R128 PolarHBondContact O-N 2.77Å; Y124-R128 VanDerWaalsContact O-N 3.11Å; R125-R128 PolarHBondContact O-N 2.96Å; V126-R128 VanDerWaalsContact C-N 3.3Å; V126-R128 PolarHBondContact O-N 3.01Å; R128-E132 IonicContact CZ-OE1 3.3Å; R128-E132 VanDerWaalsContact CZ-OE1 3.3Å; R128-E132 IonicContact NE-OE1 2.78Å; R128-E132 PolarHBondContact NE-OE1 2.8Å; R128-E132 IonicContact NH2-OE1 2.95Å; R128-E132 PolarHBondContact NH2-OE1 3.17Å; R128-E132 WeakPolarHBondContact O-CB 3.42Å; R128-E132 VanDerWaalsContact O-CG 3.28Å; R128-E132 WeakPolarHBondContact O-CG 3.2Å; R128-E132 PolarHBondContact O-N 3.23Å |
| 129 | L | 95 | Very high | 89.8 | Confident | 79 Ų | 79 | 111.5 Ų | 111.5 | 41% | 0.414 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -70.9 | -34.9 | 179.3 | -72.4 | 171 | 0 | 0 | 0 | 112.6 | R125 V126 I127 N133 | R125-L129 HydrophobicContact CG-CD1 4.02Å; R125-L129 HydrophobicContact CG-CG 4.5Å; R125-L129 WeakPolarHBondContact O-CB 3.44Å; R125-L129 VanDerWaalsContact O-CG 3.29Å; R125-L129 WeakPolarHBondContact O-CG 3.31Å; R125-L129 PolarHBondContact O-N 3.14Å; V126-L129 PolarHBondContact O-N 3.26Å; V126-L129 VanDerWaalsContact O-N 3.07Å; I127-L129 VanDerWaalsContact C-N 3.34Å; I127-L129 PolarHBondContact O-N 2.91Å; L129-N133 WeakPolarHBondContact O-CB 3.49Å; L129-N133 VanDerWaalsContact O-CG 3.3Å; L129-N133 PolarHBondContact O-N 2.72Å; L129-N133 PolarHBondContact O-ND2 3.17Å |
| 130 | E | 94.8 | Very high | 90.9 | Very high | 114 Ų | 114 | 110.8 Ų | 110.8 | 53% | 0.533 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -64.2 | -44.3 | 173.8 | -73 | 178 | 170 | 0 | 0 | 111.3 | V126 I127 N133 L134 | V126-E130 HydrophobicContact CG1-CG 4.32Å; V126-E130 WeakPolarHBondContact O-CG 3.45Å; V126-E130 PolarHBondContact O-N 3.18Å; I127-E130 PolarHBondContact O-N 3.45Å; E130-N133 PolarHBondContact O-N 3.32Å; E130-L134 WeakPolarHBondContact O-CG 3.32Å; E130-L134 PolarHBondContact O-N 3.45Å; E130-L134 VanDerWaalsContact O-N 3.08Å |
| 131 | E | 95 | Very high | 91.4 | Very high | 142 Ų | 142 | 112.6 Ų | 112.6 | 66% | 0.664 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -64 | -45.3 | 175.1 | -171.9 | 176.5 | -168 | 0 | 0 | 111.9 | I127 N133 L134 A135 | I127-E131 PolarHBondContact O-N 3.27Å; E131-N133 VanDerWaalsContact C-N 3.27Å; E131-N133 PolarHBondContact O-N 3.5Å; E131-L134 PolarHBondContact O-N 3.3Å; E131-A135 PolarHBondContact O-N 2.78Å |
| 132 | E | 93 | Very high | 91.9 | Very high | 96 Ų | 96 | 112.1 Ų | 112.1 | 45% | 0.449 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -60 | -35.2 | 175.9 | -76.7 | 176.5 | -172.9 | 0 | 0 | 112.2 | R128 | R128-E132 IonicContact CZ-OE1 3.3Å; R128-E132 VanDerWaalsContact CZ-OE1 3.3Å; R128-E132 IonicContact NE-OE1 2.78Å; R128-E132 PolarHBondContact NE-OE1 2.8Å; R128-E132 IonicContact NH2-OE1 2.95Å; R128-E132 PolarHBondContact NH2-OE1 3.17Å; R128-E132 WeakPolarHBondContact O-CB 3.42Å; R128-E132 VanDerWaalsContact O-CG 3.28Å; R128-E132 WeakPolarHBondContact O-CG 3.2Å; R128-E132 PolarHBondContact O-N 3.23Å |
| 133 | N | 92.2 | Very high | 92.3 | Very high | 140 Ų | 140 | 110.3 Ų | 110.3 | 75% | 0.749 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -76 | -29.3 | 177.7 | -80.2 | -27.6 | 0 | 0 | 0 | 113.9 | L129 E130 E131 | L129-N133 WeakPolarHBondContact O-CB 3.49Å; L129-N133 VanDerWaalsContact O-CG 3.3Å; L129-N133 PolarHBondContact O-N 2.72Å; L129-N133 PolarHBondContact O-ND2 3.17Å; E130-N133 PolarHBondContact O-N 3.32Å; E131-N133 VanDerWaalsContact C-N 3.27Å; E131-N133 PolarHBondContact O-N 3.5Å |
| 134 | L | 93.9 | Very high | 92.6 | Very high | 156 Ų | 156 | 112.7 Ų | 112.7 | 82% | 0.817 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -79.4 | -25.8 | 176 | -70.7 | 171.1 | 0 | 0 | 0 | 112.4 | E130 E131 | E130-L134 WeakPolarHBondContact O-CG 3.32Å; E130-L134 PolarHBondContact O-N 3.45Å; E130-L134 VanDerWaalsContact O-N 3.08Å; E131-L134 PolarHBondContact O-N 3.3Å |
| 135 | A | 93.5 | Very high | 92.9 | Very high | 51 Ų | 51 | 106.8 Ų | 106.8 | 42% | 0.421 | 55% | 0.551 | S | S | . | * | S | Bend | trans | -66.1 | 152.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | E131 K137 | E131-A135 PolarHBondContact O-N 2.78Å; A135-K137 PolarHBondContact O-N 2.78Å |
| 136 | P | 91.8 | Very high | 93 | Very high | 126 Ų | 126 | 104.4 Ų | 104.4 | 82% | 0.818 | 55% | 0.551 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 136.2 | 175.7 | 27 | -34.3 | 0 | 0 | 0 | 110.8 | ||
| 137 | K | 92.8 | Very high | 93 | Very high | 150 Ų | 150 | 104.6 Ų | 104.6 | 65% | 0.652 | 56% | 0.56 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 138.2 | 177.4 | -66.7 | -179.4 | -179.1 | -179.8 | 0 | 110.2 | A135 L141 V142 | A135-K137 PolarHBondContact O-N 2.78Å; K137-L141 HydrophobicContact CB-CB 4.16Å; K137-L141 HydrophobicContact CD-CB 4.44Å; K137-V142 HydrophobicContact CB-CG2 4.26Å |
| 138 | P | 92 | Very high | 93 | Very high | 70 Ų | 70 | 108.6 Ų | 108.6 | 46% | 0.455 | 58% | 0.581 | S | S | . | * | P | Polyproline II helix | trans | -62.4 | 153.1 | 173.7 | 30 | -36.3 | 0 | 0 | 0 | 109.5 | E140 L141 | P138-E140 PolarHBondContact O-N 3.36Å; P138-L141 HydrophobicContact CG-CB 4.43Å; P138-L141 HydrophobicContact CG-CD1 3.57Å; P138-L141 PolarHBondContact O-N 2.96Å |
| 139 | W | 92.5 | Very high | 92.9 | Very high | 44 Ų | 44 | 105.8 Ų | 105.8 | 17% | 0.167 | 58% | 0.582 | C | S | . | * | G | 310 helix | trans | -52.8 | -26.8 | -176.4 | 70.6 | -90.2 | 0 | 0 | 0 | 113.4 | L141 V142 V145 R150 S154 K158 | W139-L141 VanDerWaalsContact C-N 3.3Å; W139-L141 PolarHBondContact O-N 3.37Å; W139-V142 PolarHBondContact O-N 3.25Å; W139-V145 HydrophobicContact CB-CG1 4.33Å; W139-V145 HydrophobicContact CE3-CG1 4.25Å; W139-V145 VanDerWaalsContact O-CG2 3.22Å; W139-V145 WeakPolarHBondContact O-CG2 3.31Å; W139-R150 HydrophobicContact CB-CB 4.45Å; W139-R150 HydrophobicContact CD2-CB 3.84Å; W139-R150 HydrophobicContact CE3-CB 4.09Å; W139-R150 HydrophobicContact CG-CB 3.99Å; W139-S154 WeakPolarHBondContact CZ2-OG 3.28Å; W139-S154 PolarHBondContact NE1-OG 3.1Å; W139-K158 HydrophobicContact CH2-CG 4.08Å; W139-K158 HydrophobicContact CZ2-CG 3.97Å |
| 140 | E | 92 | Very high | 92.8 | Very high | 94 Ų | 94 | 105.7 Ų | 105.7 | 44% | 0.439 | 58% | 0.576 | S | S | . | * | G | 310 helix | trans | -63.9 | -30.7 | 176.2 | -63.5 | 167.7 | -132.2 | 0 | 0 | 113.9 | P138 K158 | P138-E140 PolarHBondContact O-N 3.36Å; E140-K158 WeakPolarHBondContact OE1-CE 3.42Å; E140-K158 IonicContact OE1-NZ 3.73Å; E140-K158 PolarHBondContact OE1-NZ 3.44Å; E140-K158 VanDerWaalsContact OE2-CE 3.31Å; E140-K158 WeakPolarHBondContact OE2-CE 3.46Å; E140-K158 IonicContact OE2-NZ 3.26Å; E140-K158 PolarHBondContact OE2-NZ 2.94Å |
| 141 | L | 91 | Very high | 92.7 | Very high | 119 Ų | 119 | 104 Ų | 104 | 62% | 0.623 | 58% | 0.575 | S | S | * | * | G | 310 helix | trans | -94 | -0 | -179.9 | -84.5 | 88.2 | 0 | 0 | 0 | 112.8 | K137 P138 W139 | K137-L141 HydrophobicContact CB-CB 4.16Å; K137-L141 HydrophobicContact CD-CB 4.44Å; P138-L141 HydrophobicContact CG-CB 4.43Å; P138-L141 HydrophobicContact CG-CD1 3.57Å; P138-L141 PolarHBondContact O-N 2.96Å; W139-L141 VanDerWaalsContact C-N 3.3Å; W139-L141 PolarHBondContact O-N 3.37Å |
| 142 | V | 92 | Very high | 92.7 | Very high | 74 Ų | 74 | 106 Ų | 106 | 45% | 0.448 | 58% | 0.584 | S | S | . | * | S | Bend | trans | -97.5 | 133.6 | 177.8 | -174.2 | 0 | 0 | 0 | 0 | 108.3 | K137 W139 V145 | K137-V142 HydrophobicContact CB-CG2 4.26Å; W139-V142 PolarHBondContact O-N 3.25Å; V142-V145 HydrophobicContact CB-CG2 3.97Å; V142-V145 HydrophobicContact CG1-CG2 4.3Å; V142-V145 WeakPolarHBondContact O-CG2 3.45Å |
| 143 | G | 93.4 | Very high | 92.7 | Very high | 62 Ų | 62 | 107.3 Ų | 107.3 | 64% | 0.639 | 59% | 0.594 | S | S | * | * | S | Bend | trans | -73.3 | 159.5 | 170.1 | 0 | 0 | 0 | 0 | 0 | 112 | V145 | G143-V145 PolarHBondContact O-N 3.13Š|
| 144 | E | 92.6 | Very high | 92.7 | Very high | 198 Ų | 198 | 101.3 Ų | 101.3 | 93% | 0.925 | 56% | 0.563 | S | S | * | * | S | Bend | trans | 56.2 | 42 | 170.6 | -56.4 | -178.2 | -178.7 | 0 | 0 | 114.7 | N146 | E144-N146 PolarHBondContact O-N 3.46Š|
| 145 | V | 93 | Very high | 92.6 | Very high | 43 Ų | 43 | 97.5 Ų | 97.5 | 26% | 0.261 | 54% | 0.544 | S | S | . | . | trans | -73.4 | 121.3 | -177 | -176.8 | 0 | 0 | 0 | 0 | 112.8 | W139 V142 G143 V149 R150 | W139-V145 HydrophobicContact CB-CG1 4.33Å; W139-V145 HydrophobicContact CE3-CG1 4.25Å; W139-V145 VanDerWaalsContact O-CG2 3.22Å; W139-V145 WeakPolarHBondContact O-CG2 3.31Å; V142-V145 HydrophobicContact CB-CG2 3.97Å; V142-V145 HydrophobicContact CG1-CG2 4.3Å; V142-V145 WeakPolarHBondContact O-CG2 3.45Å; G143-V145 PolarHBondContact O-N 3.13Å; V145-V149 HydrophobicContact CG1-CB 4.27Å; V145-R150 HydrophobicContact CG1-CB 4.28Å | ||
| 146 | N | 93.3 | Very high | 92.5 | Very high | 115 Ų | 115 | 102 Ų | 102 | 62% | 0.615 | 56% | 0.56 | S | S | * | * | trans | -77.6 | 152.3 | 171 | -72.9 | -28.8 | 0 | 0 | 0 | 112.2 | E144 L148 V149 | E144-N146 PolarHBondContact O-N 3.46Å; N146-L148 PolarHBondContact O-N 2.9Å; N146-L148 VanDerWaalsContact O-N 3.09Å; N146-V149 HydrophobicContact CB-CG2 4.42Å; N146-V149 PolarHBondContact O-N 3.02Å | ||
| 147 | A | 93 | Very high | 92.5 | Very high | 73 Ų | 73 | 102.4 Ų | 102.4 | 60% | 0.603 | 56% | 0.555 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59 | -24.8 | 180 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 148 | L | 92.4 | Very high | 92.3 | Very high | 171 Ų | 171 | 98.9 Ų | 98.9 | 90% | 0.895 | 54% | 0.54 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.1 | -24 | 178.8 | -61.4 | 173.1 | 0 | 0 | 0 | 113.7 | N146 | N146-L148 PolarHBondContact O-N 2.9Å; N146-L148 VanDerWaalsContact O-N 3.09Å |
| 149 | V | 91.5 | Very high | 92.4 | Very high | 104 Ų | 104 | 101.8 Ų | 101.8 | 63% | 0.63 | 56% | 0.561 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.4 | -31.5 | -174.9 | 178.1 | 0 | 0 | 0 | 0 | 111.2 | V145 N146 | V145-V149 HydrophobicContact CG1-CB 4.27Å; N146-V149 HydrophobicContact CB-CG2 4.42Å; N146-V149 PolarHBondContact O-N 3.02Å |
| 150 | R | 92.8 | Very high | 92.3 | Very high | 78 Ų | 78 | 104.5 Ų | 104.5 | 29% | 0.294 | 58% | 0.579 | S | S | . | * | S | Bend | trans | -86.8 | 151.1 | 177.8 | 70.4 | -179.2 | -174.3 | -155.9 | 0.6 | 111.3 | W139 V145 | W139-R150 HydrophobicContact CB-CB 4.45Å; W139-R150 HydrophobicContact CD2-CB 3.84Å; W139-R150 HydrophobicContact CE3-CB 4.09Å; W139-R150 HydrophobicContact CG-CB 3.99Å; V145-R150 HydrophobicContact CG1-CB 4.28Å |
| 151 | P | 94 | Very high | 92.4 | Very high | 79 Ų | 79 | 108.8 Ų | 108.8 | 51% | 0.513 | 60% | 0.604 | S | S | . | * | P | Polyproline II helix | trans | -59 | 151.8 | 170.4 | -21.8 | 33 | 0 | 0 | 0 | 112.4 | S154 | P151-S154 VanDerWaalsContact O-CB 3.28Å; P151-S154 WeakPolarHBondContact O-CB 3.43Å; P151-S154 PolarHBondContact O-N 3.42Å |
| 152 | E | 93.9 | Very high | 92.5 | Very high | 183 Ų | 183 | 110.8 Ų | 110.8 | 86% | 0.855 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.8 | 141.9 | 175.9 | -63.7 | -172.6 | 168.2 | 0 | 0 | 111.2 | S154 | E152-S154 PolarHBondContact O-N 3.01Š|
| 153 | N | 92.5 | Very high | 92.6 | Very high | 124 Ų | 124 | 115.2 Ų | 115.2 | 66% | 0.663 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 57.7 | 6.3 | -179.6 | -59.8 | -38 | 0 | 0 | 0 | 117 | L155 L156 | N153-L155 PolarHBondContact O-N 3.39Å; N153-L156 HydrophobicContact CB-CD1 4.35Å; N153-L156 PolarHBondContact O-N 3.23Å |
| 154 | S | 92.3 | Very high | 92.6 | Very high | 14 Ų | 14 | 119.8 Ų | 119.8 | 10% | 0.098 | 63% | 0.627 | C | S | . | * | H | α-helix | trans | -62 | -20 | -178.4 | -167 | 0 | 0 | 0 | 0 | 114.3 | W139 P151 E152 L156 | W139-S154 WeakPolarHBondContact CZ2-OG 3.28Å; W139-S154 PolarHBondContact NE1-OG 3.1Å; P151-S154 VanDerWaalsContact O-CB 3.28Å; P151-S154 WeakPolarHBondContact O-CB 3.43Å; P151-S154 PolarHBondContact O-N 3.42Å; E152-S154 PolarHBondContact O-N 3.01Å; S154-L156 VanDerWaalsContact C-N 3.32Å; S154-L156 PolarHBondContact O-N 3.28Å |
| 155 | L | 91.4 | Very high | 92.7 | Very high | 76 Ų | 76 | 115.5 Ų | 115.5 | 40% | 0.398 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -68.5 | -27.9 | 175.2 | -177.2 | 61.4 | 0 | 0 | 0 | 113.2 | N153 D157 K158 L160 | N153-L155 PolarHBondContact O-N 3.39Å; L155-D157 VanDerWaalsContact C-N 3.29Å; L155-D157 PolarHBondContact O-N 2.82Å; L155-K158 PolarHBondContact O-N 2.85Å; L155-L160 HydrophobicContact CD1-CD1 3.42Å; L155-L160 VanDerWaalsContact CD1-CD1 3.42Å; L155-L160 HydrophobicContact CD1-CG 4.23Å |
| 156 | L | 92.5 | Very high | 92.8 | Very high | 145 Ų | 145 | 118 Ų | 118 | 76% | 0.759 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -70.5 | -29.5 | -179 | -64.7 | 177.1 | 0 | 0 | 0 | 112.1 | N153 S154 K158 | N153-L156 HydrophobicContact CB-CD1 4.35Å; N153-L156 PolarHBondContact O-N 3.23Å; S154-L156 VanDerWaalsContact C-N 3.32Å; S154-L156 PolarHBondContact O-N 3.28Å; L156-K158 VanDerWaalsContact C-N 3.35Å |
| 157 | D | 91.3 | Very high | 92.8 | Very high | 135 Ų | 135 | 124.2 Ų | 124.2 | 72% | 0.722 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -78.6 | -22 | -179.8 | -60.3 | -26.8 | 0 | 0 | 0 | 112.3 | L155 | L155-D157 VanDerWaalsContact C-N 3.29Å; L155-D157 PolarHBondContact O-N 2.82Å |
| 158 | K | 89.6 | Confident | 92.7 | Very high | 76 Ų | 76 | 126.2 Ų | 126.2 | 33% | 0.33 | 66% | 0.655 | S | S | . | * | S | Bend | trans | -103.1 | 125.1 | -172 | -59.9 | -65.9 | 172.2 | 165.7 | 0 | 111.5 | W139 E140 L155 L156 L160 | W139-K158 HydrophobicContact CH2-CG 4.08Å; W139-K158 HydrophobicContact CZ2-CG 3.97Å; E140-K158 WeakPolarHBondContact OE1-CE 3.42Å; E140-K158 IonicContact OE1-NZ 3.73Å; E140-K158 PolarHBondContact OE1-NZ 3.44Å; E140-K158 VanDerWaalsContact OE2-CE 3.31Å; E140-K158 WeakPolarHBondContact OE2-CE 3.46Å; E140-K158 IonicContact OE2-NZ 3.26Å; E140-K158 PolarHBondContact OE2-NZ 2.94Å; L155-K158 PolarHBondContact O-N 2.85Å; L156-K158 VanDerWaalsContact C-N 3.35Å; K158-L160 PolarHBondContact O-N 2.85Å |
| 159 | S | 92.6 | Very high | 92.8 | Very high | 130 Ų | 130 | 123.2 Ų | 123.2 | 91% | 0.909 | 65% | 0.646 | S | S | * | * | trans | -83.3 | 87.9 | 175.5 | -65.3 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 160 | L | 91 | Very high | 92.9 | Very high | 102 Ų | 102 | 124 Ų | 124 | 53% | 0.534 | 65% | 0.653 | S | S | . | * | trans | -90.1 | 141.5 | 176.4 | -58.2 | -178.3 | 0 | 0 | 0 | 111.7 | L155 K158 | L155-L160 HydrophobicContact CD1-CD1 3.42Å; L155-L160 VanDerWaalsContact CD1-CD1 3.42Å; L155-L160 HydrophobicContact CD1-CG 4.23Å; K158-L160 PolarHBondContact O-N 2.85Å | ||
| 161 | L | 93.5 | Very high | 93 | Very high | 183 Ų | 183 | 127.2 Ų | 127.2 | 96% | 0.958 | 68% | 0.675 | S | S | * | * | trans | -92.3 | 125.9 | 170 | -61.5 | 178.5 | 0 | 0 | 0 | 109.3 | ||||
| 162 | F | 93 | Very high | 93 | Very high | 162 Ų | 162 | 130.2 Ų | 130.2 | 71% | 0.711 | 69% | 0.685 | S | S | * | * | trans | -142.7 | 150.4 | 178 | 61.4 | -88.7 | 0 | 0 | 0 | 110.4 | ||||
| 163 | D | 94.5 | Very high | 93.2 | Very high | 166 Ų | 166 | 124.4 Ų | 124.4 | 89% | 0.888 | 66% | 0.662 | S | S | * | * | trans | -80.1 | 148.8 | 178.2 | -72.3 | -24.4 | 0 | 0 | 0 | 111.8 | ||||
| 164 | R | 94.2 | Very high | 93.4 | Very high | 159 Ų | 159 | 123.1 Ų | 123.1 | 60% | 0.6 | 66% | 0.66 | S | S | * | * | trans | -112.9 | 128.8 | 176.6 | -165.8 | 177.8 | 177.8 | 89.7 | 4.8 | 110.5 | T166 L168 | R164-T166 VanDerWaalsContact C-N 3.29Å; R164-T166 PolarHBondContact O-N 3.46Å; R164-L168 VanDerWaalsContact CZ-CD2 3.42Å; R164-L168 VanDerWaalsContact NH2-CD2 3.26Å | ||
| 165 | A | 94.1 | Very high | 93.6 | Very high | 107 Ų | 107 | 128.2 Ų | 128.2 | 88% | 0.884 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -66.2 | -24.8 | -176.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 166 | T | 94.9 | Very high | 93.8 | Very high | 96 Ų | 96 | 127 Ų | 127 | 59% | 0.589 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -135.4 | 148.7 | -174.5 | 58.2 | 0 | 0 | 0 | 0 | 112.4 | R164 | R164-T166 VanDerWaalsContact C-N 3.29Å; R164-T166 PolarHBondContact O-N 3.46Å |
| 167 | R | 93.5 | Very high | 94.1 | Very high | 246 Ų | 246 | 122.6 Ų | 122.6 | 93% | 0.928 | 66% | 0.66 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 133.1 | 170.4 | -65.8 | -177.5 | 178.1 | 178.1 | -0.3 | 109.2 | ||
| 168 | L | 92.1 | Very high | 94.3 | Very high | 115 Ų | 115 | 122.4 Ų | 122.4 | 60% | 0.602 | 65% | 0.654 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 145.8 | 174.4 | -72 | 171.5 | 0 | 0 | 0 | 110.5 | R164 | R164-L168 VanDerWaalsContact CZ-CD2 3.42Å; R164-L168 VanDerWaalsContact NH2-CD2 3.26Å |
| 169 | P | 93.6 | Very high | 94.7 | Very high | 107 Ų | 107 | 125.7 Ų | 125.7 | 70% | 0.695 | 67% | 0.669 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 135.8 | 170.5 | 26.7 | -33.2 | 0 | 0 | 0 | 109.3 | ||
| 170 | P | 93.9 | Very high | 94.9 | Very high | 120 Ų | 120 | 123.9 Ų | 123.9 | 78% | 0.779 | 65% | 0.648 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 137 | -179.6 | 27.6 | -33.9 | 0 | 0 | 0 | 110.6 | ||
| 171 | I | 94.6 | Very high | 95.2 | Very high | 147 Ų | 147 | 123.2 Ų | 123.2 | 75% | 0.754 | 64% | 0.643 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 132.3 | 174.7 | -59.4 | 169.1 | 0 | 0 | 0 | 108.4 | T173 | I171-T173 PolarHBondContact O-N 3.32Š|
| 172 | I | 94.8 | Very high | 95.3 | Very high | 142 Ų | 142 | 117.4 Ų | 117.4 | 73% | 0.728 | 62% | 0.621 | S | S | * | * | trans | -77 | 92.5 | 179.9 | -55.2 | 171.3 | 0 | 0 | 0 | 108.5 | ||||
| 173 | T | 96.9 | Very high | 95.5 | Very high | 60 Ų | 60 | 113.8 Ų | 113.8 | 37% | 0.368 | 61% | 0.607 | S | S | . | * | trans | -84.9 | 154.7 | 174.3 | 62.2 | 0 | 0 | 0 | 0 | 111 | I171 E175 S176 T177 | I171-T173 PolarHBondContact O-N 3.32Å; T173-E175 PolarHBondContact O-N 2.9Å; T173-S176 WeakPolarHBondContact O-CB 3.25Å; T173-S176 PolarHBondContact O-N 3.33Å; T173-S176 PolarHBondContact OG1-N 3.35Å; T173-T177 PolarHBondContact O-N 2.96Å; T173-T177 PolarHBondContact O-OG1 2.84Å | ||
| 174 | P | 97.1 | Very high | 95.4 | Very high | 97 Ų | 97 | 110.8 Ų | 110.8 | 63% | 0.63 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -56 | -38.5 | 176.1 | 21.8 | -33.2 | 0 | 0 | 0 | 112.1 | S176 T177 E178 | P174-S176 VanDerWaalsContact C-N 3.33Å; P174-S176 PolarHBondContact O-N 3.38Å; P174-T177 WeakPolarHBondContact O-CB 3.37Å; P174-T177 PolarHBondContact O-N 3.35Å; P174-T177 VanDerWaalsContact O-N 3.16Å; P174-E178 WeakPolarHBondContact O-CG 3.44Å; P174-E178 PolarHBondContact O-N 3.18Å |
| 175 | E | 96 | Very high | 95.5 | Very high | 122 Ų | 122 | 109.5 Ų | 109.5 | 57% | 0.57 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -60.2 | -38.2 | 176 | -58.8 | -177.9 | -179.2 | 0 | 0 | 113.5 | T173 K179 | T173-E175 PolarHBondContact O-N 2.9Å; E175-K179 VanDerWaalsContact O-CG 3.29Å; E175-K179 WeakPolarHBondContact O-CG 3.23Å; E175-K179 PolarHBondContact O-N 3.35Å; E175-K179 VanDerWaalsContact O-N 3.11Å |
| 176 | S | 97.1 | Very high | 95.5 | Very high | 50 Ų | 50 | 112.8 Ų | 112.8 | 35% | 0.35 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -66.2 | -42.4 | 176.8 | -173.1 | 0 | 0 | 0 | 0 | 110.6 | T173 P174 K179 L180 | T173-S176 WeakPolarHBondContact O-CB 3.25Å; T173-S176 PolarHBondContact O-N 3.33Å; T173-S176 PolarHBondContact OG1-N 3.35Å; P174-S176 VanDerWaalsContact C-N 3.33Å; P174-S176 PolarHBondContact O-N 3.38Å; S176-K179 PolarHBondContact O-N 2.83Å; S176-L180 WeakPolarHBondContact O-CG 3.41Å; S176-L180 PolarHBondContact O-N 3.46Å |
| 177 | T | 97.3 | Very high | 95.4 | Very high | 53 Ų | 53 | 113.4 Ų | 113.4 | 33% | 0.325 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -63.8 | -44.6 | 175.9 | -55.6 | 0 | 0 | 0 | 0 | 111.6 | T173 P174 K179 L180 E181 | T173-T177 PolarHBondContact O-N 2.96Å; T173-T177 PolarHBondContact O-OG1 2.84Å; P174-T177 WeakPolarHBondContact O-CB 3.37Å; P174-T177 PolarHBondContact O-N 3.35Å; P174-T177 VanDerWaalsContact O-N 3.16Å; T177-K179 VanDerWaalsContact C-N 3.33Å; T177-K179 PolarHBondContact O-N 2.87Å; T177-L180 WeakPolarHBondContact O-CB 3.19Å; T177-L180 PolarHBondContact O-N 2.91Å; T177-L180 VanDerWaalsContact O-N 3.16Å; T177-E181 WeakPolarHBondContact O-CG 3.4Å; T177-E181 PolarHBondContact O-N 3.48Å |
| 178 | E | 97.2 | Very high | 95.3 | Very high | 130 Ų | 130 | 106.7 Ų | 106.7 | 61% | 0.607 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -59.2 | -42.2 | 176.3 | -73.9 | 176 | -170.9 | 0 | 0 | 112.4 | P174 E181 A182 | P174-E178 WeakPolarHBondContact O-CG 3.44Å; P174-E178 PolarHBondContact O-N 3.18Å; E178-E181 PolarHBondContact O-N 3.19Å; E178-A182 WeakPolarHBondContact O-CB 3.33Å; E178-A182 PolarHBondContact O-N 3Å |
| 179 | K | 97.2 | Very high | 95.3 | Very high | 145 Ų | 145 | 109.6 Ų | 109.6 | 63% | 0.63 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -63 | -43.3 | 175 | -72.1 | 169.2 | -173.3 | 168.7 | 0 | 111.7 | E175 S176 T177 A182 M183 | E175-K179 VanDerWaalsContact O-CG 3.29Å; E175-K179 WeakPolarHBondContact O-CG 3.23Å; E175-K179 PolarHBondContact O-N 3.35Å; E175-K179 VanDerWaalsContact O-N 3.11Å; S176-K179 PolarHBondContact O-N 2.83Å; T177-K179 VanDerWaalsContact C-N 3.33Å; T177-K179 PolarHBondContact O-N 2.87Å; K179-A182 PolarHBondContact O-N 2.9Å; K179-M183 PolarHBondContact O-N 3.33Å; K179-M183 VanDerWaalsContact O-N 3.12Å |
| 180 | L | 97 | Very high | 95.3 | Very high | 93 Ų | 93 | 108.6 Ų | 108.6 | 49% | 0.487 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -64.2 | -43.2 | 175.9 | -72.8 | 172.8 | 0 | 0 | 0 | 111.6 | S176 T177 M183 I184 | S176-L180 WeakPolarHBondContact O-CG 3.41Å; S176-L180 PolarHBondContact O-N 3.46Å; T177-L180 WeakPolarHBondContact O-CB 3.19Å; T177-L180 PolarHBondContact O-N 2.91Å; T177-L180 VanDerWaalsContact O-N 3.16Å; L180-M183 WeakPolarHBondContact O-CB 3.37Å; L180-M183 PolarHBondContact O-N 2.88Å; L180-I184 VanDerWaalsContact O-CG1 3.29Å; L180-I184 WeakPolarHBondContact O-CG1 3.37Å; L180-I184 PolarHBondContact O-N 3.24Å |
| 181 | E | 96.8 | Very high | 94.6 | Very high | 88 Ų | 88 | 113.3 Ų | 113.3 | 41% | 0.411 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -62.9 | -43.7 | 176.5 | -77.6 | -169.9 | -164.3 | 0 | 0 | 112.4 | T177 E178 M183 I184 K185 | T177-E181 WeakPolarHBondContact O-CG 3.4Å; T177-E181 PolarHBondContact O-N 3.48Å; E178-E181 PolarHBondContact O-N 3.19Å; E181-M183 VanDerWaalsContact C-N 3.25Å; E181-M183 PolarHBondContact O-N 3.43Å; E181-I184 PolarHBondContact O-N 3.01Å; E181-K185 VanDerWaalsContact O-CB 3.3Å; E181-K185 WeakPolarHBondContact O-CB 3.19Å; E181-K185 WeakPolarHBondContact O-CG 3.49Å; E181-K185 PolarHBondContact O-N 3.02Å; E181-K185 IonicContact OE2-NZ 2.67Å; E181-K185 PolarHBondContact OE2-NZ 2.96Å |
| 182 | A | 96.5 | Very high | 93.8 | Very high | 60 Ų | 60 | 110.8 Ų | 110.8 | 50% | 0.496 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -58.4 | -41.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111 | E178 K179 R186 | E178-A182 WeakPolarHBondContact O-CB 3.33Å; E178-A182 PolarHBondContact O-N 3Å; K179-A182 PolarHBondContact O-N 2.9Å; A182-R186 WeakPolarHBondContact O-CB 3.39Å; A182-R186 PolarHBondContact O-N 2.82Å |
| 183 | M | 95.6 | Very high | 92.7 | Very high | 87 Ų | 87 | 112 Ų | 112 | 43% | 0.429 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -64.5 | -43.6 | 175.1 | -169 | -166.6 | -54.8 | 0 | 0 | 112.2 | K179 L180 E181 R186 R187 | K179-M183 PolarHBondContact O-N 3.33Å; K179-M183 VanDerWaalsContact O-N 3.12Å; L180-M183 WeakPolarHBondContact O-CB 3.37Å; L180-M183 PolarHBondContact O-N 2.88Å; E181-M183 VanDerWaalsContact C-N 3.25Å; E181-M183 PolarHBondContact O-N 3.43Å; M183-R186 PolarHBondContact O-N 3.49Å; M183-R187 WeakPolarHBondContact O-CG 3.38Å; M183-R187 PolarHBondContact O-N 3.09Å |
| 184 | I | 93.8 | Very high | 91.5 | Very high | 102 Ų | 102 | 119.5 Ų | 119.5 | 52% | 0.523 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -66.5 | -47.2 | 178.7 | -67.5 | 164.8 | 0 | 0 | 0 | 110.3 | L180 E181 R186 R187 V188 | L180-I184 VanDerWaalsContact O-CG1 3.29Å; L180-I184 WeakPolarHBondContact O-CG1 3.37Å; L180-I184 PolarHBondContact O-N 3.24Å; E181-I184 PolarHBondContact O-N 3.01Å; I184-R186 VanDerWaalsContact C-N 3.29Å; I184-R186 PolarHBondContact O-N 3.38Å; I184-R187 PolarHBondContact O-N 3.35Å; I184-R187 VanDerWaalsContact O-N 3.12Å; I184-V188 HydrophobicContact CG2-CG2 4.24Å; I184-V188 WeakPolarHBondContact O-CB 3.34Å; I184-V188 WeakPolarHBondContact O-CG2 3.44Å; I184-V188 PolarHBondContact O-N 3.18Å |
| 185 | K | 95.9 | Very high | 90.3 | Very high | 132 Ų | 132 | 121.2 Ų | 121.2 | 57% | 0.574 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -55.5 | -44.7 | 175.6 | -72.8 | 167.3 | -171.5 | 162.3 | 0 | 110.4 | E181 V188 K189 | E181-K185 VanDerWaalsContact O-CB 3.3Å; E181-K185 WeakPolarHBondContact O-CB 3.19Å; E181-K185 WeakPolarHBondContact O-CG 3.49Å; E181-K185 PolarHBondContact O-N 3.02Å; E181-K185 IonicContact OE2-NZ 2.67Å; E181-K185 PolarHBondContact OE2-NZ 2.96Å; K185-V188 PolarHBondContact O-N 3.31Å; K185-K189 VanDerWaalsContact O-CB 3.29Å; K185-K189 WeakPolarHBondContact O-CB 3.31Å; K185-K189 PolarHBondContact O-N 3.07Å |
| 186 | R | 94 | Very high | 89 | Confident | 177 Ų | 177 | 122.2 Ų | 122.2 | 67% | 0.668 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -60.9 | -49.6 | 173.6 | -177 | 175.4 | 177.8 | 176.6 | 2.1 | 112.3 | A182 M183 I184 V188 K189 D190 | A182-R186 WeakPolarHBondContact O-CB 3.39Å; A182-R186 PolarHBondContact O-N 2.82Å; M183-R186 PolarHBondContact O-N 3.49Å; I184-R186 VanDerWaalsContact C-N 3.29Å; I184-R186 PolarHBondContact O-N 3.38Å; R186-V188 VanDerWaalsContact C-N 3.33Å; R186-V188 PolarHBondContact O-N 2.99Å; R186-K189 WeakPolarHBondContact O-CB 3.47Å; R186-K189 PolarHBondContact O-N 2.92Å; R186-D190 WeakPolarHBondContact CG-OD2 3.39Å; R186-D190 IonicContact NE-OD2 3.55Å; R186-D190 WeakPolarHBondContact O-CB 3.28Å; R186-D190 PolarHBondContact O-N 3.29Å |
| 187 | R | 92.6 | Very high | 87.1 | Confident | 108 Ų | 108 | 127.4 Ų | 127.4 | 41% | 0.408 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -63.5 | -35.8 | 179.3 | -74.2 | -175.8 | -178.7 | 170.5 | 7.4 | 113.5 | M183 I184 D190 R191 V192 | M183-R187 WeakPolarHBondContact O-CG 3.38Å; M183-R187 PolarHBondContact O-N 3.09Å; I184-R187 PolarHBondContact O-N 3.35Å; I184-R187 VanDerWaalsContact O-N 3.12Å; R187-D190 CarbonylContact O-C 3.57Å; R187-R191 PolarHBondContact O-N 2.88Å; R187-V192 PolarHBondContact O-N 3.39Å |
| 188 | V | 91.3 | Very high | 85.4 | Confident | 105 Ų | 105 | 128.8 Ų | 128.8 | 64% | 0.636 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -69.2 | -43.5 | 175.3 | 172.7 | 0 | 0 | 0 | 0 | 110.3 | I184 K185 R186 D190 R191 | I184-V188 HydrophobicContact CG2-CG2 4.24Å; I184-V188 WeakPolarHBondContact O-CB 3.34Å; I184-V188 WeakPolarHBondContact O-CG2 3.44Å; I184-V188 PolarHBondContact O-N 3.18Å; K185-V188 PolarHBondContact O-N 3.31Å; R186-V188 VanDerWaalsContact C-N 3.33Å; R186-V188 PolarHBondContact O-N 2.99Å; V188-D190 VanDerWaalsContact C-N 3.31Å; V188-D190 PolarHBondContact O-N 2.69Å; V188-R191 PolarHBondContact O-N 3.13Å; V188-R191 VanDerWaalsContact O-N 3.16Å |
| 189 | K | 93.2 | Very high | 83.7 | Confident | 176 Ų | 176 | 127.8 Ų | 127.8 | 77% | 0.765 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -58 | -44.4 | 172.6 | -173.9 | 179 | 179.8 | -179.3 | 0 | 111.3 | K185 R186 R191 | K185-K189 VanDerWaalsContact O-CB 3.29Å; K185-K189 WeakPolarHBondContact O-CB 3.31Å; K185-K189 PolarHBondContact O-N 3.07Å; R186-K189 WeakPolarHBondContact O-CB 3.47Å; R186-K189 PolarHBondContact O-N 2.92Å; K189-R191 VanDerWaalsContact C-N 3.26Å; K189-R191 PolarHBondContact O-N 3.22Å |
| 190 | D | 91.8 | Very high | 81.7 | Confident | 87 Ų | 87 | 127.2 Ų | 127.2 | 47% | 0.465 | 61% | 0.612 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -79.6 | -5 | -179.8 | -60.8 | -16.1 | 0 | 0 | 0 | 113.1 | R186 R187 V188 V192 | R186-D190 WeakPolarHBondContact CG-OD2 3.39Å; R186-D190 IonicContact NE-OD2 3.55Å; R186-D190 WeakPolarHBondContact O-CB 3.28Å; R186-D190 PolarHBondContact O-N 3.29Å; R187-D190 CarbonylContact O-C 3.57Å; V188-D190 VanDerWaalsContact C-N 3.31Å; V188-D190 PolarHBondContact O-N 2.69Å; D190-V192 HydrophobicContact CB-CG2 3.95Å; D190-V192 PolarHBondContact O-N 3.38Å; D190-V192 VanDerWaalsContact O-N 3.15Å |
| 191 | R | 79.9 | Confident | 79.5 | Confident | 219 Ų | 219 | 129.5 Ų | 129.5 | 83% | 0.826 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 54.8 | 24.6 | -176.9 | -56.9 | -177.4 | 178 | -168.7 | 0.5 | 115 | R187 V188 K189 K193 | R187-R191 PolarHBondContact O-N 2.88Å; V188-R191 PolarHBondContact O-N 3.13Å; V188-R191 VanDerWaalsContact O-N 3.16Å; K189-R191 VanDerWaalsContact C-N 3.26Å; K189-R191 PolarHBondContact O-N 3.22Å; R191-K193 PolarHBondContact O-N 3.2Å |
| 192 | V | 77.3 | Confident | 77.6 | Confident | 94 Ų | 94 | 132.4 Ų | 132.4 | 57% | 0.57 | 64% | 0.643 | S | S | * | * | trans | -83.6 | 97.2 | -179.6 | -177.3 | 0 | 0 | 0 | 0 | 109.7 | R187 D190 | R187-V192 PolarHBondContact O-N 3.39Å; D190-V192 HydrophobicContact CB-CG2 3.95Å; D190-V192 PolarHBondContact O-N 3.38Å; D190-V192 VanDerWaalsContact O-N 3.15Å | ||
| 193 | K | 73.2 | Confident | 75.4 | Confident | 167 Ų | 167 | 132.5 Ų | 132.5 | 73% | 0.726 | 65% | 0.649 | S | S | * | * | trans | -103.8 | 128 | 168.9 | -62.5 | -171.8 | -179.3 | -171 | 0 | 109.8 | R191 K195 | R191-K193 PolarHBondContact O-N 3.2Å; K193-K195 PolarHBondContact O-N 3.15Å | ||
| 194 | R | 71.3 | Confident | 73.3 | Confident | 217 Ų | 217 | 134.3 Ų | 134.3 | 82% | 0.819 | 67% | 0.665 | S | S | * | * | trans | -63.6 | 127 | 165.4 | -70.7 | -175.2 | 173.7 | 120.4 | -3.1 | 107.8 | ||||
| 195 | K | 70.6 | Confident | 71.4 | Confident | 133 Ų | 133 | 139.7 Ų | 139.7 | 58% | 0.578 | 68% | 0.68 | S | S | * | * | trans | -128.3 | 131.3 | 176.6 | -66.1 | -172.5 | 178.9 | -174.4 | 0 | 108.3 | K193 | K193-K195 PolarHBondContact O-N 3.15Š| ||
| 196 | V | 68.8 | Low | 69.4 | Low | 143 Ų | 143 | 141.7 Ų | 141.7 | 87% | 0.867 | 69% | 0.689 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 136.6 | 167.9 | -177.7 | 0 | 0 | 0 | 0 | 107.7 | ||
| 197 | K | 57.3 | Low | 67.6 | Low | 159 Ų | 159 | 138.1 Ų | 138.1 | 69% | 0.691 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 128.7 | 178.5 | -64.3 | 176 | 179.6 | 178.3 | 0 | 108.5 | T199 | K197-T199 PolarHBondContact O-N 3.06Š|
| 198 | P | 61.9 | Low | 66 | Low | 83 Ų | 83 | 141.3 Ų | 141.3 | 54% | 0.539 | 71% | 0.71 | S | S | . | * | P | Polyproline II helix | trans | -68.5 | 121.2 | 157.9 | 28.2 | -29 | 0 | 0 | 0 | 107.5 | N200 | P198-N200 VanDerWaalsContact C-N 3.34Å; P198-N200 PolarHBondContact O-N 2.95Å |
| 199 | T | 60.9 | Low | 64.4 | Low | 108 Ų | 108 | 144.4 Ų | 144.4 | 66% | 0.663 | 72% | 0.722 | S | S | * | * | trans | -69.1 | 91.5 | 174.3 | -55.2 | 0 | 0 | 0 | 0 | 108.3 | K197 D201 | K197-T199 PolarHBondContact O-N 3.06Å; T199-D201 VanDerWaalsContact CG2-CG 3.41Å; T199-D201 WeakPolarHBondContact CG2-OD1 3.36Å; T199-D201 VanDerWaalsContact CG2-OD2 3.23Å; T199-D201 WeakPolarHBondContact CG2-OD2 3.44Å | ||
| 200 | N | 56.8 | Low | 63.3 | Low | 133 Ų | 133 | 142 Ų | 142 | 71% | 0.711 | 72% | 0.722 | S | S | * | * | trans | -94.6 | 90.1 | 163.8 | -80.7 | -15.6 | 0 | 0 | 0 | 107.1 | P198 L202 | P198-N200 VanDerWaalsContact C-N 3.34Å; P198-N200 PolarHBondContact O-N 2.95Å; N200-L202 PolarHBondContact O-N 3.16Å | ||
| 201 | D | 49.1 | Very low | 62.4 | Low | 142 Ų | 142 | 145.1 Ų | 145.1 | 76% | 0.759 | 74% | 0.738 | S | S | * | * | trans | -73.9 | 79.2 | 171.8 | -67.1 | -29.1 | 0 | 0 | 0 | 109.2 | T199 | T199-D201 VanDerWaalsContact CG2-CG 3.41Å; T199-D201 WeakPolarHBondContact CG2-OD1 3.36Å; T199-D201 VanDerWaalsContact CG2-OD2 3.23Å; T199-D201 WeakPolarHBondContact CG2-OD2 3.44Å | ||
| 202 | L | 57 | Low | 62.3 | Low | 149 Ų | 149 | 141 Ų | 141 | 78% | 0.78 | 73% | 0.732 | S | S | * | * | trans | -105.9 | 91.6 | 155 | -63.7 | 178.4 | 0 | 0 | 0 | 105.4 | N200 V204 | N200-L202 PolarHBondContact O-N 3.16Å; L202-V204 PolarHBondContact O-N 3.38Å | ||
| 203 | G | 51.5 | Low | 62.7 | Low | 61 Ų | 61 | 145.7 Ų | 145.7 | 63% | 0.629 | 75% | 0.748 | S | S | * | * | trans | -59.1 | 81.6 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y205 | G203-Y205 WeakPolarHBondContact O-CD2 3.25Å; G203-Y205 PolarHBondContact O-N 3.46Å | ||
| 204 | V | 51.5 | Low | 63.4 | Low | 126 Ų | 126 | 145.3 Ų | 145.3 | 76% | 0.764 | 75% | 0.749 | S | S | * | * | trans | -72.2 | 86 | 164.6 | -175.7 | 0 | 0 | 0 | 0 | 106.2 | L202 K206 | L202-V204 PolarHBondContact O-N 3.38Å; V204-K206 PolarHBondContact O-N 2.82Å | ||
| 205 | Y | 53.5 | Low | 64.1 | Low | 214 Ų | 214 | 144.8 Ų | 144.8 | 84% | 0.839 | 75% | 0.753 | S | S | * | * | trans | -60.1 | 111 | 166.2 | -69.4 | -82 | 0 | 0 | 0 | 107.4 | G203 S207 | G203-Y205 WeakPolarHBondContact O-CD2 3.25Å; G203-Y205 PolarHBondContact O-N 3.46Å; Y205-S207 PolarHBondContact O-N 2.99Å | ||
| 206 | K | 54.2 | Low | 64.8 | Low | 175 Ų | 175 | 142.6 Ų | 142.6 | 76% | 0.761 | 75% | 0.754 | S | S | * | * | trans | -69.7 | 107.9 | 165.3 | -67.6 | 174.8 | -177.2 | 171.9 | 0 | 105.5 | V204 E208 | V204-K206 PolarHBondContact O-N 2.82Å; K206-E208 PolarHBondContact O-N 3.03Å; K206-E208 VanDerWaalsContact O-N 3.12Å | ||
| 207 | S | 56.6 | Low | 65.8 | Low | 101 Ų | 101 | 145.7 Ų | 145.7 | 71% | 0.706 | 76% | 0.756 | S | S | * | * | trans | -57.9 | 117.5 | 167.4 | 54.9 | 0 | 0 | 0 | 0 | 107.7 | Y205 L209 | Y205-S207 PolarHBondContact O-N 2.99Å; S207-L209 PolarHBondContact O-N 3.2Å; S207-L209 VanDerWaalsContact O-N 3.12Å | ||
| 208 | E | 57.9 | Low | 67.4 | Low | 175 Ų | 175 | 141.4 Ų | 141.4 | 82% | 0.818 | 74% | 0.74 | S | S | * | * | trans | -61.4 | 116.2 | 171.2 | -66.4 | -176.4 | 171.9 | 0 | 0 | 107.8 | K206 V210 | K206-E208 PolarHBondContact O-N 3.03Å; K206-E208 VanDerWaalsContact O-N 3.12Å; E208-V210 VanDerWaalsContact C-N 3.29Å; E208-V210 PolarHBondContact O-N 3.39Å | ||
| 209 | L | 59 | Low | 68.8 | Low | 171 Ų | 171 | 140.5 Ų | 140.5 | 90% | 0.895 | 74% | 0.736 | S | S | * | * | trans | -72.4 | 89.1 | 172.8 | -75.7 | 158.4 | 0 | 0 | 0 | 107.5 | S207 L211 | S207-L209 PolarHBondContact O-N 3.2Å; S207-L209 VanDerWaalsContact O-N 3.12Å; L209-L211 PolarHBondContact O-N 3.16Å | ||
| 210 | V | 69 | Low | 70.2 | Confident | 124 Ų | 124 | 141 Ų | 141 | 75% | 0.752 | 73% | 0.734 | S | S | * | * | trans | -74.8 | 113.6 | 168.8 | -178.9 | 0 | 0 | 0 | 0 | 107.4 | E208 D212 | E208-V210 VanDerWaalsContact C-N 3.29Å; E208-V210 PolarHBondContact O-N 3.39Å; V210-D212 PolarHBondContact O-N 3.36Å | ||
| 211 | L | 74.3 | Confident | 71.8 | Confident | 153 Ų | 153 | 139 Ų | 139 | 80% | 0.801 | 73% | 0.73 | S | S | * | * | trans | -80.6 | 114.9 | 177.1 | -175.8 | 69.6 | 0 | 0 | 0 | 109.3 | L209 Q213 | L209-L211 PolarHBondContact O-N 3.16Å; L211-Q213 PolarHBondContact O-N 3.08Å | ||
| 212 | D | 77.7 | Confident | 73.9 | Confident | 132 Ų | 132 | 136.1 Ų | 136.1 | 71% | 0.706 | 71% | 0.712 | S | S | * | * | trans | -64.8 | 124.4 | 171.9 | -102.2 | -24.8 | 0 | 0 | 0 | 110.5 | V210 Q214 | V210-D212 PolarHBondContact O-N 3.36Å; D212-Q214 VanDerWaalsContact C-N 3.31Å | ||
| 213 | Q | 85.7 | Confident | 75.5 | Confident | 194 Ų | 194 | 131.9 Ų | 131.9 | 91% | 0.907 | 69% | 0.692 | S | S | * | * | trans | -86.7 | -1.7 | 179.3 | -61.9 | -175.2 | 17.6 | 0 | 0 | 113.2 | L211 | L211-Q213 PolarHBondContact O-N 3.08Š| ||
| 214 | Q | 86.8 | Confident | 77.4 | Confident | 158 Ų | 158 | 135.9 Ų | 135.9 | 74% | 0.738 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -74.5 | 147.3 | 176.5 | -61.9 | -170.9 | -8 | 0 | 0 | 110.5 | D212 S216 | D212-Q214 VanDerWaalsContact C-N 3.31Å; Q214-S216 PolarHBondContact O-N 3.44Å |
| 215 | K | 86 | Confident | 79.3 | Confident | 207 Ų | 207 | 135.7 Ų | 135.7 | 90% | 0.9 | 68% | 0.68 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 128.8 | 175.5 | -66.1 | -179.9 | -179.1 | 177.4 | 0 | 109 | K217 | K215-K217 PolarHBondContact O-N 3.48Š|
| 216 | S | 84.7 | Confident | 81.1 | Confident | 87 Ų | 87 | 128.9 Ų | 128.9 | 61% | 0.608 | 66% | 0.656 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 130.8 | 176.5 | 178.3 | 0 | 0 | 0 | 0 | 110.4 | Q214 L218 | Q214-S216 PolarHBondContact O-N 3.44Å; S216-L218 VanDerWaalsContact C-N 3.27Å; S216-L218 PolarHBondContact OG-N 2.95Å; S216-L218 VanDerWaalsContact OG-N 3.14Å; S216-L218 PolarHBondContact OG-O 3.16Å |
| 217 | K | 90.3 | Very high | 82.6 | Confident | 207 Ų | 207 | 124.4 Ų | 124.4 | 90% | 0.9 | 64% | 0.638 | S | S | * | * | S | Bend | trans | -74.1 | -22.7 | 170.8 | -64.4 | -179.1 | -178 | 177.5 | 0 | 112.1 | K215 | K215-K217 PolarHBondContact O-N 3.48Š|
| 218 | L | 90.1 | Very high | 84.1 | Confident | 69 Ų | 69 | 127.1 Ų | 127.1 | 36% | 0.361 | 63% | 0.634 | S | S | . | * | S | Bend | trans | -96.2 | 142.9 | -176.2 | -59.4 | 173 | 0 | 0 | 0 | 110.9 | S216 E222 V223 | S216-L218 VanDerWaalsContact C-N 3.27Å; S216-L218 PolarHBondContact OG-N 2.95Å; S216-L218 VanDerWaalsContact OG-N 3.14Å; S216-L218 PolarHBondContact OG-O 3.16Å; L218-E222 VanDerWaalsContact CA-OE2 3.27Å; L218-E222 WeakPolarHBondContact CA-OE2 3.4Å; L218-E222 HydrophobicContact CB-CB 4.34Å; L218-E222 WeakPolarHBondContact CB-OE2 3.25Å; L218-E222 WeakPolarHBondContact CD2-OE2 3.25Å; L218-V223 HydrophobicContact CB-CG2 4.03Å |
| 219 | S | 91.6 | Very high | 85.5 | Confident | 64 Ų | 64 | 122.2 Ų | 122.2 | 45% | 0.448 | 61% | 0.613 | S | S | . | * | trans | -66.9 | 154.4 | 173.1 | 179.5 | 0 | 0 | 0 | 0 | 111.2 | S221 E222 V223 | S219-S221 PolarHBondContact O-N 3.17Å; S219-E222 PolarHBondContact N-OE2 3.46Å; S219-E222 WeakPolarHBondContact O-CB 3.33Å; S219-E222 PolarHBondContact O-N 2.89Å; S219-V223 WeakPolarHBondContact O-CG2 3.37Å; S219-V223 PolarHBondContact O-N 2.98Å | ||
| 220 | L | 91.1 | Very high | 86.6 | Confident | 120 Ų | 120 | 121 Ų | 121 | 63% | 0.628 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -55.6 | -38.9 | 176.6 | -177.6 | 61.9 | 0 | 0 | 0 | 111.7 | V223 Y224 | L220-V223 PolarHBondContact O-N 2.88Å; L220-Y224 HydrophobicContact CD1-CD2 4.04Å; L220-Y224 HydrophobicContact CD1-CE2 3.54Å; L220-Y224 HydrophobicContact CD2-CE2 4.17Å; L220-Y224 HydrophobicContact CG-CD2 3.94Å; L220-Y224 HydrophobicContact CG-CE2 3.63Å; L220-Y224 WeakPolarHBondContact O-CD2 3.35Å; L220-Y224 PolarHBondContact O-N 2.82Å; L220-Y224 VanDerWaalsContact O-N 3.11Å |
| 221 | S | 91 | Very high | 87 | Confident | 90 Ų | 90 | 122.2 Ų | 122.2 | 63% | 0.629 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -62.8 | -42.5 | 176.6 | -58.2 | 0 | 0 | 0 | 0 | 112.4 | S219 Y224 E225 | S219-S221 PolarHBondContact O-N 3.17Å; S221-Y224 PolarHBondContact O-N 3.07Å; S221-E225 PolarHBondContact O-N 2.93Å |
| 222 | E | 92.9 | Very high | 87.1 | Confident | 82 Ų | 82 | 124.1 Ų | 124.1 | 38% | 0.383 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -67.4 | -37.5 | 178.2 | -67.5 | 163.4 | -167.7 | 0 | 0 | 111.5 | L218 S219 Y224 E225 Q226 | L218-E222 VanDerWaalsContact CA-OE2 3.27Å; L218-E222 WeakPolarHBondContact CA-OE2 3.4Å; L218-E222 HydrophobicContact CB-CB 4.34Å; L218-E222 WeakPolarHBondContact CB-OE2 3.25Å; L218-E222 WeakPolarHBondContact CD2-OE2 3.25Å; S219-E222 PolarHBondContact N-OE2 3.46Å; S219-E222 WeakPolarHBondContact O-CB 3.33Å; S219-E222 PolarHBondContact O-N 2.89Å; E222-Y224 VanDerWaalsContact C-N 3.35Å; E222-E225 PolarHBondContact O-N 3.08Å; E222-Q226 WeakPolarHBondContact O-CB 3.49Å; E222-Q226 VanDerWaalsContact O-CG 3.29Å; E222-Q226 WeakPolarHBondContact O-CG 3.3Å; E222-Q226 PolarHBondContact O-N 3.39Å |
| 223 | V | 89.9 | Confident | 86.4 | Confident | 59 Ų | 59 | 122.6 Ų | 122.6 | 36% | 0.358 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -62.1 | -44.3 | 175 | 174 | 0 | 0 | 0 | 0 | 110.5 | L218 S219 L220 Q226 E227 | L218-V223 HydrophobicContact CB-CG2 4.03Å; S219-V223 WeakPolarHBondContact O-CG2 3.37Å; S219-V223 PolarHBondContact O-N 2.98Å; L220-V223 PolarHBondContact O-N 2.88Å; V223-Q226 PolarHBondContact O-N 2.85Å; V223-E227 VanDerWaalsContact O-CB 3.31Å; V223-E227 WeakPolarHBondContact O-CB 3.35Å; V223-E227 PolarHBondContact O-N 2.96Å |
| 224 | Y | 92.2 | Very high | 85.1 | Confident | 146 Ų | 146 | 119.8 Ų | 119.8 | 57% | 0.573 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -65.2 | -39.3 | 176.1 | -81.1 | -62.1 | 0 | 0 | 0 | 112.7 | L220 S221 E222 E227 Y228 | L220-Y224 HydrophobicContact CD1-CD2 4.04Å; L220-Y224 HydrophobicContact CD1-CE2 3.54Å; L220-Y224 HydrophobicContact CD2-CE2 4.17Å; L220-Y224 HydrophobicContact CG-CD2 3.94Å; L220-Y224 HydrophobicContact CG-CE2 3.63Å; L220-Y224 WeakPolarHBondContact O-CD2 3.35Å; L220-Y224 PolarHBondContact O-N 2.82Å; L220-Y224 VanDerWaalsContact O-N 3.11Å; S221-Y224 PolarHBondContact O-N 3.07Å; E222-Y224 VanDerWaalsContact C-N 3.35Å; Y224-E227 PolarHBondContact O-N 2.91Å; Y224-Y228 VanDerWaalsContact O-CB 3.3Å; Y224-Y228 WeakPolarHBondContact O-CB 3.43Å; Y224-Y228 PolarHBondContact O-N 3.41Å |
| 225 | E | 90.9 | Very high | 83.7 | Confident | 121 Ų | 121 | 116.6 Ų | 116.6 | 57% | 0.565 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -62.2 | -49.9 | 174.6 | -177.5 | -179.5 | -179.3 | 0 | 0 | 111.2 | S221 E222 E227 Y228 L229 | S221-E225 PolarHBondContact O-N 2.93Å; E222-E225 PolarHBondContact O-N 3.08Å; E225-E227 VanDerWaalsContact C-N 3.34Å; E225-E227 PolarHBondContact O-N 3.12Å; E225-Y228 WeakPolarHBondContact O-CB 3.41Å; E225-Y228 PolarHBondContact O-N 3.45Å; E225-Y228 VanDerWaalsContact O-N 3.16Å; E225-L229 HydrophobicContact CG-CD1 4.3Å; E225-L229 WeakPolarHBondContact O-CG 3.4Å; E225-L229 PolarHBondContact O-N 3.47Å |
| 226 | Q | 90.2 | Very high | 82.3 | Confident | 71 Ų | 71 | 113.3 Ų | 113.3 | 33% | 0.332 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -63.3 | -39 | 177.4 | -72.8 | -179.8 | 11.6 | 0 | 0 | 112.2 | E222 V223 Y228 L229 K230 | E222-Q226 WeakPolarHBondContact O-CB 3.49Å; E222-Q226 VanDerWaalsContact O-CG 3.29Å; E222-Q226 WeakPolarHBondContact O-CG 3.3Å; E222-Q226 PolarHBondContact O-N 3.39Å; V223-Q226 PolarHBondContact O-N 2.85Å; Q226-Y228 VanDerWaalsContact C-N 3.32Å; Q226-L229 PolarHBondContact O-N 3.37Å; Q226-K230 VanDerWaalsContact O-CB 3.24Å; Q226-K230 WeakPolarHBondContact O-CB 3.41Å; Q226-K230 WeakPolarHBondContact O-CG 3.49Å; Q226-K230 PolarHBondContact O-N 3.22Å |
| 227 | E | 87.2 | Confident | 81.2 | Confident | 82 Ų | 82 | 114.1 Ų | 114.1 | 38% | 0.383 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -65.5 | -38.3 | 175.2 | -165.5 | -169.7 | 162.7 | 0 | 0 | 111 | V223 Y224 E225 K231 | V223-E227 VanDerWaalsContact O-CB 3.31Å; V223-E227 WeakPolarHBondContact O-CB 3.35Å; V223-E227 PolarHBondContact O-N 2.96Å; Y224-E227 PolarHBondContact O-N 2.91Å; E225-E227 VanDerWaalsContact C-N 3.34Å; E225-E227 PolarHBondContact O-N 3.12Å; E227-K231 HydrophobicContact CG-CD 4.43Å; E227-K231 WeakPolarHBondContact O-CB 3.48Å; E227-K231 VanDerWaalsContact O-CG 3.24Å; E227-K231 WeakPolarHBondContact O-CG 3.28Å; E227-K231 PolarHBondContact O-N 2.96Å; E227-K231 WeakPolarHBondContact OE1-CE 3.38Å; E227-K231 IonicContact OE1-NZ 2.65Å; E227-K231 PolarHBondContact OE1-NZ 3.47Å |
| 228 | Y | 86.5 | Confident | 80.4 | Confident | 158 Ų | 158 | 107.7 Ų | 107.7 | 62% | 0.62 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -64.6 | -44.8 | 174.9 | -176.9 | -95.9 | 0 | 0 | 0 | 111.7 | Y224 E225 Q226 K231 R232 | Y224-Y228 VanDerWaalsContact O-CB 3.3Å; Y224-Y228 WeakPolarHBondContact O-CB 3.43Å; Y224-Y228 PolarHBondContact O-N 3.41Å; E225-Y228 WeakPolarHBondContact O-CB 3.41Å; E225-Y228 PolarHBondContact O-N 3.45Å; E225-Y228 VanDerWaalsContact O-N 3.16Å; Q226-Y228 VanDerWaalsContact C-N 3.32Å; Y228-K231 PolarHBondContact O-N 2.91Å; Y228-R232 PolarHBondContact O-N 3.45Å; Y228-R232 VanDerWaalsContact O-N 3.14Å |
| 229 | L | 87.4 | Confident | 80.1 | Confident | 72 Ų | 72 | 108.7 Ų | 108.7 | 38% | 0.377 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -64.5 | -46.6 | 175.1 | -67.8 | 174.7 | 0 | 0 | 0 | 111.7 | E225 Q226 K231 R232 E233 | E225-L229 HydrophobicContact CG-CD1 4.3Å; E225-L229 WeakPolarHBondContact O-CG 3.4Å; E225-L229 PolarHBondContact O-N 3.47Å; Q226-L229 PolarHBondContact O-N 3.37Å; L229-K231 VanDerWaalsContact C-N 3.27Å; L229-K231 PolarHBondContact O-N 3.16Å; L229-R232 CarbonylContact O-C 3.56Å; L229-R232 WeakPolarHBondContact O-CA 3.38Å; L229-R232 WeakPolarHBondContact O-CB 3.35Å; L229-R232 PolarHBondContact O-N 3.04Å; L229-E233 PolarHBondContact O-N 3.09Å |
| 230 | K | 82.9 | Confident | 80 | Confident | 145 Ų | 145 | 108 Ų | 108 | 63% | 0.63 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -63.8 | -28.1 | 175.8 | -74.2 | 171.8 | -178.6 | 172.7 | 0 | 113.5 | Q226 R232 | Q226-K230 VanDerWaalsContact O-CB 3.24Å; Q226-K230 WeakPolarHBondContact O-CB 3.41Å; Q226-K230 WeakPolarHBondContact O-CG 3.49Å; Q226-K230 PolarHBondContact O-N 3.22Å; K230-R232 VanDerWaalsContact C-N 3.33Å |
| 231 | K | 77.5 | Confident | 79.8 | Confident | 150 Ų | 150 | 107.2 Ų | 107.2 | 65% | 0.652 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -73.1 | -29.5 | 171.6 | -81.4 | 172 | -176.2 | 164.4 | 0 | 111.9 | E227 Y228 L229 | E227-K231 HydrophobicContact CG-CD 4.43Å; E227-K231 WeakPolarHBondContact O-CB 3.48Å; E227-K231 VanDerWaalsContact O-CG 3.24Å; E227-K231 WeakPolarHBondContact O-CG 3.28Å; E227-K231 PolarHBondContact O-N 2.96Å; E227-K231 WeakPolarHBondContact OE1-CE 3.38Å; E227-K231 IonicContact OE1-NZ 2.65Å; E227-K231 PolarHBondContact OE1-NZ 3.47Å; Y228-K231 PolarHBondContact O-N 2.91Å; L229-K231 VanDerWaalsContact C-N 3.27Å; L229-K231 PolarHBondContact O-N 3.16Å |
| 232 | R | 75.7 | Confident | 79.8 | Confident | 192 Ų | 192 | 107.1 Ų | 107.1 | 73% | 0.725 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -83 | -39.4 | 179.1 | -171.3 | 178.1 | 172.8 | -176.6 | -3.5 | 111.9 | Y228 L229 K230 V234 | Y228-R232 PolarHBondContact O-N 3.45Å; Y228-R232 VanDerWaalsContact O-N 3.14Å; L229-R232 CarbonylContact O-C 3.56Å; L229-R232 WeakPolarHBondContact O-CA 3.38Å; L229-R232 WeakPolarHBondContact O-CB 3.35Å; L229-R232 PolarHBondContact O-N 3.04Å; K230-R232 VanDerWaalsContact C-N 3.33Å; R232-V234 PolarHBondContact O-N 3.35Å |
| 233 | E | 63.9 | Low | 79.8 | Confident | 101 Ų | 101 | 108.7 Ų | 108.7 | 47% | 0.472 | 54% | 0.536 | S | S | . | . | S | Bend | trans | -85.4 | 108.3 | 175.3 | -67.2 | -179.9 | 173.3 | 0 | 0 | 109.1 | L229 S235 L236 | L229-E233 PolarHBondContact O-N 3.09Å; E233-S235 VanDerWaalsContact C-N 3.34Å; E233-S235 PolarHBondContact O-N 3.33Å; E233-L236 VanDerWaalsContact OE2-CD1 3.3Å; E233-L236 WeakPolarHBondContact OE2-CD1 3.36Å |
| 234 | V | 58.3 | Low | 80.1 | Confident | 135 Ų | 135 | 110.9 Ų | 110.9 | 82% | 0.818 | 54% | 0.544 | S | S | * | . | trans | -58.1 | 95.8 | 179.3 | -178.5 | 0 | 0 | 0 | 0 | 109.3 | R232 L236 | R232-V234 PolarHBondContact O-N 3.35Å; V234-L236 PolarHBondContact O-N 3.23Å | ||
| 235 | S | 56.6 | Low | 80.1 | Confident | 91 Ų | 91 | 108.3 Ų | 108.3 | 64% | 0.636 | 53% | 0.534 | S | S | * | . | trans | 35.8 | 75.9 | 168 | 61.1 | 0 | 0 | 0 | 0 | 113.6 | E233 Q237 | E233-S235 VanDerWaalsContact C-N 3.34Å; E233-S235 PolarHBondContact O-N 3.33Å; S235-Q237 PolarHBondContact O-N 3.49Å | ||
| 236 | L | 56.6 | Low | 80.3 | Confident | 137 Ų | 137 | 108.2 Ų | 108.2 | 72% | 0.717 | 53% | 0.533 | S | S | * | . | trans | -52.6 | 108.2 | 163.6 | -69.1 | 172.8 | 0 | 0 | 0 | 107 | E233 V234 C238 | E233-L236 VanDerWaalsContact OE2-CD1 3.3Å; E233-L236 WeakPolarHBondContact OE2-CD1 3.36Å; V234-L236 PolarHBondContact O-N 3.23Å; L236-C238 PolarHBondContact O-N 2.86Å | ||
| 237 | Q | 63.1 | Low | 80.6 | Confident | 105 Ų | 105 | 110.5 Ų | 110.5 | 49% | 0.491 | 55% | 0.547 | S | S | . | . | trans | -55.9 | 133.7 | 177.2 | -64.1 | 175.3 | -8.9 | 0 | 0 | 106.2 | S235 E242 | S235-Q237 PolarHBondContact O-N 3.49Å; Q237-E242 HydrophobicContact CB-CG 4.25Å | ||
| 238 | C | 73.1 | Confident | 81 | Confident | 71 Ų | 71 | 110.4 Ų | 110.4 | 48% | 0.48 | 55% | 0.549 | S | S | . | . | trans | -57 | 132.8 | -179.8 | -40.3 | 0 | 0 | 0 | 0 | 107.5 | L236 A240 H241 E242 | L236-C238 PolarHBondContact O-N 2.86Å; C238-A240 PolarHBondContact O-N 3.12Å; C238-H241 WeakPolarHBondContact CB-ND1 3.41Å; C238-H241 WeakPolarHBondContact O-CA 3.35Å; C238-H241 WeakPolarHBondContact O-CB 3.46Å; C238-H241 PolarHBondContact O-N 3.36Å; C238-E242 PolarHBondContact O-N 2.9Å | ||
| 239 | P | 84.3 | Confident | 81.4 | Confident | 91 Ų | 91 | 110 Ų | 110 | 59% | 0.591 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -55 | -34 | -175.1 | 19.4 | -32 | 0 | 0 | 0 | 111.7 | H241 E242 E243 | P239-H241 VanDerWaalsContact C-N 3.29Å; P239-H241 PolarHBondContact O-N 3.34Å; P239-E242 WeakPolarHBondContact O-CA 3.38Å; P239-E242 WeakPolarHBondContact O-CB 3.44Å; P239-E242 PolarHBondContact O-N 3.06Å; P239-E243 WeakPolarHBondContact O-CG 3.5Å; P239-E243 PolarHBondContact O-N 2.92Å |
| 240 | A | 87.6 | Confident | 81.9 | Confident | 49 Ų | 49 | 110.9 Ų | 110.9 | 41% | 0.405 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -55.3 | -38 | 171.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | C238 I244 | C238-A240 PolarHBondContact O-N 3.12Å; A240-I244 WeakPolarHBondContact O-CB 3.49Å; A240-I244 WeakPolarHBondContact O-CD1 3.39Å; A240-I244 WeakPolarHBondContact O-CG1 3.33Å; A240-I244 PolarHBondContact O-N 2.77Å |
| 241 | H | 88.7 | Confident | 82.5 | Confident | 103 Ų | 103 | 108.3 Ų | 108.3 | 48% | 0.477 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -70.5 | -31.7 | 175.7 | -72 | 90.9 | 0 | 0 | 0 | 112.2 | C238 P239 R245 | C238-H241 WeakPolarHBondContact CB-ND1 3.41Å; C238-H241 WeakPolarHBondContact O-CA 3.35Å; C238-H241 WeakPolarHBondContact O-CB 3.46Å; C238-H241 PolarHBondContact O-N 3.36Å; P239-H241 VanDerWaalsContact C-N 3.29Å; P239-H241 PolarHBondContact O-N 3.34Å; H241-R245 WeakPolarHBondContact O-CB 3.34Å; H241-R245 VanDerWaalsContact O-CG 3.28Å; H241-R245 WeakPolarHBondContact O-CG 3.4Å; H241-R245 VanDerWaalsContact O-CZ 3.32Å; H241-R245 PolarHBondContact O-N 3.08Å |
| 242 | E | 90.4 | Very high | 83.4 | Confident | 88 Ų | 88 | 104.9 Ų | 104.9 | 41% | 0.411 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -70 | -44.5 | 174.5 | -68.3 | -179.5 | -179.7 | 0 | 0 | 110.7 | Q237 C238 P239 R245 Q246 | Q237-E242 HydrophobicContact CB-CG 4.25Å; C238-E242 PolarHBondContact O-N 2.9Å; P239-E242 WeakPolarHBondContact O-CA 3.38Å; P239-E242 WeakPolarHBondContact O-CB 3.44Å; P239-E242 PolarHBondContact O-N 3.06Å; E242-R245 WeakPolarHBondContact O-CB 3.32Å; E242-R245 PolarHBondContact O-N 3.19Å; E242-Q246 WeakPolarHBondContact O-CG 3.37Å; E242-Q246 PolarHBondContact O-N 3.37Å |
| 243 | E | 93.9 | Very high | 84.3 | Confident | 116 Ų | 116 | 102.4 Ų | 102.4 | 54% | 0.542 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -58.3 | -48.7 | 173.1 | -69.5 | 170.9 | -164.2 | 0 | 0 | 111.3 | P239 R245 Q246 L247 | P239-E243 WeakPolarHBondContact O-CG 3.5Å; P239-E243 PolarHBondContact O-N 2.92Å; E243-R245 VanDerWaalsContact C-N 3.31Å; E243-R245 PolarHBondContact O-N 3.23Å; E243-Q246 PolarHBondContact O-N 3.37Å; E243-Q246 VanDerWaalsContact O-N 3.15Å; E243-L247 WeakPolarHBondContact O-CG 3.48Å; E243-L247 PolarHBondContact O-N 3.19Å |
| 244 | I | 94.7 | Very high | 85.8 | Confident | 104 Ų | 104 | 104 Ų | 104 | 53% | 0.533 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -59.6 | -43.5 | 175.5 | -69.1 | 162.4 | 0 | 0 | 0 | 110.4 | A240 Q246 L247 L248 | A240-I244 WeakPolarHBondContact O-CB 3.49Å; A240-I244 WeakPolarHBondContact O-CD1 3.39Å; A240-I244 WeakPolarHBondContact O-CG1 3.33Å; A240-I244 PolarHBondContact O-N 2.77Å; I244-Q246 VanDerWaalsContact C-N 3.32Å; I244-Q246 PolarHBondContact O-N 3.5Å; I244-L247 PolarHBondContact O-N 3.45Å; I244-L248 WeakPolarHBondContact O-CB 3.43Å; I244-L248 PolarHBondContact O-N 3.33Å |
| 245 | R | 93.4 | Very high | 87.6 | Confident | 92 Ų | 92 | 101.1 Ų | 101.1 | 35% | 0.347 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62 | -38.7 | 177 | -83.2 | -172.1 | -69 | -82.3 | -5 | 112.1 | H241 E242 E243 K249 | H241-R245 WeakPolarHBondContact O-CB 3.34Å; H241-R245 VanDerWaalsContact O-CG 3.28Å; H241-R245 WeakPolarHBondContact O-CG 3.4Å; H241-R245 VanDerWaalsContact O-CZ 3.32Å; H241-R245 PolarHBondContact O-N 3.08Å; E242-R245 WeakPolarHBondContact O-CB 3.32Å; E242-R245 PolarHBondContact O-N 3.19Å; E243-R245 VanDerWaalsContact C-N 3.31Å; E243-R245 PolarHBondContact O-N 3.23Å; R245-K249 VanDerWaalsContact O-CG 3.25Å; R245-K249 WeakPolarHBondContact O-CG 3.29Å; R245-K249 PolarHBondContact O-N 3.29Å; R245-K249 VanDerWaalsContact O-N 3.09Å |
| 246 | Q | 94.4 | Very high | 89.5 | Confident | 120 Ų | 120 | 97.5 Ų | 97.5 | 56% | 0.561 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -67.8 | -51.7 | 176.9 | -71.5 | 174.3 | 7.5 | 0 | 0 | 111 | E242 E243 I244 L248 K249 D250 | E242-Q246 WeakPolarHBondContact O-CG 3.37Å; E242-Q246 PolarHBondContact O-N 3.37Å; E243-Q246 PolarHBondContact O-N 3.37Å; E243-Q246 VanDerWaalsContact O-N 3.15Å; I244-Q246 VanDerWaalsContact C-N 3.32Å; I244-Q246 PolarHBondContact O-N 3.5Å; Q246-L248 VanDerWaalsContact C-N 3.26Å; Q246-L248 PolarHBondContact O-N 2.76Å; Q246-K249 WeakPolarHBondContact O-CB 3.35Å; Q246-K249 PolarHBondContact O-N 3.46Å; Q246-K249 VanDerWaalsContact O-N 3.08Å; Q246-D250 PolarHBondContact O-N 3.04Å |
| 247 | L | 96.5 | Very high | 91.4 | Very high | 118 Ų | 118 | 93.3 Ų | 93.3 | 62% | 0.618 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -58.6 | -38.5 | 177 | -69.5 | 174.4 | 0 | 0 | 0 | 112.3 | E243 I244 D250 L251 | E243-L247 WeakPolarHBondContact O-CG 3.48Å; E243-L247 PolarHBondContact O-N 3.19Å; I244-L247 PolarHBondContact O-N 3.45Å; L247-D250 PolarHBondContact O-N 3.47Å; L247-L251 VanDerWaalsContact O-CB 3.26Å; L247-L251 WeakPolarHBondContact O-CB 3.48Å; L247-L251 PolarHBondContact O-N 3.32Å |
| 248 | L | 95.8 | Very high | 92.9 | Very high | 81 Ų | 81 | 95.3 Ų | 95.3 | 42% | 0.424 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -65.5 | -41.3 | 176.8 | -171 | 78.6 | 0 | 0 | 0 | 111.5 | I244 Q246 L251 F252 | I244-L248 WeakPolarHBondContact O-CB 3.43Å; I244-L248 PolarHBondContact O-N 3.33Å; Q246-L248 VanDerWaalsContact C-N 3.26Å; Q246-L248 PolarHBondContact O-N 2.76Å; L248-L251 PolarHBondContact O-N 2.85Å; L248-F252 HydrophobicContact CD1-CD2 4.08Å; L248-F252 HydrophobicContact CD1-CE2 3.46Å; L248-F252 VanDerWaalsContact CD1-CE2 3.46Å; L248-F252 HydrophobicContact CD1-CZ 4.02Å; L248-F252 HydrophobicContact CD2-CD2 4.34Å; L248-F252 HydrophobicContact CD2-CE2 3.84Å; L248-F252 HydrophobicContact CG-CD2 3.69Å; L248-F252 HydrophobicContact CG-CE2 3.42Å; L248-F252 VanDerWaalsContact CG-CE2 3.42Å; L248-F252 HydrophobicContact CG-CZ 4.44Å; L248-F252 WeakPolarHBondContact O-CB 3.36Å; L248-F252 WeakPolarHBondContact O-CD2 3.1Å; L248-F252 PolarHBondContact O-N 3.14Å |
| 249 | K | 94.8 | Very high | 94 | Very high | 148 Ų | 148 | 95 Ų | 95 | 64% | 0.643 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -61.9 | -45.4 | 174.1 | -75.3 | 172.4 | -177.5 | -174.4 | 0 | 110.9 | R245 Q246 F252 F253 | R245-K249 VanDerWaalsContact O-CG 3.25Å; R245-K249 WeakPolarHBondContact O-CG 3.29Å; R245-K249 PolarHBondContact O-N 3.29Å; R245-K249 VanDerWaalsContact O-N 3.09Å; Q246-K249 WeakPolarHBondContact O-CB 3.35Å; Q246-K249 PolarHBondContact O-N 3.46Å; Q246-K249 VanDerWaalsContact O-N 3.08Å; K249-F252 PolarHBondContact O-N 3.02Å; K249-F253 WeakPolarHBondContact O-CB 3.4Å; K249-F253 PolarHBondContact O-N 3.16Å |
| 250 | D | 97 | Very high | 94.4 | Very high | 92 Ų | 92 | 96.2 Ų | 96.2 | 49% | 0.492 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -65.6 | -40.4 | 178.9 | -69.3 | -5.7 | 0 | 0 | 0 | 112.2 | Q246 L247 K254 | Q246-D250 PolarHBondContact O-N 3.04Å; L247-D250 PolarHBondContact O-N 3.47Å; D250-K254 WeakPolarHBondContact O-CG 3.29Å; D250-K254 PolarHBondContact O-N 3.48Å; D250-K254 VanDerWaalsContact O-N 3.16Å |
| 251 | L | 96.8 | Very high | 94.7 | Very high | 90 Ų | 90 | 99.5 Ų | 99.5 | 47% | 0.471 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.1 | -50.5 | 176.4 | 177.7 | 63.5 | 0 | 0 | 0 | 111 | L247 L248 F253 K254 L255 | L247-L251 VanDerWaalsContact O-CB 3.26Å; L247-L251 WeakPolarHBondContact O-CB 3.48Å; L247-L251 PolarHBondContact O-N 3.32Å; L248-L251 PolarHBondContact O-N 2.85Å; L251-F253 VanDerWaalsContact C-N 3.32Å; L251-F253 PolarHBondContact O-N 3.32Å; L251-K254 PolarHBondContact O-N 3.38Å; L251-K254 VanDerWaalsContact O-N 3.16Å; L251-L255 HydrophobicContact CD1-CD1 4.23Å; L251-L255 HydrophobicContact CD1-CG 4.3Å; L251-L255 HydrophobicContact CG-CD1 4.04Å; L251-L255 HydrophobicContact CG-CG 4.47Å; L251-L255 WeakPolarHBondContact O-CG 3.22Å; L251-L255 PolarHBondContact O-N 3.39Å |
| 252 | F | 95.2 | Very high | 95 | Very high | 78 Ų | 78 | 102 Ų | 102 | 34% | 0.342 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.3 | -38.2 | 178.9 | -76.7 | -50.3 | 0 | 0 | 0 | 111.7 | L248 K249 K254 L255 D256 | L248-F252 HydrophobicContact CD1-CD2 4.08Å; L248-F252 HydrophobicContact CD1-CE2 3.46Å; L248-F252 VanDerWaalsContact CD1-CE2 3.46Å; L248-F252 HydrophobicContact CD1-CZ 4.02Å; L248-F252 HydrophobicContact CD2-CD2 4.34Å; L248-F252 HydrophobicContact CD2-CE2 3.84Å; L248-F252 HydrophobicContact CG-CD2 3.69Å; L248-F252 HydrophobicContact CG-CE2 3.42Å; L248-F252 VanDerWaalsContact CG-CE2 3.42Å; L248-F252 HydrophobicContact CG-CZ 4.44Å; L248-F252 WeakPolarHBondContact O-CB 3.36Å; L248-F252 WeakPolarHBondContact O-CD2 3.1Å; L248-F252 PolarHBondContact O-N 3.14Å; K249-F252 PolarHBondContact O-N 3.02Å; F252-K254 VanDerWaalsContact C-N 3.26Å; F252-K254 PolarHBondContact O-N 2.82Å; F252-L255 HydrophobicContact CD1-CD1 4.26Å; F252-L255 PolarHBondContact O-N 3.11Å; F252-D256 WeakPolarHBondContact O-CB 3.46Å; F252-D256 PolarHBondContact O-N 2.71Å |
| 253 | F | 94.5 | Very high | 95.1 | Very high | 141 Ų | 141 | 102.4 Ų | 102.4 | 62% | 0.618 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -57.8 | -40.6 | 174 | -175 | -100.2 | 0 | 0 | 0 | 112.3 | K249 L251 A257 | K249-F253 WeakPolarHBondContact O-CB 3.4Å; K249-F253 PolarHBondContact O-N 3.16Å; L251-F253 VanDerWaalsContact C-N 3.32Å; L251-F253 PolarHBondContact O-N 3.32Å; F253-A257 WeakPolarHBondContact O-CB 3.3Å; F253-A257 PolarHBondContact O-N 3.12Å; F253-A257 VanDerWaalsContact O-N 3.08Å |
| 254 | K | 96.7 | Very high | 95 | Very high | 135 Ų | 135 | 103 Ų | 103 | 59% | 0.587 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -68.5 | -43.5 | 175.4 | -68.6 | 168.7 | -173 | 173.4 | 0 | 112.5 | D250 L251 F252 A257 L258 | D250-K254 WeakPolarHBondContact O-CG 3.29Å; D250-K254 PolarHBondContact O-N 3.48Å; D250-K254 VanDerWaalsContact O-N 3.16Å; L251-K254 PolarHBondContact O-N 3.38Å; L251-K254 VanDerWaalsContact O-N 3.16Å; F252-K254 VanDerWaalsContact C-N 3.26Å; F252-K254 PolarHBondContact O-N 2.82Å; K254-A257 PolarHBondContact O-N 3.38Å; K254-L258 WeakPolarHBondContact O-CB 3.27Å; K254-L258 VanDerWaalsContact O-CG 3.29Å; K254-L258 WeakPolarHBondContact O-CG 3.42Å; K254-L258 PolarHBondContact O-N 2.81Å |
| 255 | L | 96.4 | Very high | 94.8 | Very high | 74 Ų | 74 | 103.3 Ų | 103.3 | 39% | 0.387 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -66.4 | -42.7 | 178.4 | -69.8 | 175.3 | 0 | 0 | 0 | 111.9 | L251 F252 A257 L258 T259 | L251-L255 HydrophobicContact CD1-CD1 4.23Å; L251-L255 HydrophobicContact CD1-CG 4.3Å; L251-L255 HydrophobicContact CG-CD1 4.04Å; L251-L255 HydrophobicContact CG-CG 4.47Å; L251-L255 WeakPolarHBondContact O-CG 3.22Å; L251-L255 PolarHBondContact O-N 3.39Å; F252-L255 HydrophobicContact CD1-CD1 4.26Å; F252-L255 PolarHBondContact O-N 3.11Å; L255-A257 VanDerWaalsContact C-N 3.29Å; L255-A257 PolarHBondContact O-N 2.9Å; L255-L258 PolarHBondContact O-N 3.5Å; L255-T259 WeakPolarHBondContact O-CB 3.43Å; L255-T259 VanDerWaalsContact O-CG2 3.31Å; L255-T259 WeakPolarHBondContact O-CG2 3.3Å; L255-T259 PolarHBondContact O-N 2.9Å; L255-T259 PolarHBondContact O-OG1 2.81Å |
| 256 | D | 96 | Very high | 94.5 | Very high | 15 Ų | 15 | 107 Ų | 107 | 8% | 0.08 | 53% | 0.533 | C | S | . | . | H | α-helix | trans | -60.5 | -42 | 176 | -65.3 | -8.6 | 0 | 0 | 0 | 109.5 | F252 T259 N260 F261 Y263 R266 | F252-D256 WeakPolarHBondContact O-CB 3.46Å; F252-D256 PolarHBondContact O-N 2.71Å; D256-T259 WeakPolarHBondContact CA-OG1 3.45Å; D256-T259 PolarHBondContact O-N 3.5Å; D256-T259 PolarHBondContact O-OG1 3.37Å; D256-T259 VanDerWaalsContact O-OG1 3.05Å; D256-N260 PolarHBondContact O-N 3.32Å; D256-F261 HydrophobicContact CB-CD1 4.22Å; D256-F261 HydrophobicContact CB-CE1 4.27Å; D256-F261 WeakPolarHBondContact O-CA 3.34Å; D256-F261 PolarHBondContact O-N 2.98Å; D256-Y263 HydrophobicContact CB-CD1 3.97Å; D256-Y263 HydrophobicContact CB-CE1 3.68Å; D256-R266 IonicContact OD2-NH1 3.92Å |
| 257 | A | 96 | Very high | 94.2 | Very high | 49 Ų | 49 | 106.3 Ų | 106.3 | 41% | 0.405 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -67.5 | -41.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | F253 K254 L255 T259 N260 F261 | F253-A257 WeakPolarHBondContact O-CB 3.3Å; F253-A257 PolarHBondContact O-N 3.12Å; F253-A257 VanDerWaalsContact O-N 3.08Å; K254-A257 PolarHBondContact O-N 3.38Å; L255-A257 VanDerWaalsContact C-N 3.29Å; L255-A257 PolarHBondContact O-N 2.9Å; A257-T259 VanDerWaalsContact C-N 3.27Å; A257-T259 PolarHBondContact O-N 3.34Å; A257-N260 PolarHBondContact O-N 3.48Å; A257-F261 HydrophobicContact CB-CZ 4.47Å |
| 258 | L | 95.3 | Very high | 93.7 | Very high | 146 Ų | 146 | 107 Ų | 107 | 76% | 0.764 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -64.6 | -31.8 | 177.2 | -76.2 | 170.7 | 0 | 0 | 0 | 112.7 | K254 L255 N260 | K254-L258 WeakPolarHBondContact O-CB 3.27Å; K254-L258 VanDerWaalsContact O-CG 3.29Å; K254-L258 WeakPolarHBondContact O-CG 3.42Å; K254-L258 PolarHBondContact O-N 2.81Å; L255-L258 PolarHBondContact O-N 3.5Å; L258-N260 VanDerWaalsContact C-N 3.26Å; L258-N260 PolarHBondContact O-N 2.98Å |
| 259 | T | 95 | Very high | 93.2 | Very high | 66 Ų | 66 | 108.3 Ų | 108.3 | 41% | 0.405 | 56% | 0.561 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -86.8 | 9.1 | 178 | 56.5 | 0 | 0 | 0 | 0 | 113.1 | L255 D256 A257 F261 H262 | L255-T259 WeakPolarHBondContact O-CB 3.43Å; L255-T259 VanDerWaalsContact O-CG2 3.31Å; L255-T259 WeakPolarHBondContact O-CG2 3.3Å; L255-T259 PolarHBondContact O-N 2.9Å; L255-T259 PolarHBondContact O-OG1 2.81Å; D256-T259 WeakPolarHBondContact CA-OG1 3.45Å; D256-T259 PolarHBondContact O-N 3.5Å; D256-T259 PolarHBondContact O-OG1 3.37Å; D256-T259 VanDerWaalsContact O-OG1 3.05Å; A257-T259 VanDerWaalsContact C-N 3.27Å; A257-T259 PolarHBondContact O-N 3.34Å; T259-F261 PolarHBondContact O-N 3.28Å; T259-H262 PolarHBondContact O-N 2.84Å; T259-H262 VanDerWaalsContact O-N 3.16Å |
| 260 | N | 94.1 | Very high | 92.7 | Very high | 116 Ų | 116 | 107.1 Ų | 107.1 | 62% | 0.62 | 57% | 0.568 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 53.5 | 36.2 | -175.6 | -167.9 | 45.8 | 0 | 0 | 0 | 112.7 | D256 A257 L258 H262 | D256-N260 PolarHBondContact O-N 3.32Å; A257-N260 PolarHBondContact O-N 3.48Å; L258-N260 VanDerWaalsContact C-N 3.26Å; L258-N260 PolarHBondContact O-N 2.98Å; N260-H262 VanDerWaalsContact C-N 3.26Å; N260-H262 PolarHBondContact O-N 3.28Å |
| 261 | F | 92.8 | Very high | 92 | Very high | 117 Ų | 117 | 111.5 Ų | 111.5 | 51% | 0.513 | 59% | 0.586 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 60.8 | 24.2 | -178.7 | -59 | -91.3 | 0 | 0 | 0 | 115.4 | D256 A257 T259 Y263 | D256-F261 HydrophobicContact CB-CD1 4.22Å; D256-F261 HydrophobicContact CB-CE1 4.27Å; D256-F261 WeakPolarHBondContact O-CA 3.34Å; D256-F261 PolarHBondContact O-N 2.98Å; A257-F261 HydrophobicContact CB-CZ 4.47Å; T259-F261 PolarHBondContact O-N 3.28Å; F261-Y263 HydrophobicContact CB-CE1 4.12Å; F261-Y263 AromaticContact CD1-CE1 3.98Å; F261-Y263 HydrophobicContact CD1-CE1 3.98Å; F261-Y263 PolarHBondContact O-N 3.21Å |
| 262 | H | 96.1 | Very high | 91.4 | Very high | 155 Ų | 155 | 116.1 Ų | 116.1 | 72% | 0.718 | 60% | 0.602 | S | S | * | * | trans | -93.5 | 73.3 | 172.9 | -62.9 | -57.7 | 0 | 0 | 0 | 112 | T259 N260 | T259-H262 PolarHBondContact O-N 2.84Å; T259-H262 VanDerWaalsContact O-N 3.16Å; N260-H262 VanDerWaalsContact C-N 3.26Å; N260-H262 PolarHBondContact O-N 3.28Å | ||
| 263 | Y | 91.5 | Very high | 90.9 | Very high | 97 Ų | 97 | 116.7 Ų | 116.7 | 38% | 0.38 | 62% | 0.622 | S | S | . | * | S | Bend | trans | -134.3 | 165.4 | -179.7 | 62.9 | -84.2 | 0 | 0 | 0 | 112.4 | D256 F261 | D256-Y263 HydrophobicContact CB-CD1 3.97Å; D256-Y263 HydrophobicContact CB-CE1 3.68Å; F261-Y263 HydrophobicContact CB-CE1 4.12Å; F261-Y263 AromaticContact CD1-CE1 3.98Å; F261-Y263 HydrophobicContact CD1-CE1 3.98Å; F261-Y263 PolarHBondContact O-N 3.21Å |
| 264 | T | 91.7 | Very high | 90.5 | Very high | 130 Ų | 130 | 116.4 Ų | 116.4 | 80% | 0.798 | 63% | 0.631 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 122.4 | 173.6 | 52.7 | 0 | 0 | 0 | 0 | 110.1 | ||
| 265 | P | 90 | Very high | 89.9 | Confident | 110 Ų | 110 | 114.1 Ų | 114.1 | 71% | 0.714 | 63% | 0.628 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 150.9 | -177.3 | 26.6 | -34.8 | 0 | 0 | 0 | 111.5 | ||
| 266 | R | 88 | Confident | 89.5 | Confident | 170 Ų | 170 | 114.1 Ų | 114.1 | 64% | 0.642 | 63% | 0.634 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 144.4 | 179 | -69.5 | -176.2 | -77.2 | -88.8 | 2.5 | 110.7 | D256 | D256-R266 IonicContact OD2-NH1 3.92Š|
| 267 | P | 88 | Confident | 89.2 | Confident | 105 Ų | 105 | 117.7 Ų | 117.7 | 68% | 0.682 | 65% | 0.653 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 143.5 | 176.4 | 26.4 | -34.4 | 0 | 0 | 0 | 110.3 | V269 | P267-V269 PolarHBondContact O-N 2.87Š|
| 268 | P | 86.1 | Confident | 88.9 | Confident | 132 Ų | 132 | 118.7 Ų | 118.7 | 86% | 0.857 | 65% | 0.651 | S | S | * | * | trans | -66.9 | 108.6 | -176.6 | 27 | -33.8 | 0 | 0 | 0 | 110 | ||||
| 269 | V | 84.8 | Confident | 88.7 | Confident | 108 Ų | 108 | 115 Ų | 115 | 66% | 0.655 | 64% | 0.635 | S | S | * | * | trans | -83.6 | 131.4 | 170.1 | -180 | 0 | 0 | 0 | 0 | 107.4 | P267 E271 | P267-V269 PolarHBondContact O-N 2.87Å; V269-E271 PolarHBondContact O-N 3.39Å | ||
| 270 | P | 85 | Confident | 88.4 | Confident | 124 Ų | 124 | 113.1 Ų | 113.1 | 81% | 0.805 | 63% | 0.625 | S | S | * | * | trans | -66.3 | 103.4 | 177.7 | 26.6 | -33.6 | 0 | 0 | 0 | 110.1 | ||||
| 271 | E | 83.2 | Confident | 88.2 | Confident | 183 Ų | 183 | 111.4 Ų | 111.4 | 86% | 0.855 | 62% | 0.615 | S | S | * | * | P | Polyproline II helix | trans | -88.2 | 135.2 | 172.4 | -65 | 179.6 | -179.4 | 0 | 0 | 109.4 | V269 | V269-E271 PolarHBondContact O-N 3.39Š|
| 272 | F | 83.8 | Confident | 88.1 | Confident | 187 Ų | 187 | 109.8 Ų | 109.8 | 82% | 0.82 | 62% | 0.615 | S | S | * | * | P | Polyproline II helix | trans | -103.5 | 118.5 | 173.4 | 65.9 | -86.6 | 0 | 0 | 0 | 108.8 | V274 | F272-V274 HydrophobicContact CD2-CG2 4.23Š|
| 273 | A | 84.6 | Confident | 87.7 | Confident | 91 Ų | 91 | 109.3 Ų | 109.3 | 75% | 0.752 | 61% | 0.614 | S | S | * | * | P | Polyproline II helix | trans | -99.6 | 123.9 | 171.2 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||
| 274 | V | 85.5 | Confident | 87.6 | Confident | 135 Ų | 135 | 107.5 Ų | 107.5 | 82% | 0.818 | 61% | 0.609 | S | S | * | * | trans | -89.4 | 107.9 | 173.9 | -178.2 | 0 | 0 | 0 | 0 | 108 | F272 | F272-V274 HydrophobicContact CD2-CG2 4.23Š| ||
| 275 | V | 84.1 | Confident | 87.6 | Confident | 87 Ų | 87 | 110 Ų | 110 | 53% | 0.527 | 61% | 0.612 | S | S | . | * | trans | -96.7 | 124.9 | 178.1 | -177.4 | 0 | 0 | 0 | 0 | 109.4 | L297 | V275-L297 HydrophobicContact CG1-CD2 4.4Š| ||
| 276 | S | 87.8 | Confident | 87.6 | Confident | 73 Ų | 73 | 112.5 Ų | 112.5 | 51% | 0.51 | 63% | 0.625 | S | S | . | * | trans | -83 | 152.4 | 173.2 | 45.4 | 0 | 0 | 0 | 0 | 111.8 | M278 T296 | S276-M278 PolarHBondContact O-N 3.16Å; S276-T296 PolarHBondContact O-OG1 3.34Å | ||
| 277 | N | 90 | Very high | 87.7 | Confident | 90 Ų | 90 | 107.3 Ų | 107.3 | 48% | 0.481 | 62% | 0.618 | S | S | . | * | trans | -72.4 | 94.4 | 174.5 | -168 | 14.9 | 0 | 0 | 0 | 110.6 | L297 | N277-L297 HydrophobicContact CB-CD1 3.66Å; N277-L297 HydrophobicContact CB-CG 4.07Å | ||
| 278 | M | 89.7 | Confident | 87.8 | Confident | 71 Ų | 71 | 109 Ų | 109 | 35% | 0.35 | 63% | 0.629 | S | S | . | * | trans | -127 | 156.4 | 179.4 | -58.7 | -169.9 | 83.9 | 0 | 0 | 109.5 | S276 V282 T296 | S276-M278 PolarHBondContact O-N 3.16Å; M278-V282 HydrophobicContact CE-CB 4.37Å; M278-V282 HydrophobicContact CE-CG1 3.73Å; M278-V282 HydrophobicContact CE-CG2 4.32Å; M278-V282 HydrophobicContact SD-CG1 4.27Å; M278-T296 PolarHBondContact N-OG1 3.19Å; M278-T296 WeakPolarHBondContact O-CG2 3.43Å; M278-T296 PolarHBondContact O-N 3Å; M278-T296 PolarHBondContact O-OG1 3.01Å | ||
| 279 | P | 91.2 | Very high | 88 | Confident | 68 Ų | 68 | 108 Ų | 108 | 44% | 0.442 | 62% | 0.62 | S | S | . | * | B | Isolated β-bridge | trans | -60.6 | 140.9 | 166.8 | -19.3 | 32.1 | 0 | 0 | 0 | 110.2 | I281 V282 | P279-I281 PolarHBondContact O-N 3.35Å; P279-I281 VanDerWaalsContact O-N 3.12Å; P279-V282 PolarHBondContact O-N 3.38Å |
| 280 | S | 89.4 | Confident | 88.1 | Confident | 27 Ų | 27 | 106.6 Ų | 106.6 | 19% | 0.189 | 61% | 0.612 | C | S | . | * | G | 310 helix | trans | -55.2 | -31.5 | 179.3 | -68.6 | 0 | 0 | 0 | 0 | 112.8 | V282 M283 E284 A294 | S280-V282 PolarHBondContact O-N 3.07Å; S280-V282 VanDerWaalsContact O-N 3.08Å; S280-M283 WeakPolarHBondContact O-CB 3.5Å; S280-M283 PolarHBondContact O-N 2.96Å; S280-E284 PolarHBondContact O-N 3.44Å; S280-A294 WeakPolarHBondContact CB-O 3.42Å; S280-A294 PolarHBondContact N-O 3.07Å; S280-A294 PolarHBondContact OG-O 3.4Å |
| 281 | I | 89.3 | Confident | 88.2 | Confident | 79 Ų | 79 | 106.6 Ų | 106.6 | 41% | 0.405 | 61% | 0.61 | S | S | . | * | G | 310 helix | trans | -51.4 | -32.9 | 175.8 | -60.3 | 167.4 | 0 | 0 | 0 | 112.6 | P279 M283 E284 T290 S292 | P279-I281 PolarHBondContact O-N 3.35Å; P279-I281 VanDerWaalsContact O-N 3.12Å; I281-M283 VanDerWaalsContact C-N 3.28Å; I281-M283 PolarHBondContact O-N 3.27Å; I281-E284 PolarHBondContact O-N 3.45Å; I281-T290 HydrophobicContact CD1-CG2 4.44Å; I281-T290 HydrophobicContact CG1-CG2 4.34Å; I281-T290 HydrophobicContact CG2-CG2 4.28Å; I281-S292 WeakPolarHBondContact CG1-O 3.38Å |
| 282 | V | 89.7 | Confident | 88.3 | Confident | 84 Ų | 84 | 100.2 Ų | 100.2 | 51% | 0.509 | 59% | 0.585 | S | S | . | * | G | 310 helix | trans | -71.7 | -25.9 | 180 | -177.7 | 0 | 0 | 0 | 0 | 112.2 | M278 P279 S280 | M278-V282 HydrophobicContact CE-CB 4.37Å; M278-V282 HydrophobicContact CE-CG1 3.73Å; M278-V282 HydrophobicContact CE-CG2 4.32Å; M278-V282 HydrophobicContact SD-CG1 4.27Å; P279-V282 PolarHBondContact O-N 3.38Å; S280-V282 PolarHBondContact O-N 3.07Å; S280-V282 VanDerWaalsContact O-N 3.08Å |
| 283 | M | 89 | Confident | 88.5 | Confident | 144 Ų | 144 | 98.3 Ų | 98.3 | 71% | 0.709 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.3 | -13.8 | 179.1 | -60.5 | -60 | -59.8 | 0 | 0 | 112.7 | S280 I281 T296 | S280-M283 WeakPolarHBondContact O-CB 3.5Å; S280-M283 PolarHBondContact O-N 2.96Å; I281-M283 VanDerWaalsContact C-N 3.28Å; I281-M283 PolarHBondContact O-N 3.27Å; M283-T296 HydrophobicContact CG-CG2 4.11Å |
| 284 | E | 89.1 | Confident | 88.8 | Confident | 59 Ų | 59 | 96.6 Ų | 96.6 | 28% | 0.276 | 57% | 0.57 | S | S | . | * | S | Bend | trans | -74.7 | 153 | 177.9 | -71.8 | 179.3 | -168.3 | 0 | 0 | 111.1 | S280 I281 V291 S292 | S280-E284 PolarHBondContact O-N 3.44Å; I281-E284 PolarHBondContact O-N 3.45Å; E284-V291 PolarHBondContact OE2-N 3.42Å; E284-S292 PolarHBondContact OE1-N 3.1Å |
| 285 | E | 91.1 | Very high | 89.1 | Confident | 184 Ų | 184 | 94 Ų | 94 | 86% | 0.86 | 55% | 0.554 | S | S | * | * | trans | -65.3 | 152.6 | 171.8 | -63.3 | -179.5 | 178 | 0 | 0 | 110.3 | A287 | E285-A287 VanDerWaalsContact C-N 3.34Å; E285-A287 PolarHBondContact O-N 3.24Å | ||
| 286 | V | 90.4 | Very high | 89.3 | Confident | 161 Ų | 161 | 92 Ų | 92 | 98% | 0.976 | 54% | 0.542 | S | S | * | . | S | Bend | trans | -71 | 90.9 | -179.8 | -175.6 | 0 | 0 | 0 | 0 | 109.6 | ||
| 287 | A | 89.2 | Confident | 89.4 | Confident | 61 Ų | 61 | 90.4 Ų | 90.4 | 50% | 0.504 | 53% | 0.528 | S | S | . | . | trans | -117.3 | 152 | 175 | 0 | 0 | 0 | 0 | 0 | 110.3 | E285 V289 | E285-A287 VanDerWaalsContact C-N 3.34Å; E285-A287 PolarHBondContact O-N 3.24Å; A287-V289 PolarHBondContact O-N 3.36Å; A287-V289 VanDerWaalsContact O-N 3.17Å | ||
| 288 | P | 90.9 | Very high | 89.3 | Confident | 140 Ų | 140 | 88.1 Ų | 88.1 | 91% | 0.909 | 52% | 0.522 | S | S | * | . | S | Bend | trans | -68.3 | -10.3 | 179.2 | 26.8 | -34.4 | 0 | 0 | 0 | 114 | ||
| 289 | V | 90.3 | Very high | 89.4 | Confident | 111 Ų | 111 | 89.9 Ų | 89.9 | 67% | 0.673 | 54% | 0.538 | S | S | * | . | S | Bend | trans | -125.9 | 128.2 | 179.9 | 179.7 | 0 | 0 | 0 | 0 | 108.7 | A287 | A287-V289 PolarHBondContact O-N 3.36Å; A287-V289 VanDerWaalsContact O-N 3.17Å |
| 290 | T | 87.4 | Confident | 89.4 | Confident | 80 Ų | 80 | 91.5 Ų | 91.5 | 49% | 0.491 | 54% | 0.54 | S | S | . | . | trans | -84.4 | 141.9 | 175.4 | 56.6 | 0 | 0 | 0 | 0 | 110.3 | I281 | I281-T290 HydrophobicContact CD1-CG2 4.44Å; I281-T290 HydrophobicContact CG1-CG2 4.34Å; I281-T290 HydrophobicContact CG2-CG2 4.28Å | ||
| 291 | V | 86 | Confident | 89.4 | Confident | 124 Ų | 124 | 96.3 Ų | 96.3 | 75% | 0.752 | 56% | 0.559 | S | S | * | * | trans | -95 | -39.9 | -179.4 | -178.6 | 0 | 0 | 0 | 0 | 111.6 | E284 | E284-V291 PolarHBondContact OE2-N 3.42Š| ||
| 292 | S | 85.9 | Confident | 89.4 | Confident | 49 Ų | 49 | 97.4 Ų | 97.4 | 34% | 0.343 | 57% | 0.565 | S | S | . | * | trans | -136.3 | 137 | -171 | -65.1 | 0 | 0 | 0 | 0 | 114.9 | I281 E284 | I281-S292 WeakPolarHBondContact CG1-O 3.38Å; E284-S292 PolarHBondContact OE1-N 3.1Å | ||
| 293 | D | 88.7 | Confident | 89.4 | Confident | 146 Ų | 146 | 100.8 Ų | 100.8 | 78% | 0.781 | 57% | 0.573 | S | S | * | * | trans | -94.3 | 4.3 | 174.3 | -63.3 | -21.9 | 0 | 0 | 0 | 113.6 | ||||
| 294 | A | 90.4 | Very high | 89.4 | Confident | 56 Ų | 56 | 104.5 Ų | 104.5 | 46% | 0.463 | 58% | 0.579 | S | S | . | * | trans | -70.7 | 159.9 | -175.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | S280 | S280-A294 WeakPolarHBondContact CB-O 3.42Å; S280-A294 PolarHBondContact N-O 3.07Å; S280-A294 PolarHBondContact OG-O 3.4Å | ||
| 295 | T | 91.2 | Very high | 89.2 | Confident | 79 Ų | 79 | 111 Ų | 111 | 49% | 0.485 | 60% | 0.601 | S | S | . | * | B | Isolated β-bridge | trans | -91 | 150.8 | 167.5 | 54.9 | 0 | 0 | 0 | 0 | 110.6 | L297 | T295-L297 PolarHBondContact O-N 2.89Å; T295-L297 PolarHBondContact OG1-O 3.09Å |
| 296 | T | 88.5 | Confident | 88.9 | Confident | 45 Ų | 45 | 109 Ų | 109 | 28% | 0.276 | 59% | 0.591 | S | S | . | * | S | Bend | trans | -62.5 | -36.1 | -178.7 | 51.8 | 0 | 0 | 0 | 0 | 113.9 | S276 M278 M283 | S276-T296 PolarHBondContact O-OG1 3.34Å; M278-T296 PolarHBondContact N-OG1 3.19Å; M278-T296 WeakPolarHBondContact O-CG2 3.43Å; M278-T296 PolarHBondContact O-N 3Å; M278-T296 PolarHBondContact O-OG1 3.01Å; M283-T296 HydrophobicContact CG-CG2 4.11Å |
| 297 | L | 90 | Very high | 88.4 | Confident | 41 Ų | 41 | 112.7 Ų | 112.7 | 22% | 0.215 | 59% | 0.588 | C | S | . | * | S | Bend | trans | -90.3 | 142.7 | -179.3 | -64.5 | -173.8 | 0 | 0 | 0 | 112.4 | V275 N277 T295 E301 I302 | V275-L297 HydrophobicContact CG1-CD2 4.4Å; N277-L297 HydrophobicContact CB-CD1 3.66Å; N277-L297 HydrophobicContact CB-CG 4.07Å; T295-L297 PolarHBondContact O-N 2.89Å; T295-L297 PolarHBondContact OG1-O 3.09Å; L297-E301 WeakPolarHBondContact CA-OE2 3.29Å; L297-E301 WeakPolarHBondContact CD2-OE2 3.36Å; L297-I302 HydrophobicContact CB-CD1 4.4Å; L297-I302 HydrophobicContact CB-CG1 4.06Å; L297-I302 HydrophobicContact CD1-CG1 4.45Å |
| 298 | A | 88.9 | Confident | 87.6 | Confident | 42 Ų | 42 | 115.1 Ų | 115.1 | 35% | 0.347 | 58% | 0.584 | S | S | . | * | trans | -73.5 | 150.5 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | E300 E301 I302 | A298-E300 PolarHBondContact O-N 3.08Å; A298-E300 VanDerWaalsContact O-N 3.08Å; A298-E301 HydrophobicContact CB-CG 4.17Å; A298-E301 PolarHBondContact N-OE2 3.22Å; A298-E301 WeakPolarHBondContact O-CB 3.26Å; A298-E301 PolarHBondContact O-N 3.44Å; A298-I302 PolarHBondContact O-N 3.07Å; A298-I302 VanDerWaalsContact O-N 3.16Å | ||
| 299 | P | 90.4 | Very high | 87.2 | Confident | 107 Ų | 107 | 116.9 Ų | 116.9 | 70% | 0.695 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -55.2 | -30.4 | 175.3 | -27.4 | 35 | 0 | 0 | 0 | 114 | E301 K303 | P299-E301 VanDerWaalsContact C-N 3.35Å; P299-K303 PolarHBondContact O-N 3.35Å |
| 300 | E | 91 | Very high | 86.7 | Confident | 102 Ų | 102 | 117 Ų | 117 | 48% | 0.477 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -72.2 | -24.8 | 176.7 | -62.9 | -167 | 164.7 | 0 | 0 | 113.8 | A298 K303 R304 R305 | A298-E300 PolarHBondContact O-N 3.08Å; A298-E300 VanDerWaalsContact O-N 3.08Å; E300-K303 WeakPolarHBondContact CA-O 3.43Å; E300-K303 CarbonylContact O-C 3.35Å; E300-R304 WeakPolarHBondContact O-CA 3.17Å; E300-R304 PolarHBondContact O-N 2.98Å; E300-R305 HydrophobicContact CG-CG 4.42Å; E300-R305 VanDerWaalsContact OE1-CD 3.28Å; E300-R305 WeakPolarHBondContact OE1-CD 3.4Å; E300-R305 IonicContact OE1-CZ 2.78Å; E300-R305 IonicContact OE1-NE 3.77Å; E300-R305 PolarHBondContact OE1-NE 3.18Å; E300-R305 IonicContact OE1-NH1 3.79Å; E300-R305 PolarHBondContact OE1-NH1 3.36Å |
| 301 | E | 89.4 | Confident | 86.5 | Confident | 128 Ų | 128 | 116.3 Ų | 116.3 | 60% | 0.598 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -81.1 | -37 | 175.8 | -64.2 | 171.1 | 157.4 | 0 | 0 | 110.8 | L297 A298 P299 | L297-E301 WeakPolarHBondContact CA-OE2 3.29Å; L297-E301 WeakPolarHBondContact CD2-OE2 3.36Å; A298-E301 HydrophobicContact CB-CG 4.17Å; A298-E301 PolarHBondContact N-OE2 3.22Å; A298-E301 WeakPolarHBondContact O-CB 3.26Å; A298-E301 PolarHBondContact O-N 3.44Å; P299-E301 VanDerWaalsContact C-N 3.35Å |
| 302 | I | 89.1 | Confident | 86.6 | Confident | 103 Ų | 103 | 112.2 Ų | 112.2 | 53% | 0.528 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -68 | -48.8 | 172.7 | -59 | 171.1 | 0 | 0 | 0 | 110.2 | L297 A298 | L297-I302 HydrophobicContact CB-CD1 4.4Å; L297-I302 HydrophobicContact CB-CG1 4.06Å; L297-I302 HydrophobicContact CD1-CG1 4.45Å; A298-I302 PolarHBondContact O-N 3.07Å; A298-I302 VanDerWaalsContact O-N 3.16Å |
| 303 | K | 90.5 | Very high | 86.6 | Confident | 155 Ų | 155 | 114.5 Ų | 114.5 | 67% | 0.674 | 57% | 0.574 | S | S | * | * | S | Bend | trans | -133.6 | 108.5 | 178.1 | -173.9 | 179.2 | 179.8 | -179.5 | 0 | 110.3 | P299 E300 R305 | P299-K303 PolarHBondContact O-N 3.35Å; E300-K303 WeakPolarHBondContact CA-O 3.43Å; E300-K303 CarbonylContact O-C 3.35Å; K303-R305 PolarHBondContact O-N 3.09Å |
| 304 | R | 88.3 | Confident | 86.5 | Confident | 221 Ų | 221 | 115.9 Ų | 115.9 | 83% | 0.834 | 58% | 0.576 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 132.6 | 173.4 | -67.8 | -178.5 | 179.2 | 172.8 | 1.2 | 110.3 | E300 E306 | E300-R304 WeakPolarHBondContact O-CA 3.17Å; E300-R304 PolarHBondContact O-N 2.98Å; R304-E306 PolarHBondContact O-N 3.36Å |
| 305 | R | 85.6 | Confident | 86.5 | Confident | 196 Ų | 196 | 119.7 Ų | 119.7 | 74% | 0.74 | 59% | 0.585 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 126.2 | 171.5 | -72.5 | -179.8 | 162.5 | 170.2 | -11.1 | 110.5 | E300 K303 | E300-R305 HydrophobicContact CG-CG 4.42Å; E300-R305 VanDerWaalsContact OE1-CD 3.28Å; E300-R305 WeakPolarHBondContact OE1-CD 3.4Å; E300-R305 IonicContact OE1-CZ 2.78Å; E300-R305 IonicContact OE1-NE 3.77Å; E300-R305 PolarHBondContact OE1-NE 3.18Å; E300-R305 IonicContact OE1-NH1 3.79Å; E300-R305 PolarHBondContact OE1-NH1 3.36Å; K303-R305 PolarHBondContact O-N 3.09Å |
| 306 | E | 85.4 | Confident | 86.4 | Confident | 141 Ų | 141 | 117.2 Ų | 117.2 | 66% | 0.659 | 57% | 0.568 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 134.2 | 171.3 | -68.4 | -177.2 | -174.7 | 0 | 0 | 109.3 | R304 R308 | R304-E306 PolarHBondContact O-N 3.36Å; E306-R308 PolarHBondContact O-N 3.29Å |
| 307 | R | 78.7 | Confident | 86.4 | Confident | 239 Ų | 239 | 118.5 Ų | 118.5 | 90% | 0.902 | 58% | 0.576 | S | S | * | * | S | Bend | trans | -72.4 | -14.5 | -175.7 | -65.8 | -176.9 | 179.2 | -169 | -1.9 | 113.2 | ||
| 308 | R | 73 | Confident | 86.5 | Confident | 113 Ų | 113 | 121.6 Ų | 121.6 | 43% | 0.426 | 59% | 0.59 | S | S | . | * | S | Bend | trans | -154.5 | 151.4 | -176.8 | -59.9 | -174.3 | -168.9 | 171.5 | 5.1 | 108.3 | E306 | E306-R308 PolarHBondContact O-N 3.29Š|
| 309 | E | 81.9 | Confident | 86.7 | Confident | 176 Ų | 176 | 124.4 Ų | 124.4 | 82% | 0.822 | 60% | 0.602 | S | S | * | * | trans | -59.6 | 141.1 | 164.5 | -67.2 | 167.3 | -172.6 | 0 | 0 | 109.7 | S311 | E309-S311 PolarHBondContact O-N 3.3Š| ||
| 310 | P | 81.4 | Confident | 86.7 | Confident | 114 Ų | 114 | 122.2 Ų | 122.2 | 74% | 0.74 | 59% | 0.585 | S | S | * | * | trans | -64.4 | 119.7 | 176.1 | 26.9 | -33.1 | 0 | 0 | 0 | 109 | ||||
| 311 | S | 83.3 | Confident | 86.7 | Confident | 65 Ų | 65 | 122.5 Ų | 122.5 | 46% | 0.455 | 58% | 0.581 | S | S | . | * | trans | -127.4 | 130 | 175.1 | 170.1 | 0 | 0 | 0 | 0 | 109.3 | E309 N316 | E309-S311 PolarHBondContact O-N 3.3Å; S311-N316 PolarHBondContact OG-ND2 2.87Å; S311-N316 VanDerWaalsContact OG-ND2 3.17Å | ||
| 312 | A | 86.7 | Confident | 86.9 | Confident | 39 Ų | 39 | 121.9 Ų | 121.9 | 32% | 0.322 | 58% | 0.577 | S | S | . | * | trans | -74.2 | 148.3 | 179.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | E314 E315 N316 | A312-E314 PolarHBondContact O-N 3.4Å; A312-E314 VanDerWaalsContact O-N 3.15Å; A312-E315 HydrophobicContact CB-CG 4.08Å; A312-E315 PolarHBondContact N-OE2 3.43Å; A312-E315 PolarHBondContact O-N 3.48Å; A312-N316 PolarHBondContact O-ND2 3.02Å | ||
| 313 | P | 85.3 | Confident | 87.1 | Confident | 96 Ų | 96 | 125.4 Ų | 125.4 | 62% | 0.623 | 58% | 0.583 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.9 | -26 | 178.3 | 25.2 | -33.8 | 0 | 0 | 0 | 112.9 | R321 | P313-R321 PolarHBondContact O-NE 3.27Å; P313-R321 PolarHBondContact O-NH2 3.2Å |
| 314 | E | 87.5 | Confident | 87.1 | Confident | 176 Ų | 176 | 120.5 Ų | 120.5 | 82% | 0.822 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.8 | -36.8 | -180 | -64.8 | 177.7 | -175.1 | 0 | 0 | 113 | A312 N316 | A312-E314 PolarHBondContact O-N 3.4Å; A312-E314 VanDerWaalsContact O-N 3.15Å; E314-N316 VanDerWaalsContact C-N 3.28Å; E314-N316 PolarHBondContact O-N 2.95Å |
| 315 | E | 89.7 | Confident | 87.3 | Confident | 136 Ų | 136 | 118.1 Ų | 118.1 | 64% | 0.636 | 56% | 0.555 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.8 | -22.1 | 178.8 | -61.7 | 164.4 | 171.7 | 0 | 0 | 112.4 | A312 T317 | A312-E315 HydrophobicContact CB-CG 4.08Å; A312-E315 PolarHBondContact N-OE2 3.43Å; A312-E315 PolarHBondContact O-N 3.48Å; E315-T317 PolarHBondContact O-N 3.49Å |
| 316 | N | 88.9 | Confident | 87.7 | Confident | 27 Ų | 27 | 117 Ų | 117 | 14% | 0.144 | 55% | 0.551 | C | S | . | * | trans | -72.9 | 119.9 | -175 | -80.1 | -73.7 | 0 | 0 | 0 | 111.1 | S311 A312 E314 D320 R321 | S311-N316 PolarHBondContact OG-ND2 2.87Å; S311-N316 VanDerWaalsContact OG-ND2 3.17Å; A312-N316 PolarHBondContact O-ND2 3.02Å; E314-N316 VanDerWaalsContact C-N 3.28Å; E314-N316 PolarHBondContact O-N 2.95Å; N316-D320 HydrophobicContact CB-CB 4.45Å; N316-R321 HydrophobicContact CB-CG 3.86Å; N316-R321 PolarHBondContact O-NE 2.73Å; N316-R321 VanDerWaalsContact O-NE 3.1Å | ||
| 317 | T | 90.2 | Very high | 88.2 | Confident | 71 Ų | 71 | 115.6 Ų | 115.6 | 44% | 0.436 | 54% | 0.543 | S | S | . | . | trans | -60 | 156.5 | 170.2 | 70.4 | 0 | 0 | 0 | 0 | 111 | E315 T319 D320 R321 | E315-T317 PolarHBondContact O-N 3.49Å; T317-T319 PolarHBondContact O-N 3.35Å; T317-T319 VanDerWaalsContact O-N 3.13Å; T317-T319 PolarHBondContact OG1-OG1 3.4Å; T317-D320 PolarHBondContact O-N 3.44Å; T317-D320 VanDerWaalsContact OG1-CG 3.24Å; T317-D320 PolarHBondContact OG1-N 2.94Å; T317-D320 PolarHBondContact OG1-OD2 3.42Å; T317-R321 WeakPolarHBondContact O-CG 3.41Å; T317-R321 PolarHBondContact O-N 3.05Å | ||
| 318 | E | 91.3 | Very high | 88.9 | Confident | 107 Ų | 107 | 108.9 Ų | 108.9 | 50% | 0.5 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -56.2 | -30 | 175.9 | -76.2 | -61.4 | 130.6 | 0 | 0 | 112.9 | R321 K322 | E318-R321 IonicContact OE1-CZ 3.11Å; E318-R321 IonicContact OE1-NH1 2.7Å; E318-R321 PolarHBondContact OE1-NH1 2.67Å; E318-K322 VanDerWaalsContact O-CG 3.28Å; E318-K322 WeakPolarHBondContact O-CG 3.49Å; E318-K322 PolarHBondContact O-N 3.45Å |
| 319 | T | 92.3 | Very high | 90 | Very high | 100 Ų | 100 | 109.8 Ų | 109.8 | 61% | 0.613 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -71.7 | -40.9 | 177.1 | 63.5 | 0 | 0 | 0 | 0 | 111.4 | T317 K322 R323 | T317-T319 PolarHBondContact O-N 3.35Å; T317-T319 VanDerWaalsContact O-N 3.13Å; T317-T319 PolarHBondContact OG1-OG1 3.4Å; T319-K322 PolarHBondContact O-N 2.94Å; T319-R323 WeakPolarHBondContact O-CB 3.36Å; T319-R323 PolarHBondContact O-N 3.23Å |
| 320 | D | 91.4 | Very high | 90.7 | Very high | 62 Ų | 62 | 110.5 Ų | 110.5 | 33% | 0.332 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -66.6 | -44.9 | 176.5 | -65.7 | -40.7 | 0 | 0 | 0 | 111.6 | N316 T317 K322 R323 L324 | N316-D320 HydrophobicContact CB-CB 4.45Å; T317-D320 PolarHBondContact O-N 3.44Å; T317-D320 VanDerWaalsContact OG1-CG 3.24Å; T317-D320 PolarHBondContact OG1-N 2.94Å; T317-D320 PolarHBondContact OG1-OD2 3.42Å; D320-K322 VanDerWaalsContact C-N 3.29Å; D320-K322 PolarHBondContact O-N 3.05Å; D320-R323 WeakPolarHBondContact O-CB 3.42Å; D320-R323 PolarHBondContact O-N 3.08Å; D320-R323 VanDerWaalsContact O-N 3.09Å; D320-L324 WeakPolarHBondContact O-CB 3.34Å; D320-L324 VanDerWaalsContact O-CG 3.25Å; D320-L324 WeakPolarHBondContact O-CG 3.49Å; D320-L324 PolarHBondContact O-N 3.34Å |
| 321 | R | 90.9 | Very high | 91.3 | Very high | 107 Ų | 107 | 108.2 Ų | 108.2 | 40% | 0.404 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -54.6 | -44.7 | 173.1 | -67 | 175.6 | -179.7 | 177.9 | -3.1 | 111.5 | P313 N316 T317 E318 R325 | P313-R321 PolarHBondContact O-NE 3.27Å; P313-R321 PolarHBondContact O-NH2 3.2Å; N316-R321 HydrophobicContact CB-CG 3.86Å; N316-R321 PolarHBondContact O-NE 2.73Å; N316-R321 VanDerWaalsContact O-NE 3.1Å; T317-R321 WeakPolarHBondContact O-CG 3.41Å; T317-R321 PolarHBondContact O-N 3.05Å; E318-R321 IonicContact OE1-CZ 3.11Å; E318-R321 IonicContact OE1-NH1 2.7Å; E318-R321 PolarHBondContact OE1-NH1 2.67Å; R321-R325 WeakPolarHBondContact O-CB 3.4Å; R321-R325 PolarHBondContact O-N 3.32Å |
| 322 | K | 94.2 | Very high | 91.9 | Very high | 116 Ų | 116 | 111.1 Ų | 111.1 | 50% | 0.504 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -66.6 | -41.1 | 176.2 | -73 | 172.3 | -173.5 | 174.2 | 0 | 112.2 | E318 T319 D320 R325 R326 | E318-K322 VanDerWaalsContact O-CG 3.28Å; E318-K322 WeakPolarHBondContact O-CG 3.49Å; E318-K322 PolarHBondContact O-N 3.45Å; T319-K322 PolarHBondContact O-N 2.94Å; D320-K322 VanDerWaalsContact C-N 3.29Å; D320-K322 PolarHBondContact O-N 3.05Å; K322-R325 PolarHBondContact O-N 2.88Å; K322-R326 WeakPolarHBondContact O-CG 3.44Å; K322-R326 PolarHBondContact O-N 2.95Å |
| 323 | R | 92.4 | Very high | 92.3 | Very high | 176 Ų | 176 | 113 Ų | 113 | 66% | 0.664 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -62.6 | -46 | 176.2 | -176 | -173.5 | -70.4 | -112 | 1.7 | 111.4 | T319 D320 R325 R326 K327 | T319-R323 WeakPolarHBondContact O-CB 3.36Å; T319-R323 PolarHBondContact O-N 3.23Å; D320-R323 WeakPolarHBondContact O-CB 3.42Å; D320-R323 PolarHBondContact O-N 3.08Å; D320-R323 VanDerWaalsContact O-N 3.09Å; R323-R325 PolarHBondContact O-N 3.33Å; R323-R326 PolarHBondContact O-N 2.99Å; R323-K327 PolarHBondContact O-N 2.78Å |
| 324 | L | 90.1 | Very high | 92.7 | Very high | 53 Ų | 53 | 113.6 Ų | 113.6 | 28% | 0.277 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -57.8 | -47.3 | 175 | -71.4 | 171.6 | 0 | 0 | 0 | 111.2 | D320 R326 K327 I328 | D320-L324 WeakPolarHBondContact O-CB 3.34Å; D320-L324 VanDerWaalsContact O-CG 3.25Å; D320-L324 WeakPolarHBondContact O-CG 3.49Å; D320-L324 PolarHBondContact O-N 3.34Å; L324-R326 PolarHBondContact O-N 2.96Å; L324-K327 PolarHBondContact O-N 3.1Å; L324-I328 WeakPolarHBondContact O-CG1 3.17Å; L324-I328 PolarHBondContact O-N 3.39Å |
| 325 | R | 92.7 | Very high | 92.9 | Very high | 170 Ų | 170 | 113.1 Ų | 113.1 | 64% | 0.642 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -58.4 | -44.7 | 175.8 | -173.2 | -177.8 | -71.4 | -142.7 | -2 | 112.1 | R321 K322 R323 I328 K329 | R321-R325 WeakPolarHBondContact O-CB 3.4Å; R321-R325 PolarHBondContact O-N 3.32Å; K322-R325 PolarHBondContact O-N 2.88Å; R323-R325 PolarHBondContact O-N 3.33Å; R325-I328 PolarHBondContact O-N 3.34Å; R325-K329 HydrophobicContact CG-CD 4.47Å; R325-K329 WeakPolarHBondContact O-CB 3.22Å; R325-K329 WeakPolarHBondContact O-CG 3.09Å; R325-K329 PolarHBondContact O-N 3.12Å |
| 326 | R | 95.5 | Very high | 93 | Very high | 172 Ų | 172 | 109.1 Ų | 109.1 | 65% | 0.649 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -62.2 | -42.6 | 175.7 | -68.6 | 177.7 | -162.6 | 136.6 | -0.1 | 111.8 | K322 R323 L324 K329 R330 | K322-R326 WeakPolarHBondContact O-CG 3.44Å; K322-R326 PolarHBondContact O-N 2.95Å; R323-R326 PolarHBondContact O-N 2.99Å; L324-R326 PolarHBondContact O-N 2.96Å; R326-K329 PolarHBondContact O-N 3.47Å; R326-R330 WeakPolarHBondContact O-CB 3.31Å; R326-R330 PolarHBondContact O-N 2.95Å |
| 327 | K | 94 | Very high | 92.9 | Very high | 112 Ų | 112 | 114.4 Ų | 114.4 | 49% | 0.487 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.9 | -45.8 | 178 | -174.2 | 169.6 | 178.6 | 176.5 | 0 | 111.7 | R323 L324 R330 I331 | R323-K327 PolarHBondContact O-N 2.78Å; L324-K327 PolarHBondContact O-N 3.1Å; K327-R330 PolarHBondContact O-N 3Å; K327-I331 HydrophobicContact CG-CD1 4.18Å; K327-I331 WeakPolarHBondContact O-CG1 2.94Å; K327-I331 PolarHBondContact O-N 3.07Å |
| 328 | I | 94.3 | Very high | 92.8 | Very high | 99 Ų | 99 | 117.4 Ų | 117.4 | 51% | 0.508 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62.3 | -48.1 | 176.1 | -66.8 | 167.4 | 0 | 0 | 0 | 110.4 | L324 R325 R330 I331 Q332 | L324-I328 WeakPolarHBondContact O-CG1 3.17Å; L324-I328 PolarHBondContact O-N 3.39Å; R325-I328 PolarHBondContact O-N 3.34Å; I328-R330 VanDerWaalsContact C-N 3.31Å; I328-R330 PolarHBondContact O-N 3.07Å; I328-I331 PolarHBondContact O-N 3.33Å; I328-Q332 WeakPolarHBondContact O-CB 3.34Å; I328-Q332 PolarHBondContact O-N 3.02Å |
| 329 | K | 96.4 | Very high | 92.4 | Very high | 131 Ų | 131 | 118.8 Ų | 118.8 | 57% | 0.57 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -58.6 | -39.6 | 176.1 | -77.2 | -172.8 | 175.6 | -167.7 | 0 | 112.5 | R325 R326 S333 | R325-K329 HydrophobicContact CG-CD 4.47Å; R325-K329 WeakPolarHBondContact O-CB 3.22Å; R325-K329 WeakPolarHBondContact O-CG 3.09Å; R325-K329 PolarHBondContact O-N 3.12Å; R326-K329 PolarHBondContact O-N 3.47Å; K329-S333 VanDerWaalsContact O-CB 3.25Å; K329-S333 WeakPolarHBondContact O-CB 3.28Å; K329-S333 PolarHBondContact O-N 3.47Å |
| 330 | R | 95.9 | Very high | 91.8 | Very high | 191 Ų | 191 | 120 Ų | 120 | 72% | 0.721 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -63 | -47.9 | 174.9 | -178.1 | -179.8 | -82.1 | 176.1 | -5.5 | 111.4 | R326 K327 I328 S333 L334 | R326-R330 WeakPolarHBondContact O-CB 3.31Å; R326-R330 PolarHBondContact O-N 2.95Å; K327-R330 PolarHBondContact O-N 3Å; I328-R330 VanDerWaalsContact C-N 3.31Å; I328-R330 PolarHBondContact O-N 3.07Å; R330-S333 PolarHBondContact O-N 3.11Å; R330-L334 HydrophobicContact CG-CD1 4.33Å; R330-L334 WeakPolarHBondContact O-CG 3.43Å; R330-L334 PolarHBondContact O-N 3.29Å |
| 331 | I | 95 | Very high | 91 | Very high | 67 Ų | 67 | 121.1 Ų | 121.1 | 34% | 0.344 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63.1 | -43.5 | 178.4 | -66.3 | 166 | 0 | 0 | 0 | 110.8 | K327 I328 L334 R335 | K327-I331 HydrophobicContact CG-CD1 4.18Å; K327-I331 WeakPolarHBondContact O-CG1 2.94Å; K327-I331 PolarHBondContact O-N 3.07Å; I328-I331 PolarHBondContact O-N 3.33Å; I331-L334 PolarHBondContact O-N 3.43Å; I331-R335 HydrophobicContact CG2-CG 4.5Å; I331-R335 WeakPolarHBondContact O-CG 3.36Å; I331-R335 PolarHBondContact O-N 2.95Å |
| 332 | Q | 94.7 | Very high | 90.3 | Very high | 126 Ų | 126 | 121.9 Ų | 121.9 | 59% | 0.589 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -63.1 | -42.7 | 177.1 | -171.8 | -179.3 | 15 | 0 | 0 | 111.6 | I328 R335 C336 | I328-Q332 WeakPolarHBondContact O-CB 3.34Å; I328-Q332 PolarHBondContact O-N 3.02Å; Q332-R335 PolarHBondContact O-N 3.41Å; Q332-C336 VanDerWaalsContact O-CB 3.3Å; Q332-C336 WeakPolarHBondContact O-CB 3.28Å; Q332-C336 PolarHBondContact O-N 3.35Å |
| 333 | S | 94.7 | Very high | 89.2 | Confident | 77 Ų | 77 | 118.2 Ų | 118.2 | 54% | 0.538 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -60.9 | -44.2 | 174.8 | 179.5 | 0 | 0 | 0 | 0 | 111.9 | K329 R330 C336 K337 | K329-S333 VanDerWaalsContact O-CB 3.25Å; K329-S333 WeakPolarHBondContact O-CB 3.28Å; K329-S333 PolarHBondContact O-N 3.47Å; R330-S333 PolarHBondContact O-N 3.11Å; S333-C336 PolarHBondContact O-N 2.97Å; S333-K337 WeakPolarHBondContact O-CB 3.4Å; S333-K337 PolarHBondContact O-N 2.8Å |
| 334 | L | 93.9 | Very high | 87.7 | Confident | 109 Ų | 109 | 111.4 Ų | 111.4 | 57% | 0.571 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.9 | -41.9 | 175.4 | -70.7 | 171.9 | 0 | 0 | 0 | 112.4 | R330 I331 K337 K338 | R330-L334 HydrophobicContact CG-CD1 4.33Å; R330-L334 WeakPolarHBondContact O-CG 3.43Å; R330-L334 PolarHBondContact O-N 3.29Å; I331-L334 PolarHBondContact O-N 3.43Å; L334-K337 PolarHBondContact O-N 3.09Å; L334-K338 WeakPolarHBondContact O-CB 3.5Å; L334-K338 PolarHBondContact O-N 3Å |
| 335 | R | 93.4 | Very high | 86.2 | Confident | 166 Ų | 166 | 113.8 Ų | 113.8 | 63% | 0.626 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -63.1 | -45.6 | 174.8 | -74.8 | 179 | -178.5 | -179.4 | -0.7 | 111.6 | I331 Q332 K338 Q339 | I331-R335 HydrophobicContact CG2-CG 4.5Å; I331-R335 WeakPolarHBondContact O-CG 3.36Å; I331-R335 PolarHBondContact O-N 2.95Å; Q332-R335 PolarHBondContact O-N 3.41Å; R335-K338 PolarHBondContact O-N 3.15Å; R335-Q339 WeakPolarHBondContact O-CB 3.28Å; R335-Q339 WeakPolarHBondContact O-CG 3.33Å; R335-Q339 PolarHBondContact O-N 3.2Å |
| 336 | C | 90 | Very high | 84.5 | Confident | 53 Ų | 53 | 108.7 Ų | 108.7 | 36% | 0.358 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62 | -44.5 | 176.7 | -173.9 | 0 | 0 | 0 | 0 | 111.1 | Q332 S333 K338 Q339 Q340 | Q332-C336 VanDerWaalsContact O-CB 3.3Å; Q332-C336 WeakPolarHBondContact O-CB 3.28Å; Q332-C336 PolarHBondContact O-N 3.35Å; S333-C336 PolarHBondContact O-N 2.97Å; C336-K338 PolarHBondContact O-N 3.33Å; C336-Q339 PolarHBondContact O-N 2.97Å; C336-Q340 WeakPolarHBondContact O-CB 3.42Å; C336-Q340 WeakPolarHBondContact O-CG 3.29Å; C336-Q340 PolarHBondContact O-N 3.05Å; C336-Q340 PolarHBondContact SG-NE2 3.15Å |
| 337 | K | 87.7 | Confident | 82.5 | Confident | 137 Ų | 137 | 105.5 Ų | 105.5 | 60% | 0.596 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -60.4 | -43.6 | 174.7 | -169.8 | 176.2 | -178.5 | -179.2 | 0 | 111.8 | S333 L334 Q340 L341 | S333-K337 WeakPolarHBondContact O-CB 3.4Å; S333-K337 PolarHBondContact O-N 2.8Å; L334-K337 PolarHBondContact O-N 3.09Å; K337-Q340 PolarHBondContact O-N 2.93Å; K337-L341 VanDerWaalsContact O-CG 3.25Å; K337-L341 WeakPolarHBondContact O-CG 3.29Å; K337-L341 PolarHBondContact O-N 3.26Å |
| 338 | K | 87.1 | Confident | 80.5 | Confident | 135 Ų | 135 | 105.8 Ų | 105.8 | 59% | 0.587 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.7 | -41.7 | 175.5 | -172.1 | 175.1 | -177.2 | 174.4 | 0 | 111.8 | L334 R335 C336 L341 K342 | L334-K338 WeakPolarHBondContact O-CB 3.5Å; L334-K338 PolarHBondContact O-N 3Å; R335-K338 PolarHBondContact O-N 3.15Å; C336-K338 PolarHBondContact O-N 3.33Å; K338-L341 PolarHBondContact O-N 3.17Å; K338-K342 WeakPolarHBondContact O-CG 3.47Å; K338-K342 PolarHBondContact O-N 3.07Å |
| 339 | Q | 83.6 | Confident | 78.5 | Confident | 135 Ų | 135 | 105 Ų | 105 | 63% | 0.631 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -66 | -40.3 | 175.7 | -76.4 | 176.3 | -13.5 | 0 | 0 | 112.1 | R335 C336 L341 K342 A343 | R335-Q339 WeakPolarHBondContact O-CB 3.28Å; R335-Q339 WeakPolarHBondContact O-CG 3.33Å; R335-Q339 PolarHBondContact O-N 3.2Å; C336-Q339 PolarHBondContact O-N 2.97Å; Q339-L341 VanDerWaalsContact C-N 3.34Å; Q339-L341 PolarHBondContact O-N 2.91Å; Q339-K342 PolarHBondContact O-N 3.1Å; Q339-A343 WeakPolarHBondContact O-CB 3.43Å; Q339-A343 PolarHBondContact O-N 3.42Å |
| 340 | Q | 79.6 | Confident | 76.3 | Confident | 127 Ų | 127 | 103 Ų | 103 | 59% | 0.593 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -66.2 | -35.5 | 175.5 | -72.8 | 176.8 | 12.5 | 0 | 0 | 112.5 | C336 K337 G344 | C336-Q340 WeakPolarHBondContact O-CB 3.42Å; C336-Q340 WeakPolarHBondContact O-CG 3.29Å; C336-Q340 PolarHBondContact O-N 3.05Å; C336-Q340 PolarHBondContact SG-NE2 3.15Å; K337-Q340 PolarHBondContact O-N 2.93Å; Q340-G344 PolarHBondContact O-N 3.25Å |
| 341 | L | 75.2 | Confident | 74.4 | Confident | 85 Ų | 85 | 97.9 Ų | 97.9 | 45% | 0.445 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.4 | -47.6 | 172.7 | -69.5 | 170 | 0 | 0 | 0 | 110.7 | K337 K338 Q339 G344 E345 | K337-L341 VanDerWaalsContact O-CG 3.25Å; K337-L341 WeakPolarHBondContact O-CG 3.29Å; K337-L341 PolarHBondContact O-N 3.26Å; K338-L341 PolarHBondContact O-N 3.17Å; Q339-L341 VanDerWaalsContact C-N 3.34Å; Q339-L341 PolarHBondContact O-N 2.91Å; L341-G344 PolarHBondContact O-N 3.41Å; L341-E345 VanDerWaalsContact O-CG 3.31Å; L341-E345 WeakPolarHBondContact O-CG 3.47Å; L341-E345 PolarHBondContact O-N 2.97Å; L341-E345 VanDerWaalsContact O-N 3.13Å |
| 342 | K | 76.4 | Confident | 72.5 | Confident | 122 Ų | 122 | 98.4 Ų | 98.4 | 53% | 0.53 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.3 | -39.7 | 175.7 | -72.4 | -172.9 | 170.7 | -157.7 | 0 | 113.8 | K338 Q339 E345 S346 | K338-K342 WeakPolarHBondContact O-CG 3.47Å; K338-K342 PolarHBondContact O-N 3.07Å; Q339-K342 PolarHBondContact O-N 3.1Å; K342-E345 WeakPolarHBondContact O-CB 3.34Å; K342-E345 PolarHBondContact O-N 2.97Å; K342-S346 PolarHBondContact O-N 3.37Å; K342-S346 PolarHBondContact O-OG 3.38Å |
| 343 | A | 69.9 | Low | 70.9 | Confident | 39 Ų | 39 | 99.2 Ų | 99.2 | 32% | 0.322 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -70.2 | -39.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | Q339 E345 S346 D347 | Q339-A343 WeakPolarHBondContact O-CB 3.43Å; Q339-A343 PolarHBondContact O-N 3.42Å; A343-E345 PolarHBondContact O-N 2.98Å; A343-S346 WeakPolarHBondContact CA-OG 3.43Å; A343-S346 PolarHBondContact O-N 3.06Å; A343-S346 VanDerWaalsContact O-N 3.14Å; A343-S346 PolarHBondContact O-OG 3.34Å; A343-D347 WeakPolarHBondContact O-CB 3.28Å; A343-D347 PolarHBondContact O-N 3.01Å |
| 344 | G | 61.1 | Low | 69.3 | Low | 33 Ų | 33 | 100.8 Ų | 100.8 | 34% | 0.34 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65.3 | -18.7 | 171.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q340 L341 K348 | Q340-G344 PolarHBondContact O-N 3.25Å; L341-G344 PolarHBondContact O-N 3.41Å; G344-K348 VanDerWaalsContact O-CD 3.28Å; G344-K348 WeakPolarHBondContact O-CD 3.29Å; G344-K348 WeakPolarHBondContact O-CE 3.32Å; G344-K348 WeakPolarHBondContact O-CG 3.45Å |
| 345 | E | 59 | Low | 67.7 | Low | 103 Ų | 103 | 102 Ų | 102 | 48% | 0.481 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -82.4 | -43.2 | 168.6 | -70.8 | 159.2 | -172.7 | 0 | 0 | 111 | L341 K342 A343 | L341-E345 VanDerWaalsContact O-CG 3.31Å; L341-E345 WeakPolarHBondContact O-CG 3.47Å; L341-E345 PolarHBondContact O-N 2.97Å; L341-E345 VanDerWaalsContact O-N 3.13Å; K342-E345 WeakPolarHBondContact O-CB 3.34Å; K342-E345 PolarHBondContact O-N 2.97Å; A343-E345 PolarHBondContact O-N 2.98Å |
| 346 | S | 56.9 | Low | 66 | Low | 63 Ų | 63 | 97.9 Ų | 97.9 | 44% | 0.441 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -76.9 | -37.5 | -177.7 | 64.8 | 0 | 0 | 0 | 0 | 115.1 | K342 A343 K348 A349 L350 | K342-S346 PolarHBondContact O-N 3.37Å; K342-S346 PolarHBondContact O-OG 3.38Å; A343-S346 WeakPolarHBondContact CA-OG 3.43Å; A343-S346 PolarHBondContact O-N 3.06Å; A343-S346 VanDerWaalsContact O-N 3.14Å; A343-S346 PolarHBondContact O-OG 3.34Å; S346-K348 PolarHBondContact O-N 3.48Å; S346-A349 WeakPolarHBondContact O-CA 3.49Å; S346-A349 WeakPolarHBondContact O-CB 3.43Å; S346-A349 PolarHBondContact O-N 3.11Å; S346-L350 PolarHBondContact O-N 3.01Å |
| 347 | D | 53.8 | Low | 64.7 | Low | 106 Ų | 106 | 100.3 Ų | 100.3 | 57% | 0.567 | 52% | 0.518 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.6 | -16.5 | -179.5 | -73.3 | -16.7 | 0 | 0 | 0 | 112.3 | A343 | A343-D347 WeakPolarHBondContact O-CB 3.28Å; A343-D347 PolarHBondContact O-N 3.01Å |
| 348 | K | 51.5 | Low | 63.4 | Low | 118 Ų | 118 | 99 Ų | 99 | 51% | 0.513 | 52% | 0.516 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.1 | -13.7 | 170.9 | -63.8 | -179.3 | -175 | -178 | 0 | 113.2 | G344 S346 | G344-K348 VanDerWaalsContact O-CD 3.28Å; G344-K348 WeakPolarHBondContact O-CD 3.29Å; G344-K348 WeakPolarHBondContact O-CE 3.32Å; G344-K348 WeakPolarHBondContact O-CG 3.45Å; S346-K348 PolarHBondContact O-N 3.48Å |
| 349 | A | 51.7 | Low | 62 | Low | 81 Ų | 81 | 98.9 Ų | 98.9 | 67% | 0.669 | 52% | 0.521 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.3 | -13.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | S346 | S346-A349 WeakPolarHBondContact O-CA 3.49Å; S346-A349 WeakPolarHBondContact O-CB 3.43Å; S346-A349 PolarHBondContact O-N 3.11Å |
| 350 | L | 51.6 | Low | 61 | Low | 89 Ų | 89 | 100.5 Ų | 100.5 | 47% | 0.466 | 52% | 0.521 | S | S | . | . | S | Bend | trans | -104.1 | 124 | 178.8 | -136.7 | 74.3 | 0 | 0 | 0 | 110.6 | S346 | S346-L350 PolarHBondContact O-N 3.01Š|
| 351 | V | 56 | Low | 60.2 | Low | 85 Ų | 85 | 102 Ų | 102 | 52% | 0.515 | 53% | 0.526 | S | S | . | . | trans | -44.2 | 131.2 | 166.8 | 174.4 | 0 | 0 | 0 | 0 | 108.6 | K353 K355 | V351-K353 PolarHBondContact O-N 3.37Å; V351-K355 HydrophobicContact CG1-CB 3.76Å; V351-K355 HydrophobicContact CG1-CD 4.2Å | ||
| 352 | P | 55.5 | Low | 59.5 | Low | 78 Ų | 78 | 103.7 Ų | 103.7 | 51% | 0.506 | 54% | 0.54 | S | S | . | . | trans | -46.6 | 130.9 | -177 | -29.7 | 34.2 | 0 | 0 | 0 | 110.9 | D354 K355 M356 | P352-D354 PolarHBondContact O-N 3.29Å; P352-K355 PolarHBondContact O-N 3.41Å; P352-M356 PolarHBondContact O-N 3.04Å | ||
| 353 | K | 60.2 | Low | 58.4 | Low | 142 Ų | 142 | 101.1 Ų | 101.1 | 62% | 0.617 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -51 | -28.6 | -178.4 | -70.2 | 177.7 | -179.9 | 172.2 | 0 | 111.9 | V351 M356 Q357 | V351-K353 PolarHBondContact O-N 3.37Å; K353-M356 PolarHBondContact O-N 3.06Å; K353-Q357 WeakPolarHBondContact O-CG 3.47Å; K353-Q357 PolarHBondContact O-N 2.98Å |
| 354 | D | 61.2 | Low | 57.8 | Low | 111 Ų | 111 | 103.9 Ų | 103.9 | 59% | 0.594 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -62.3 | -40.9 | 175.7 | -58.9 | -15.5 | 0 | 0 | 0 | 112.8 | P352 Q357 I358 | P352-D354 PolarHBondContact O-N 3.29Å; D354-Q357 PolarHBondContact O-N 3.45Å; D354-I358 WeakPolarHBondContact O-CD1 3.23Å; D354-I358 VanDerWaalsContact O-CG1 3.25Å; D354-I358 WeakPolarHBondContact O-CG1 3.47Å; D354-I358 PolarHBondContact O-N 3.17Å |
| 355 | K | 60.5 | Low | 57.1 | Low | 135 Ų | 135 | 108.7 Ų | 108.7 | 59% | 0.587 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -69.2 | -34.7 | 174.5 | -72.1 | -172 | 178.2 | -172.3 | 0 | 111.9 | V351 P352 L359 | V351-K355 HydrophobicContact CG1-CB 3.76Å; V351-K355 HydrophobicContact CG1-CD 4.2Å; P352-K355 PolarHBondContact O-N 3.41Å; K355-L359 PolarHBondContact O-N 3.39Å; K355-L359 VanDerWaalsContact O-N 3.12Å |
| 356 | M | 58.7 | Low | 56.3 | Low | 79 Ų | 79 | 112.5 Ų | 112.5 | 39% | 0.389 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -69.4 | -33.9 | 172.3 | -84.5 | -167.4 | 70 | 0 | 0 | 113 | P352 K353 R360 | P352-M356 PolarHBondContact O-N 3.04Å; K353-M356 PolarHBondContact O-N 3.06Å; M356-R360 WeakPolarHBondContact O-CG 3.39Å; M356-R360 PolarHBondContact O-N 2.98Å; M356-R360 VanDerWaalsContact O-N 3.08Å |
| 357 | Q | 61.7 | Low | 55.5 | Low | 104 Ų | 104 | 119.6 Ų | 119.6 | 49% | 0.486 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -71.5 | -36.4 | 175.5 | -74.4 | -178.2 | 22.7 | 0 | 0 | 112 | K353 D354 R360 K361 | K353-Q357 WeakPolarHBondContact O-CG 3.47Å; K353-Q357 PolarHBondContact O-N 2.98Å; D354-Q357 PolarHBondContact O-N 3.45Å; Q357-R360 PolarHBondContact O-N 3.49Å; Q357-K361 WeakPolarHBondContact O-CG 3.17Å; Q357-K361 PolarHBondContact O-N 3Å |
| 358 | I | 59.9 | Low | 55.3 | Low | 109 Ų | 109 | 119.9 Ų | 119.9 | 56% | 0.559 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -63.5 | -45.5 | 173.4 | -67.7 | 161.6 | 0 | 0 | 0 | 110.2 | D354 R360 K361 V362 | D354-I358 WeakPolarHBondContact O-CD1 3.23Å; D354-I358 VanDerWaalsContact O-CG1 3.25Å; D354-I358 WeakPolarHBondContact O-CG1 3.47Å; D354-I358 PolarHBondContact O-N 3.17Å; I358-R360 VanDerWaalsContact C-N 3.34Å; I358-R360 PolarHBondContact O-N 3.31Å; I358-K361 PolarHBondContact O-N 3.08Å; I358-V362 HydrophobicContact CG2-CG2 4.44Å; I358-V362 VanDerWaalsContact O-CG2 3.31Å; I358-V362 WeakPolarHBondContact O-CG2 3.45Å; I358-V362 PolarHBondContact O-N 3.38Å |
| 359 | L | 58.4 | Low | 54.7 | Low | 132 Ų | 132 | 123.2 Ų | 123.2 | 69% | 0.691 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -63.2 | -35.7 | 176.4 | -80.2 | 159 | 0 | 0 | 0 | 113.3 | K355 G363 | K355-L359 PolarHBondContact O-N 3.39Å; K355-L359 VanDerWaalsContact O-N 3.12Å; L359-G363 PolarHBondContact O-N 3.41Å |
| 360 | R | 62.8 | Low | 54.4 | Low | 169 Ų | 169 | 126 Ų | 126 | 64% | 0.638 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -70.2 | -33.6 | 174.3 | -75.7 | 178.7 | -178 | 158.6 | -0.2 | 113.2 | M356 Q357 I358 T364 | M356-R360 WeakPolarHBondContact O-CG 3.39Å; M356-R360 PolarHBondContact O-N 2.98Å; M356-R360 VanDerWaalsContact O-N 3.08Å; Q357-R360 PolarHBondContact O-N 3.49Å; I358-R360 VanDerWaalsContact C-N 3.34Å; I358-R360 PolarHBondContact O-N 3.31Å; R360-T364 PolarHBondContact O-OG1 3.33Å |
| 361 | K | 61.5 | Low | 54.1 | Low | 160 Ų | 160 | 127.6 Ų | 127.6 | 70% | 0.696 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -75.1 | -29.3 | 177.6 | -76.8 | -178.9 | 176.7 | -178.1 | 0 | 113 | Q357 I358 | Q357-K361 WeakPolarHBondContact O-CG 3.17Å; Q357-K361 PolarHBondContact O-N 3Å; I358-K361 PolarHBondContact O-N 3.08Å |
| 362 | V | 61.1 | Low | 53.6 | Low | 120 Ų | 120 | 132 Ų | 132 | 73% | 0.727 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -80.2 | -23.6 | 178.5 | 179.4 | 0 | 0 | 0 | 0 | 112.1 | I358 T364 | I358-V362 HydrophobicContact CG2-CG2 4.44Å; I358-V362 VanDerWaalsContact O-CG2 3.31Å; I358-V362 WeakPolarHBondContact O-CG2 3.45Å; I358-V362 PolarHBondContact O-N 3.38Å; V362-T364 VanDerWaalsContact C-N 3.34Å; V362-T364 PolarHBondContact O-N 3.49Å |
| 363 | G | 54.7 | Low | 52.8 | Low | 68 Ų | 68 | 134.2 Ų | 134.2 | 70% | 0.701 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.2 | -2.9 | 178.8 | 0 | 0 | 0 | 0 | 0 | 116.1 | L359 | L359-G363 PolarHBondContact O-N 3.41Š|
| 364 | T | 56.9 | Low | 52.4 | Low | 97 Ų | 97 | 131.8 Ų | 131.8 | 60% | 0.595 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -130.9 | 91.8 | -177.5 | 55.2 | 0 | 0 | 0 | 0 | 108.8 | R360 V362 | R360-T364 PolarHBondContact O-OG1 3.33Å; V362-T364 VanDerWaalsContact C-N 3.34Å; V362-T364 PolarHBondContact O-N 3.49Å |
| 365 | V | 45.7 | Very low | 51.9 | Low | 134 Ų | 134 | 135.7 Ų | 135.7 | 81% | 0.812 | 72% | 0.717 | S | S | * | * | trans | 167 | 99.7 | 152.3 | 157.9 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 366 | K | 42 | Very low | 51.2 | Low | 183 Ų | 183 | 137.4 Ų | 137.4 | 80% | 0.796 | 73% | 0.733 | S | S | * | * | trans | 154.6 | 70.1 | 137.4 | -84.6 | -176.2 | -175.6 | -176.6 | 0 | 110.5 | ||||
| 367 | K | 40.5 | Very low | 51.1 | Low | 212 Ų | 212 | 140.8 Ų | 140.8 | 92% | 0.922 | 75% | 0.751 | S | S | * | * | trans | -94.8 | 92.9 | 151.3 | -166.2 | 175.8 | -172 | 175.6 | 0 | 105.4 | ||||
| 368 | T | 48.5 | Very low | 50.6 | Low | 111 Ų | 111 | 144.6 Ų | 144.6 | 68% | 0.681 | 77% | 0.766 | S | S | * | * | trans | -137 | 125.4 | 174.6 | 48.2 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 369 | M | 39.9 | Very low | 50.2 | Low | 188 Ų | 188 | 145.9 Ų | 145.9 | 93% | 0.926 | 77% | 0.774 | S | S | * | * | trans | 83.4 | 74.6 | 161.4 | -53.9 | -154.6 | 151.3 | 0 | 0 | 117.8 | ||||
| 370 | V | 44.4 | Very low | 49.6 | Very low | 140 Ų | 140 | 152.8 Ų | 152.8 | 85% | 0.848 | 80% | 0.799 | S | S | * | * | trans | -67.5 | 112.2 | 132.1 | 173 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 371 | N | 47 | Very low | 49 | Very low | 123 Ų | 123 | 152 Ų | 152 | 66% | 0.658 | 81% | 0.807 | S | S | * | * | trans | -176.5 | 118.8 | 130.8 | -117.8 | -17.8 | 0 | 0 | 0 | 112.4 | ||||
| 372 | Q | 45.3 | Very low | 48.3 | Very low | 178 Ų | 178 | 151.6 Ų | 151.6 | 83% | 0.832 | 81% | 0.812 | S | S | * | * | trans | 46.9 | 92.8 | 139.8 | -65 | 173 | 2.3 | 0 | 0 | 118.4 | ||||
| 373 | S | 39 | Very low | 47.6 | Very low | 124 Ų | 124 | 153.3 Ų | 153.3 | 87% | 0.867 | 82% | 0.817 | S | S | * | * | trans | -163.8 | 82.8 | 138.8 | 52.5 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 374 | A | 51.2 | Low | 47.2 | Very low | 91 Ų | 91 | 158.4 Ų | 158.4 | 75% | 0.752 | 82% | 0.824 | S | S | * | * | trans | -146.7 | 132 | 161.4 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 375 | Q | 50.8 | Low | 46.6 | Very low | 192 Ų | 192 | 162.2 Ų | 162.2 | 90% | 0.897 | 84% | 0.838 | S | S | * | * | trans | 97.9 | 72.7 | 173.9 | -54.1 | 175 | 10.9 | 0 | 0 | 115.2 | ||||
| 376 | N | 45.7 | Very low | 46.6 | Very low | 172 Ų | 172 | 164.1 Ų | 164.1 | 92% | 0.92 | 84% | 0.84 | S | S | * | * | trans | -123.1 | 90.2 | 140.2 | -124.5 | -0.4 | 0 | 0 | 0 | 105.8 | ||||
| 377 | I | 57 | Low | 47 | Very low | 149 Ų | 149 | 162.7 Ų | 162.7 | 76% | 0.764 | 84% | 0.843 | S | S | * | * | trans | -139.9 | 118.1 | 172.2 | -71.6 | -179.7 | 0 | 0 | 0 | 106.9 | ||||
| 378 | F | 51.2 | Low | 47.5 | Very low | 185 Ų | 185 | 158.9 Ų | 158.9 | 81% | 0.811 | 84% | 0.837 | S | S | * | * | trans | 65.7 | 113.1 | 161.7 | -94 | -110.6 | 0 | 0 | 0 | 118.3 | ||||
| 379 | L | 49.9 | Very low | 47.4 | Very low | 136 Ų | 136 | 162.9 Ų | 162.9 | 71% | 0.712 | 85% | 0.85 | S | S | * | * | 58.7 | 111.4 | 68.7 | -87.8 | 157.4 | 0 | 0 | 0 | 114.2 | |||||
| 380 | F | 47.2 | Very low | 48.1 | Very low | 277 Ų | 277 | 160.6 Ų | 160.6 | 100% | 1.215 | 84% | 0.843 | S | S | * | * | trans | 69.8 | 0 | 165.8 | -92.7 | -86.5 | 0 | 0 | 0 | 119.5 |
Retrieved 380 of 380 residues in 438.1 ms
(Link to these results)