| 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 | 79.4 | Confident | 80.7 | Confident | 46 Ų | 46 | 87.5 Ų | 87.5 | 23% | 0.227 | 44% | 0.435 | C | S | . | . | 0 | -79.9 | 0 | -59.8 | -44.8 | 176.7 | 0 | 0 | 110.9 | L3 E4 S5 V76 F84 V93 F97 | M1-L3 PolarHBondContact O-N 2.89Å; M1-E4 PolarHBondContact O-N 3.3Å; M1-E4 VanDerWaalsContact O-N 3.1Å; M1-S5 PolarHBondContact O-N 3.41Å; M1-S5 PolarHBondContact O-OG 3.44Å; M1-V76 HydrophobicContact CG-CG1 4.5Å; M1-F84 HydrophobicContact CE-CE2 4.12Å; M1-F84 HydrophobicContact SD-CE2 3.79Å; M1-V93 HydrophobicContact CE-CB 3.81Å; M1-V93 HydrophobicContact CE-CG1 3.22Å; M1-V93 HydrophobicContact CE-CG2 3.27Å; M1-V93 HydrophobicContact SD-CG2 4.37Å; M1-F97 HydrophobicContact CE-CE1 4.4Å; M1-F97 HydrophobicContact CE-CE2 3.26Å; M1-F97 HydrophobicContact CE-CZ 3.2Å; M1-F97 HydrophobicContact CG-CZ 4.16Å; M1-F97 HydrophobicContact SD-CE1 4.15Å; M1-F97 HydrophobicContact SD-CE2 4.06Å; M1-F97 HydrophobicContact SD-CZ 3.36Å; M1-F97 WeakPolarHBondContact SD-CZ 3.49Å | |||
| 2 | M | 83.3 | Confident | 80 | Confident | 119 Ų | 119 | 83.5 Ų | 83.5 | 59% | 0.586 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -54.9 | -48.7 | -177.3 | -67.5 | -178.7 | 74.6 | 0 | 0 | 113.2 | E4 S5 L6 F79 | M2-E4 PolarHBondContact O-N 3.46Å; M2-S5 WeakPolarHBondContact CA-OG 3.21Å; M2-S5 PolarHBondContact O-N 3.36Å; M2-S5 PolarHBondContact O-OG 3.47Å; M2-L6 WeakPolarHBondContact O-CG 3.46Å; M2-L6 PolarHBondContact O-N 3.36Å; M2-F79 HydrophobicContact CE-CD2 4.36Å; M2-F79 HydrophobicContact CE-CE2 3.84Å; M2-F79 HydrophobicContact CE-CZ 4.15Å; M2-F79 HydrophobicContact CG-CB 4.3Å; M2-F79 HydrophobicContact CG-CD2 3.56Å; M2-F79 HydrophobicContact CG-CE2 4.02Å; M2-F79 HydrophobicContact CG-CG 3.92Å; M2-F79 HydrophobicContact SD-CD2 4.29Å; M2-F79 HydrophobicContact SD-CE2 4.28Å |
| 3 | L | 80.8 | Confident | 79.3 | Confident | 143 Ų | 143 | 86.7 Ų | 86.7 | 75% | 0.749 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -62.2 | -39.4 | 178.2 | -71.4 | 170.6 | 0 | 0 | 0 | 113.3 | M1 L6 P7 | M1-L3 PolarHBondContact O-N 2.89Å; L3-L6 HydrophobicContact CD2-CD1 4.14Å; L3-L6 PolarHBondContact O-N 3.47Å; L3-P7 WeakPolarHBondContact O-CD 3.21Å |
| 4 | E | 80.4 | Confident | 78.9 | Confident | 76 Ų | 76 | 84.6 Ų | 84.6 | 36% | 0.355 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -72.5 | -28.8 | 177.6 | -66.6 | -60.5 | 160.5 | 0 | 0 | 112.5 | M1 M2 L6 P7 A83 F97 | M1-E4 PolarHBondContact O-N 3.3Å; M1-E4 VanDerWaalsContact O-N 3.1Å; M2-E4 PolarHBondContact O-N 3.46Å; E4-L6 VanDerWaalsContact C-N 3.33Å; E4-P7 WeakPolarHBondContact O-CD 3.36Å; E4-P7 WeakPolarHBondContact O-CG 3.49Å; E4-A83 HydrophobicContact CB-CB 4.32Å; E4-F97 HydrophobicContact CG-CD1 4.06Å; E4-F97 HydrophobicContact CG-CE1 3.74Å |
| 5 | S | 80.1 | Confident | 78.4 | Confident | 0 Ų | 0 | 83.3 Ų | 83.3 | 0% | 0 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -75.9 | -19.5 | 177 | 61.2 | 0 | 0 | 0 | 0 | 113.5 | M1 M2 T8 I9 F79 | M1-S5 PolarHBondContact O-N 3.41Å; M1-S5 PolarHBondContact O-OG 3.44Å; M2-S5 WeakPolarHBondContact CA-OG 3.21Å; M2-S5 PolarHBondContact O-N 3.36Å; M2-S5 PolarHBondContact O-OG 3.47Å; S5-T8 PolarHBondContact O-N 3.17Å; S5-I9 WeakPolarHBondContact O-CB 3.5Å; S5-I9 WeakPolarHBondContact O-CD1 3.49Å; S5-I9 WeakPolarHBondContact O-CG1 3.47Å; S5-I9 PolarHBondContact O-N 3.41Å; S5-F79 WeakPolarHBondContact OG-CD1 3.43Å |
| 6 | L | 81.2 | Confident | 77.8 | Confident | 101 Ų | 101 | 87.1 Ų | 87.1 | 53% | 0.529 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -59 | -50.4 | -178 | -74.7 | 172.9 | 0 | 0 | 0 | 114.6 | M2 L3 E4 T8 I9 Y10 | M2-L6 WeakPolarHBondContact O-CG 3.46Å; M2-L6 PolarHBondContact O-N 3.36Å; L3-L6 HydrophobicContact CD2-CD1 4.14Å; L3-L6 PolarHBondContact O-N 3.47Å; E4-L6 VanDerWaalsContact C-N 3.33Å; L6-T8 VanDerWaalsContact C-N 3.33Å; L6-T8 PolarHBondContact O-N 3.37Å; L6-I9 PolarHBondContact O-N 2.79Å; L6-Y10 WeakPolarHBondContact O-CB 3.45Å; L6-Y10 PolarHBondContact O-N 3.25Å |
| 7 | P | 80.3 | Confident | 77.4 | Confident | 69 Ų | 69 | 88.6 Ų | 88.6 | 45% | 0.448 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -59.4 | -46.1 | 177.3 | 21.6 | -33.2 | 0 | 0 | 0 | 111.2 | L3 E4 I9 Y10 D11 | L3-P7 WeakPolarHBondContact O-CD 3.21Å; E4-P7 WeakPolarHBondContact O-CD 3.36Å; E4-P7 WeakPolarHBondContact O-CG 3.49Å; P7-I9 VanDerWaalsContact C-N 3.32Å; P7-I9 PolarHBondContact O-N 3.36Å; P7-Y10 WeakPolarHBondContact O-CB 3.45Å; P7-Y10 PolarHBondContact O-N 3.24Å; P7-Y10 VanDerWaalsContact O-N 3.09Å; P7-D11 PolarHBondContact O-N 3.43Å |
| 8 | T | 77.8 | Confident | 77.3 | Confident | 23 Ų | 23 | 84.3 Ų | 84.3 | 14% | 0.141 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -60.1 | -39.6 | 177.8 | -50.5 | 0 | 0 | 0 | 0 | 113.2 | S5 L6 G12 W14 V82 Y85 | S5-T8 PolarHBondContact O-N 3.17Å; L6-T8 VanDerWaalsContact C-N 3.33Å; L6-T8 PolarHBondContact O-N 3.37Å; T8-G12 PolarHBondContact O-N 2.94Å; T8-W14 HydrophobicContact CG2-CB 3.86Å; T8-V82 HydrophobicContact CG2-CG1 4.27Å; T8-V82 WeakPolarHBondContact CG2-O 3.42Å; T8-Y85 HydrophobicContact CG2-CD1 3.65Å; T8-Y85 HydrophobicContact CG2-CE1 3.35Å |
| 9 | I | 81.7 | Confident | 77.4 | Confident | 61 Ų | 61 | 82.8 Ų | 82.8 | 31% | 0.313 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -68.6 | -38.3 | 176.5 | -71.7 | 164.9 | 0 | 0 | 0 | 110.9 | S5 L6 P7 G12 F79 V82 | S5-I9 WeakPolarHBondContact O-CB 3.5Å; S5-I9 WeakPolarHBondContact O-CD1 3.49Å; S5-I9 WeakPolarHBondContact O-CG1 3.47Å; S5-I9 PolarHBondContact O-N 3.41Å; L6-I9 PolarHBondContact O-N 2.79Å; P7-I9 VanDerWaalsContact C-N 3.32Å; P7-I9 PolarHBondContact O-N 3.36Å; I9-G12 PolarHBondContact O-N 3.45Å; I9-F79 HydrophobicContact CD1-CD1 4.16Å; I9-F79 HydrophobicContact CD1-CE1 4.13Å; I9-V82 HydrophobicContact CD1-CG1 4.31Å; I9-V82 HydrophobicContact CG1-CG1 3.73Å |
| 10 | Y | 82.9 | Confident | 77.5 | Confident | 208 Ų | 208 | 87.9 Ų | 87.9 | 82% | 0.816 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -67.3 | -37.6 | 179.1 | -175.1 | -96.9 | 0 | 0 | 0 | 112.3 | L6 P7 G12 | L6-Y10 WeakPolarHBondContact O-CB 3.45Å; L6-Y10 PolarHBondContact O-N 3.25Å; P7-Y10 WeakPolarHBondContact O-CB 3.45Å; P7-Y10 PolarHBondContact O-N 3.24Å; P7-Y10 VanDerWaalsContact O-N 3.09Å; Y10-G12 PolarHBondContact O-N 3.09Å |
| 11 | D | 79.6 | Confident | 77.6 | Confident | 117 Ų | 117 | 93.8 Ų | 93.8 | 63% | 0.626 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -70.9 | -18.8 | 177.5 | -68 | -22.2 | 0 | 0 | 0 | 112.8 | P7 E13 | P7-D11 PolarHBondContact O-N 3.43Å; D11-E13 PolarHBondContact O-N 3.33Å |
| 12 | G | 73 | Confident | 77.7 | Confident | 39 Ų | 39 | 99.2 Ų | 99.2 | 40% | 0.402 | 48% | 0.476 | S | S | . | . | trans | 73 | -12.5 | 169.4 | 0 | 0 | 0 | 0 | 0 | 116.3 | T8 I9 Y10 W14 | T8-G12 PolarHBondContact O-N 2.94Å; I9-G12 PolarHBondContact O-N 3.45Å; Y10-G12 PolarHBondContact O-N 3.09Å; G12-W14 VanDerWaalsContact C-N 3.26Å; G12-W14 PolarHBondContact O-N 3.47Å | ||
| 13 | E | 70.1 | Confident | 77.6 | Confident | 125 Ų | 125 | 97.8 Ų | 97.8 | 58% | 0.584 | 48% | 0.476 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.5 | -18 | -179.1 | -62 | -161 | 149.4 | 0 | 0 | 113.8 | D11 S15 I16 H17 | D11-E13 PolarHBondContact O-N 3.33Å; E13-S15 PolarHBondContact O-N 2.86Å; E13-I16 PolarHBondContact O-N 3.49Å; E13-H17 PolarHBondContact O-CD2 3.17Å |
| 14 | W | 74.1 | Confident | 77.4 | Confident | 58 Ų | 58 | 98.5 Ų | 98.5 | 22% | 0.22 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -57.6 | -34.1 | -178.4 | 68.1 | -86.3 | 0 | 0 | 0 | 113.5 | T8 G12 I16 H17 V18 W20 V82 Y85 | T8-W14 HydrophobicContact CG2-CB 3.86Å; G12-W14 VanDerWaalsContact C-N 3.26Å; G12-W14 PolarHBondContact O-N 3.47Å; W14-I16 PolarHBondContact O-N 3.37Å; W14-I16 VanDerWaalsContact O-N 3.17Å; W14-H17 PolarHBondContact O-N 3.44Å; W14-V18 HydrophobicContact CE3-CG2 4.06Å; W14-V18 WeakPolarHBondContact O-CB 3.42Å; W14-V18 WeakPolarHBondContact O-CG2 3.39Å; W14-V18 PolarHBondContact O-N 2.98Å; W14-V18 VanDerWaalsContact O-N 3.09Å; W14-W20 HydrophobicContact CZ3-CH2 4.29Å; W14-W20 HydrophobicContact CZ3-CZ2 4.17Å; W14-V82 HydrophobicContact CB-CG1 4.16Å; W14-V82 HydrophobicContact CD2-CG1 3.93Å; W14-V82 HydrophobicContact CD2-CG2 4.47Å; W14-V82 HydrophobicContact CE3-CG1 4.02Å; W14-V82 HydrophobicContact CE3-CG2 3.76Å; W14-V82 HydrophobicContact CG-CG1 4.01Å; W14-V82 HydrophobicContact CZ3-CG2 3.9Å; W14-Y85 HydrophobicContact CB-CD1 4.44Å; W14-Y85 HydrophobicContact CB-CE1 4.5Å |
| 15 | S | 71.1 | Confident | 77.4 | Confident | 65 Ų | 65 | 96.6 Ų | 96.6 | 46% | 0.455 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -64.7 | -22.7 | -175.5 | -179.2 | 0 | 0 | 0 | 0 | 113.6 | E13 | E13-S15 PolarHBondContact O-N 2.86Å |
| 16 | I | 69.6 | Low | 77.8 | Confident | 144 Ų | 144 | 102.6 Ų | 102.6 | 74% | 0.738 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -88.7 | -30.4 | -176.7 | -59.9 | 167.5 | 0 | 0 | 0 | 110.7 | E13 W14 | E13-I16 PolarHBondContact O-N 3.49Å; W14-I16 PolarHBondContact O-N 3.37Å; W14-I16 VanDerWaalsContact O-N 3.17Å |
| 17 | H | 71.2 | Confident | 78 | Confident | 113 Ų | 113 | 100.9 Ų | 100.9 | 52% | 0.523 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -94.3 | -18.7 | -176.5 | -66.7 | -69 | 0 | 0 | 0 | 114.1 | E13 W14 V19 Y85 | E13-H17 PolarHBondContact O-CD2 3.17Å; W14-H17 PolarHBondContact O-N 3.44Å; H17-V19 PolarHBondContact O-N 3.34Å; H17-Y85 HydrophobicContact CB-CD2 3.46Å; H17-Y85 VanDerWaalsContact CB-CD2 3.46Å; H17-Y85 HydrophobicContact CB-CE2 3.73Å; H17-Y85 AromaticContact CD2-CE2 3.8Å; H17-Y85 AromaticContact CG-CE2 3.92Å |
| 18 | V | 75.6 | Confident | 78.3 | Confident | 10 Ų | 10 | 99 Ų | 99 | 6% | 0.061 | 48% | 0.48 | C | S | . | . | trans | -69.8 | 117.5 | 175.9 | 161.9 | 0 | 0 | 0 | 0 | 110 | W14 W20 Y81 | W14-V18 HydrophobicContact CE3-CG2 4.06Å; W14-V18 WeakPolarHBondContact O-CB 3.42Å; W14-V18 WeakPolarHBondContact O-CG2 3.39Å; W14-V18 PolarHBondContact O-N 2.98Å; W14-V18 VanDerWaalsContact O-N 3.09Å; V18-W20 HydrophobicContact CG1-CD2 4.04Å; V18-W20 HydrophobicContact CG1-CE3 4.49Å; V18-W20 HydrophobicContact CG1-CG 4.46Å; V18-W20 HydrophobicContact CG1-CH2 4.43Å; V18-W20 HydrophobicContact CG1-CZ2 3.97Å; V18-W20 PolarHBondContact O-N 2.96Å; V18-Y81 HydrophobicContact CB-CE1 4.2Å; V18-Y81 HydrophobicContact CG1-CD1 4.03Å; V18-Y81 HydrophobicContact CG1-CE1 3.6Å; V18-Y81 HydrophobicContact CG2-CD1 4.32Å; V18-Y81 HydrophobicContact CG2-CE1 4.13Å | ||
| 19 | V | 79.2 | Confident | 78.8 | Confident | 56 Ų | 56 | 101 Ų | 101 | 34% | 0.339 | 49% | 0.494 | S | S | . | . | trans | -87.9 | 104.3 | 174.5 | -173.2 | 0 | 0 | 0 | 0 | 109.6 | H17 W21 R22 Y81 | H17-V19 PolarHBondContact O-N 3.34Å; V19-W21 VanDerWaalsContact C-N 3.3Å; V19-W21 PolarHBondContact O-N 3.19Å; V19-R22 HydrophobicContact CB-CG 4.19Å; V19-R22 HydrophobicContact CG1-CG 3.48Å; V19-R22 VanDerWaalsContact CG1-CG 3.48Å; V19-Y81 PolarHBondContact N-OH 2.74Å | ||
| 20 | W | 77.9 | Confident | 79.2 | Confident | 184 Ų | 184 | 99.9 Ų | 99.9 | 70% | 0.697 | 49% | 0.489 | S | S | * | . | S | Bend | trans | -67 | -26.3 | -176.3 | -65 | 94.4 | 0 | 0 | 0 | 114.6 | W14 V18 | W14-W20 HydrophobicContact CZ3-CH2 4.29Å; W14-W20 HydrophobicContact CZ3-CZ2 4.17Å; V18-W20 HydrophobicContact CG1-CD2 4.04Å; V18-W20 HydrophobicContact CG1-CE3 4.49Å; V18-W20 HydrophobicContact CG1-CG 4.46Å; V18-W20 HydrophobicContact CG1-CH2 4.43Å; V18-W20 HydrophobicContact CG1-CZ2 3.97Å; V18-W20 PolarHBondContact O-N 2.96Å |
| 21 | W | 81.4 | Confident | 79.5 | Confident | 212 Ų | 212 | 90 Ų | 90 | 80% | 0.803 | 45% | 0.45 | S | S | * | . | trans | -138.7 | 110.8 | -176.9 | -170.8 | -100.6 | 0 | 0 | 0 | 111.5 | V19 | V19-W21 VanDerWaalsContact C-N 3.3Å; V19-W21 PolarHBondContact O-N 3.19Å | ||
| 22 | R | 80.9 | Confident | 80 | Confident | 160 Ų | 160 | 86.6 Ų | 86.6 | 60% | 0.604 | 43% | 0.432 | S | S | * | . | trans | -131 | 115.2 | 166.5 | -65 | -163.9 | -177.6 | -164.4 | 3.3 | 108.8 | V19 Q24 | V19-R22 HydrophobicContact CB-CG 4.19Å; V19-R22 HydrophobicContact CG1-CG 3.48Å; V19-R22 VanDerWaalsContact CG1-CG 3.48Å; R22-Q24 PolarHBondContact O-N 3.34Å | ||
| 23 | P | 79.9 | Confident | 80.9 | Confident | 90 Ų | 90 | 89.1 Ų | 89.1 | 58% | 0.584 | 44% | 0.439 | S | S | * | . | trans | -75.7 | -15.2 | 177 | 30.5 | -34.3 | 0 | 0 | 0 | 112.5 | G25 F26 | P23-G25 PolarHBondContact O-N 3.25Å; P23-F26 WeakPolarHBondContact O-CB 3.36Å; P23-F26 PolarHBondContact O-N 3.48Å | ||
| 24 | Q | 77.8 | Confident | 81.8 | Confident | 158 Ų | 158 | 85.3 Ų | 85.3 | 74% | 0.738 | 43% | 0.426 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.5 | 126.9 | 175.8 | -67.5 | 164.8 | -15.1 | 0 | 0 | 109.6 | R22 F26 | R22-Q24 PolarHBondContact O-N 3.34Å; Q24-F26 VanDerWaalsContact C-N 3.34Å |
| 25 | G | 80.8 | Confident | 82.4 | Confident | 36 Ų | 36 | 85.6 Ų | 85.6 | 37% | 0.371 | 43% | 0.43 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 82.5 | 1.2 | -178.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | P23 L27 T28 C29 | P23-G25 PolarHBondContact O-N 3.25Å; G25-L27 VanDerWaalsContact C-N 3.26Å; G25-L27 PolarHBondContact O-N 3.29Å; G25-T28 WeakPolarHBondContact CA-OG1 3.14Å; G25-T28 PolarHBondContact O-N 3.17Å; G25-T28 PolarHBondContact O-OG1 3.32Å; G25-C29 PolarHBondContact O-N 2.85Å; G25-C29 PolarHBondContact O-SG 3.36Å; G25-C29 VanDerWaalsContact O-SG 3.36Å |
| 26 | F | 87.1 | Confident | 83.3 | Confident | 125 Ų | 125 | 84.5 Ų | 84.5 | 55% | 0.548 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -55.4 | -42.3 | 177.8 | 177.8 | -101.7 | 0 | 0 | 0 | 112.6 | P23 Q24 T28 C29 L30 | P23-F26 WeakPolarHBondContact O-CB 3.36Å; P23-F26 PolarHBondContact O-N 3.48Å; Q24-F26 VanDerWaalsContact C-N 3.34Å; F26-T28 VanDerWaalsContact C-N 3.29Å; F26-T28 PolarHBondContact O-N 3.38Å; F26-C29 PolarHBondContact O-N 3.09Å; F26-L30 HydrophobicContact CD1-CD1 4.46Å; F26-L30 HydrophobicContact CE1-CD1 3.53Å; F26-L30 HydrophobicContact CE2-CD1 4.43Å; F26-L30 HydrophobicContact CZ-CD1 3.52Å; F26-L30 VanDerWaalsContact O-CB 3.25Å; F26-L30 WeakPolarHBondContact O-CB 3.28Å; F26-L30 PolarHBondContact O-N 3.38Å |
| 27 | L | 86.8 | Confident | 84.2 | Confident | 65 Ų | 65 | 80.1 Ų | 80.1 | 34% | 0.34 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -72.5 | -16.7 | 179.2 | -67.7 | 175.8 | 0 | 0 | 0 | 114 | G25 P31 A237 S238 A241 | G25-L27 VanDerWaalsContact C-N 3.26Å; G25-L27 PolarHBondContact O-N 3.29Å; L27-P31 WeakPolarHBondContact O-CD 3.38Å; L27-A237 HydrophobicContact CD2-CB 4.49Å; L27-S238 WeakPolarHBondContact O-CB 3.45Å; L27-A241 HydrophobicContact CB-CB 3.78Å |
| 28 | T | 86 | Confident | 85 | Confident | 30 Ų | 30 | 76.5 Ų | 76.5 | 18% | 0.184 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -88.9 | -33.4 | 173.1 | 56.2 | 0 | 0 | 0 | 0 | 111.3 | G25 F26 P31 A241 I242 | G25-T28 WeakPolarHBondContact CA-OG1 3.14Å; G25-T28 PolarHBondContact O-N 3.17Å; G25-T28 PolarHBondContact O-OG1 3.32Å; F26-T28 VanDerWaalsContact C-N 3.29Å; F26-T28 PolarHBondContact O-N 3.38Å; T28-P31 WeakPolarHBondContact O-CD 3.46Å; T28-P31 VanDerWaalsContact O-CG 3.28Å; T28-P31 WeakPolarHBondContact O-CG 3.47Å; T28-A241 HydrophobicContact CG2-CB 4.03Å; T28-I242 HydrophobicContact CG2-CG1 4.18Å |
| 29 | C | 88.4 | Confident | 85.5 | Confident | 64 Ų | 64 | 78.5 Ų | 78.5 | 43% | 0.432 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -78.5 | -36.9 | 177 | -58.2 | 0 | 0 | 0 | 0 | 113.5 | G25 F26 I32 V33 | G25-C29 PolarHBondContact O-N 2.85Å; G25-C29 PolarHBondContact O-SG 3.36Å; G25-C29 VanDerWaalsContact O-SG 3.36Å; F26-C29 PolarHBondContact O-N 3.09Å; C29-I32 WeakPolarHBondContact O-CB 3.33Å; C29-I32 PolarHBondContact O-N 3.36Å; C29-I32 VanDerWaalsContact O-N 3.07Å; C29-V33 PolarHBondContact O-N 3.38Å |
| 30 | L | 89.4 | Confident | 85.8 | Confident | 39 Ų | 39 | 79 Ų | 79 | 20% | 0.204 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -50.9 | -49.7 | -179 | -175.5 | 141.8 | 0 | 0 | 0 | 113.9 | F26 I32 V33 C34 I234 | F26-L30 HydrophobicContact CD1-CD1 4.46Å; F26-L30 HydrophobicContact CE1-CD1 3.53Å; F26-L30 HydrophobicContact CE2-CD1 4.43Å; F26-L30 HydrophobicContact CZ-CD1 3.52Å; F26-L30 VanDerWaalsContact O-CB 3.25Å; F26-L30 WeakPolarHBondContact O-CB 3.28Å; F26-L30 PolarHBondContact O-N 3.38Å; L30-I32 VanDerWaalsContact C-N 3.32Å; L30-I32 PolarHBondContact O-N 2.99Å; L30-V33 PolarHBondContact O-N 3.3Å; L30-C34 WeakPolarHBondContact O-CB 3.27Å; L30-C34 PolarHBondContact O-N 3.49Å; L30-C34 PolarHBondContact O-SG 3.41Å; L30-I234 HydrophobicContact CD2-CB 4.28Å; L30-I234 HydrophobicContact CD2-CD1 4.02Å; L30-I234 HydrophobicContact CD2-CG1 3.84Å; L30-I234 HydrophobicContact CD2-CG2 3.47Å; L30-I234 VanDerWaalsContact CD2-CG2 3.47Å |
| 31 | P | 89.9 | Confident | 86.1 | Confident | 0 Ų | 0 | 74.5 Ų | 74.5 | 0% | 0 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -63.9 | -33.8 | 177.6 | 26.1 | -37.9 | 0 | 0 | 0 | 113.4 | L27 T28 C34 M35 G180 A181 I242 | L27-P31 WeakPolarHBondContact O-CD 3.38Å; T28-P31 WeakPolarHBondContact O-CD 3.46Å; T28-P31 VanDerWaalsContact O-CG 3.28Å; T28-P31 WeakPolarHBondContact O-CG 3.47Å; P31-C34 PolarHBondContact O-N 3.44Å; P31-M35 WeakPolarHBondContact O-CB 3.4Å; P31-M35 PolarHBondContact O-N 3.4Å; P31-G180 WeakPolarHBondContact O-CA 3.48Å; P31-A181 HydrophobicContact CB-CB 3.92Å; P31-A181 VanDerWaalsContact CB-N 3.34Å; P31-I242 HydrophobicContact CG-CD1 3.93Å |
| 32 | I | 90.6 | Very high | 86.4 | Confident | 46 Ų | 46 | 69.3 Ų | 69.3 | 24% | 0.236 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -65.6 | -45.8 | 177.6 | -58.7 | 174.1 | 0 | 0 | 0 | 109.7 | C29 L30 M35 A36 E173 L176 | C29-I32 WeakPolarHBondContact O-CB 3.33Å; C29-I32 PolarHBondContact O-N 3.36Å; C29-I32 VanDerWaalsContact O-N 3.07Å; L30-I32 VanDerWaalsContact C-N 3.32Å; L30-I32 PolarHBondContact O-N 2.99Å; I32-M35 WeakPolarHBondContact O-CB 3.44Å; I32-M35 PolarHBondContact O-N 3.48Å; I32-A36 WeakPolarHBondContact O-CB 3.5Å; I32-A36 PolarHBondContact O-N 2.91Å; I32-E173 HydrophobicContact CD1-CG 4Å; I32-L176 HydrophobicContact CG1-CB 4.37Å; I32-L176 HydrophobicContact CG2-CB 4.48Å |
| 33 | V | 90.7 | Very high | 86.7 | Confident | 91 Ų | 91 | 64.8 Ų | 64.8 | 55% | 0.552 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -63.4 | -45.8 | 175.8 | 175.9 | 0 | 0 | 0 | 0 | 110.5 | C29 L30 M35 A36 M37 | C29-V33 PolarHBondContact O-N 3.38Å; L30-V33 PolarHBondContact O-N 3.3Å; V33-M35 VanDerWaalsContact C-N 3.28Å; V33-M35 PolarHBondContact O-N 3.07Å; V33-A36 PolarHBondContact O-N 3.4Å; V33-M37 HydrophobicContact CG1-CG 4.49Å; V33-M37 VanDerWaalsContact O-CG 3.3Å; V33-M37 WeakPolarHBondContact O-CG 3.48Å; V33-M37 PolarHBondContact O-N 2.97Å; V33-M37 VanDerWaalsContact O-N 3.08Å |
| 34 | C | 88.4 | Confident | 87 | Confident | 46 Ų | 46 | 68 Ų | 68 | 31% | 0.311 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -56.1 | -45.2 | 175.5 | -71.5 | 0 | 0 | 0 | 0 | 111.2 | L30 P31 M37 C38 | L30-C34 WeakPolarHBondContact O-CB 3.27Å; L30-C34 PolarHBondContact O-N 3.49Å; L30-C34 PolarHBondContact O-SG 3.41Å; P31-C34 PolarHBondContact O-N 3.44Å; C34-M37 PolarHBondContact O-N 3.42Å; C34-C38 PolarHBondContact O-N 3.06Å; C34-C38 PolarHBondContact O-SG 3.09Å |
| 35 | M | 87.9 | Confident | 87.4 | Confident | 63 Ų | 63 | 64.1 Ų | 64.1 | 31% | 0.31 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -62.7 | -45 | 177.3 | -171.9 | 175.7 | 169.9 | 0 | 0 | 112.8 | P31 I32 V33 M37 C38 L176 T179 | P31-M35 WeakPolarHBondContact O-CB 3.4Å; P31-M35 PolarHBondContact O-N 3.4Å; I32-M35 WeakPolarHBondContact O-CB 3.44Å; I32-M35 PolarHBondContact O-N 3.48Å; V33-M35 VanDerWaalsContact C-N 3.28Å; V33-M35 PolarHBondContact O-N 3.07Å; M35-M37 PolarHBondContact O-N 3.27Å; M35-C38 VanDerWaalsContact O-CB 3.27Å; M35-C38 WeakPolarHBondContact O-CB 3.25Å; M35-C38 PolarHBondContact O-N 3.04Å; M35-L176 HydrophobicContact CE-CD2 4.36Å; M35-L176 HydrophobicContact SD-CD2 4.38Å; M35-T179 HydrophobicContact CE-CG2 3.47Å; M35-T179 VanDerWaalsContact CE-CG2 3.47Å; M35-T179 HydrophobicContact SD-CG2 3.77Å |
| 36 | A | 90.5 | Very high | 87.7 | Confident | 42 Ų | 42 | 65.4 Ų | 65.4 | 35% | 0.347 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -61.3 | -32 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112 | I32 V33 C38 Y73 | I32-A36 WeakPolarHBondContact O-CB 3.5Å; I32-A36 PolarHBondContact O-N 2.91Å; V33-A36 PolarHBondContact O-N 3.4Å; A36-C38 VanDerWaalsContact C-N 3.35Å; A36-Y73 HydrophobicContact CB-CD2 4.3Å; A36-Y73 HydrophobicContact CB-CE2 3.76Å |
| 37 | M | 88.7 | Confident | 87.7 | Confident | 52 Ų | 52 | 62.3 Ų | 62.3 | 26% | 0.256 | 35% | 0.35 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.2 | -2.9 | 176.6 | -58.4 | -54.7 | -63.2 | 0 | 0 | 113.4 | V33 C34 M35 C39 I66 A70 Y73 | V33-M37 HydrophobicContact CG1-CG 4.49Å; V33-M37 VanDerWaalsContact O-CG 3.3Å; V33-M37 WeakPolarHBondContact O-CG 3.48Å; V33-M37 PolarHBondContact O-N 2.97Å; V33-M37 VanDerWaalsContact O-N 3.08Å; C34-M37 PolarHBondContact O-N 3.42Å; M35-M37 PolarHBondContact O-N 3.27Å; M37-C39 PolarHBondContact O-N 3.39Å; M37-I66 HydrophobicContact CE-CB 4.47Å; M37-I66 HydrophobicContact CE-CG2 3.44Å; M37-I66 VanDerWaalsContact CE-CG2 3.44Å; M37-A70 HydrophobicContact CE-CB 3.81Å; M37-A70 HydrophobicContact SD-CB 4.36Å; M37-Y73 HydrophobicContact SD-CD2 3.97Å; M37-Y73 HydrophobicContact SD-CE2 4.19Å |
| 38 | C | 86.4 | Confident | 87.8 | Confident | 38 Ų | 38 | 64.3 Ų | 64.3 | 26% | 0.257 | 37% | 0.369 | S | S | . | . | trans | -76.3 | 109.4 | 178.8 | -75 | 0 | 0 | 0 | 0 | 111.9 | C34 M35 A36 | C34-C38 PolarHBondContact O-N 3.06Å; C34-C38 PolarHBondContact O-SG 3.09Å; M35-C38 VanDerWaalsContact O-CB 3.27Å; M35-C38 WeakPolarHBondContact O-CB 3.25Å; M35-C38 PolarHBondContact O-N 3.04Å; A36-C38 VanDerWaalsContact C-N 3.35Å | ||
| 39 | C | 86.3 | Confident | 87.9 | Confident | 52 Ų | 52 | 68.2 Ų | 68.2 | 35% | 0.351 | 40% | 0.396 | S | S | . | . | trans | -121.8 | 9.5 | 172.5 | 54.2 | 0 | 0 | 0 | 0 | 113 | M37 T41 Q42 L43 | M37-C39 PolarHBondContact O-N 3.39Å; C39-T41 VanDerWaalsContact C-N 3.27Å; C39-T41 PolarHBondContact O-N 2.95Å; C39-Q42 PolarHBondContact O-N 2.86Å; C39-Q42 VanDerWaalsContact O-N 3.16Å; C39-Q42 PolarHBondContact O-OE1 3.34Å; C39-L43 PolarHBondContact O-N 3.3Å | ||
| 40 | Q | 86.8 | Confident | 87.9 | Confident | 65 Ų | 65 | 66.9 Ų | 66.9 | 30% | 0.304 | 39% | 0.385 | S | S | . | . | G | 310 helix | trans | -65.3 | -31.4 | -168.9 | -53.1 | 83.9 | -8.5 | 0 | 0 | 112.2 | Q42 L43 V187 | Q40-Q42 VanDerWaalsContact C-N 3.28Å; Q40-Q42 PolarHBondContact O-N 3.47Å; Q40-L43 VanDerWaalsContact O-CB 3.31Å; Q40-L43 WeakPolarHBondContact O-CB 3.44Å; Q40-L43 PolarHBondContact O-N 3.36Å; Q40-V187 HydrophobicContact CB-CG1 3.97Å |
| 41 | T | 84.4 | Confident | 87.6 | Confident | 90 Ų | 90 | 73.5 Ų | 73.5 | 55% | 0.552 | 41% | 0.412 | S | S | * | . | G | 310 helix | trans | -72.5 | -22.7 | -179.3 | 57 | 0 | 0 | 0 | 0 | 112.6 | C39 V187 | C39-T41 VanDerWaalsContact C-N 3.27Å; C39-T41 PolarHBondContact O-N 2.95Å; T41-V187 HydrophobicContact CG2-CG1 4.1Å |
| 42 | Q | 86.9 | Confident | 87.3 | Confident | 104 Ų | 104 | 78.7 Ų | 78.7 | 49% | 0.486 | 44% | 0.44 | S | S | . | . | G | 310 helix | trans | -90.6 | -5.7 | 176.3 | -66.3 | 74.8 | 24.9 | 0 | 0 | 113.2 | C39 Q40 F44 P45 V46 | C39-Q42 PolarHBondContact O-N 2.86Å; C39-Q42 VanDerWaalsContact O-N 3.16Å; C39-Q42 PolarHBondContact O-OE1 3.34Å; Q40-Q42 VanDerWaalsContact C-N 3.28Å; Q40-Q42 PolarHBondContact O-N 3.47Å; Q42-F44 PolarHBondContact O-N 3.41Å; Q42-P45 VanDerWaalsContact O-CD 3.29Å; Q42-P45 WeakPolarHBondContact O-CD 3.19Å; Q42-V46 VanDerWaalsContact O-CG2 3.29Å; Q42-V46 WeakPolarHBondContact O-CG2 3.38Å; Q42-V46 PolarHBondContact O-N 3.05Å |
| 43 | L | 87.7 | Confident | 86.9 | Confident | 64 Ų | 64 | 79.1 Ų | 79.1 | 34% | 0.335 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -60.1 | -44.4 | -174.7 | -175.3 | 59.7 | 0 | 0 | 0 | 112.3 | C39 Q40 V46 L47 V58 V62 | C39-L43 PolarHBondContact O-N 3.3Å; Q40-L43 VanDerWaalsContact O-CB 3.31Å; Q40-L43 WeakPolarHBondContact O-CB 3.44Å; Q40-L43 PolarHBondContact O-N 3.36Å; L43-V46 PolarHBondContact O-N 3.38Å; L43-L47 HydrophobicContact CD1-CD1 3.46Å; L43-L47 VanDerWaalsContact CD1-CD1 3.46Å; L43-L47 HydrophobicContact CG-CD1 3.7Å; L43-L47 VanDerWaalsContact O-CD1 3.23Å; L43-L47 WeakPolarHBondContact O-CD1 3.48Å; L43-L47 PolarHBondContact O-N 3.39Å; L43-V58 HydrophobicContact CD1-CG1 4.33Å; L43-V62 HydrophobicContact CD1-CG2 3.8Å |
| 44 | F | 86 | Confident | 86.8 | Confident | 157 Ų | 157 | 78 Ų | 78 | 69% | 0.689 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -63.6 | -46.8 | -177.5 | -63.8 | -75.2 | 0 | 0 | 0 | 114.3 | Q42 V46 L47 S48 | Q42-F44 PolarHBondContact O-N 3.41Å; F44-V46 VanDerWaalsContact C-N 3.31Å; F44-V46 PolarHBondContact O-N 3.23Å; F44-L47 PolarHBondContact O-N 2.92Å; F44-S48 PolarHBondContact O-N 3.33Å; F44-S48 PolarHBondContact O-OG 3.26Å; F44-S48 VanDerWaalsContact O-OG 3.13Å |
| 45 | P | 85.4 | Confident | 86.7 | Confident | 78 Ų | 78 | 81.5 Ų | 81.5 | 51% | 0.506 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -55.8 | -43.8 | 169.4 | -27.2 | 32.1 | 0 | 0 | 0 | 113.1 | Q42 L47 S48 C49 | Q42-P45 VanDerWaalsContact O-CD 3.29Å; Q42-P45 WeakPolarHBondContact O-CD 3.19Å; P45-L47 PolarHBondContact O-N 3.37Å; P45-S48 WeakPolarHBondContact O-CB 3.43Å; P45-S48 PolarHBondContact O-N 2.85Å; P45-S48 VanDerWaalsContact O-N 3.15Å; P45-C49 PolarHBondContact O-N 3.47Å; P45-C49 PolarHBondContact O-SG 2.94Å |
| 46 | V | 87.6 | Confident | 86.7 | Confident | 63 Ų | 63 | 84.8 Ų | 84.8 | 38% | 0.382 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64.8 | -41 | -178.7 | 172.7 | 0 | 0 | 0 | 0 | 111.6 | Q42 L43 F44 S48 C49 I50 | Q42-V46 VanDerWaalsContact O-CG2 3.29Å; Q42-V46 WeakPolarHBondContact O-CG2 3.38Å; Q42-V46 PolarHBondContact O-N 3.05Å; L43-V46 PolarHBondContact O-N 3.38Å; F44-V46 VanDerWaalsContact C-N 3.31Å; F44-V46 PolarHBondContact O-N 3.23Å; V46-S48 PolarHBondContact O-N 3.45Å; V46-C49 WeakPolarHBondContact O-CB 3.32Å; V46-C49 PolarHBondContact O-N 3.11Å; V46-I50 HydrophobicContact CG1-CD1 4.18Å; V46-I50 PolarHBondContact O-N 3.12Å |
| 47 | L | 88.3 | Confident | 86.6 | Confident | 60 Ų | 60 | 89.1 Ų | 89.1 | 31% | 0.314 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -56.4 | -36.9 | 174.5 | -101.3 | 71 | 0 | 0 | 0 | 112.2 | L43 F44 P45 C49 I50 V58 | L43-L47 HydrophobicContact CD1-CD1 3.46Å; L43-L47 VanDerWaalsContact CD1-CD1 3.46Å; L43-L47 HydrophobicContact CG-CD1 3.7Å; L43-L47 VanDerWaalsContact O-CD1 3.23Å; L43-L47 WeakPolarHBondContact O-CD1 3.48Å; L43-L47 PolarHBondContact O-N 3.39Å; F44-L47 PolarHBondContact O-N 2.92Å; P45-L47 PolarHBondContact O-N 3.37Å; L47-C49 PolarHBondContact O-N 2.91Å; L47-I50 PolarHBondContact O-N 3.07Å; L47-V58 HydrophobicContact CD1-CG1 3.62Å; L47-V58 HydrophobicContact CD1-CG2 4.29Å; L47-V58 HydrophobicContact CG-CG1 4.35Å; L47-V58 HydrophobicContact CG-CG2 4.17Å |
| 48 | S | 87.6 | Confident | 86.7 | Confident | 106 Ų | 106 | 87.6 Ų | 87.6 | 74% | 0.741 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -71 | -18 | -179.5 | -53.9 | 0 | 0 | 0 | 0 | 112.6 | F44 P45 V46 | F44-S48 PolarHBondContact O-N 3.33Å; F44-S48 PolarHBondContact O-OG 3.26Å; F44-S48 VanDerWaalsContact O-OG 3.13Å; P45-S48 WeakPolarHBondContact O-CB 3.43Å; P45-S48 PolarHBondContact O-N 2.85Å; P45-S48 VanDerWaalsContact O-N 3.15Å; V46-S48 PolarHBondContact O-N 3.45Å |
| 49 | C | 88.5 | Confident | 86.9 | Confident | 112 Ų | 112 | 91 Ų | 91 | 76% | 0.757 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -90.6 | -17.5 | 176.1 | -60.3 | 0 | 0 | 0 | 0 | 113.2 | P45 V46 L47 | P45-C49 PolarHBondContact O-N 3.47Å; P45-C49 PolarHBondContact O-SG 2.94Å; V46-C49 WeakPolarHBondContact O-CB 3.32Å; V46-C49 PolarHBondContact O-N 3.11Å; L47-C49 PolarHBondContact O-N 2.91Å |
| 50 | I | 88.6 | Confident | 87.1 | Confident | 37 Ų | 37 | 96.2 Ų | 96.2 | 19% | 0.19 | 51% | 0.512 | C | S | . | . | S | Bend | trans | -83.9 | 120.7 | -178.2 | -64.2 | 169 | 0 | 0 | 0 | 109.4 | V46 L47 D52 A53 V58 | V46-I50 HydrophobicContact CG1-CD1 4.18Å; V46-I50 PolarHBondContact O-N 3.12Å; L47-I50 PolarHBondContact O-N 3.07Å; I50-D52 PolarHBondContact O-N 2.89Å; I50-A53 HydrophobicContact CB-CB 4.47Å; I50-A53 HydrophobicContact CG2-CB 4.42Å; I50-V58 HydrophobicContact CD1-CG2 4.11Å |
| 51 | K | 82.6 | Confident | 87.3 | Confident | 178 Ų | 178 | 96 Ų | 96 | 77% | 0.774 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.1 | 125.1 | 173.6 | -168.1 | 175.4 | -179 | -179.4 | 0 | 109.7 | ||
| 52 | D | 83.1 | Confident | 87.6 | Confident | 109 Ų | 109 | 93.4 Ų | 93.4 | 58% | 0.583 | 50% | 0.499 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55 | 68.8 | -174.8 | -51.2 | -42.3 | 0 | 0 | 0 | 112.2 | I50 T54 | I50-D52 PolarHBondContact O-N 2.89Å; D52-T54 PolarHBondContact O-N 3.25Å |
| 53 | A | 82.3 | Confident | 87.8 | Confident | 54 Ų | 54 | 90.9 Ų | 90.9 | 45% | 0.446 | 49% | 0.493 | S | S | . | . | trans | -69.1 | 71.8 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | I50 V58 | I50-A53 HydrophobicContact CB-CB 4.47Å; I50-A53 HydrophobicContact CG2-CB 4.42Å; A53-V58 HydrophobicContact CB-CG2 4.16Å | ||
| 54 | T | 89.1 | Confident | 88.1 | Confident | 69 Ų | 69 | 90.6 Ų | 90.6 | 42% | 0.423 | 49% | 0.492 | S | S | . | . | trans | -75.6 | 145.6 | 165.7 | 55.8 | 0 | 0 | 0 | 0 | 110.2 | D52 D56 R57 V58 | D52-T54 PolarHBondContact O-N 3.25Å; T54-D56 VanDerWaalsContact C-N 3.28Å; T54-D56 PolarHBondContact O-N 2.85Å; T54-R57 PolarHBondContact O-N 3.26Å; T54-R57 WeakPolarHBondContact OG1-CB 3.36Å; T54-R57 WeakPolarHBondContact OG1-CD 3.29Å; T54-R57 VanDerWaalsContact OG1-CG 3.23Å; T54-R57 WeakPolarHBondContact OG1-CG 3.15Å; T54-V58 PolarHBondContact O-N 3.47Å; T54-V58 VanDerWaalsContact O-N 3.1Å | ||
| 55 | T | 87 | Confident | 88.4 | Confident | 118 Ų | 118 | 86.5 Ų | 86.5 | 72% | 0.724 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -51 | -44 | -178.1 | -50.2 | 0 | 0 | 0 | 0 | 113.1 | R57 V58 D59 | T55-R57 PolarHBondContact O-N 3.13Å; T55-V58 PolarHBondContact O-N 2.89Å; T55-D59 WeakPolarHBondContact O-CB 3.25Å; T55-D59 PolarHBondContact O-N 3.2Å |
| 56 | D | 87.9 | Confident | 88.8 | Confident | 133 Ų | 133 | 85.4 Ų | 85.4 | 71% | 0.711 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -65.9 | -36.6 | -178.3 | -56 | -25.3 | 0 | 0 | 0 | 113 | T54 Y60 | T54-D56 VanDerWaalsContact C-N 3.28Å; T54-D56 PolarHBondContact O-N 2.85Å; D56-Y60 WeakPolarHBondContact O-CB 3.31Å; D56-Y60 PolarHBondContact O-N 2.97Å |
| 57 | R | 88.6 | Confident | 89.1 | Confident | 133 Ų | 133 | 87 Ų | 87 | 50% | 0.502 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -70.8 | -42.3 | 177.4 | -72.8 | -180 | 178.2 | 176.2 | 0.1 | 111.4 | T54 T55 D59 Y60 V61 | T54-R57 PolarHBondContact O-N 3.26Å; T54-R57 WeakPolarHBondContact OG1-CB 3.36Å; T54-R57 WeakPolarHBondContact OG1-CD 3.29Å; T54-R57 VanDerWaalsContact OG1-CG 3.23Å; T54-R57 WeakPolarHBondContact OG1-CG 3.15Å; T55-R57 PolarHBondContact O-N 3.13Å; R57-D59 VanDerWaalsContact C-N 3.35Å; R57-Y60 PolarHBondContact O-N 3.24Å; R57-V61 VanDerWaalsContact O-CG2 3.29Å; R57-V61 WeakPolarHBondContact O-CG2 3.32Å; R57-V61 PolarHBondContact O-N 3.02Å |
| 58 | V | 90.4 | Very high | 89.5 | Confident | 19 Ų | 19 | 89.3 Ų | 89.3 | 12% | 0.115 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -62 | -46.9 | 176.4 | 173.1 | 0 | 0 | 0 | 0 | 109.6 | L43 L47 I50 A53 T54 T55 Y60 V61 V62 | L43-V58 HydrophobicContact CD1-CG1 4.33Å; L47-V58 HydrophobicContact CD1-CG1 3.62Å; L47-V58 HydrophobicContact CD1-CG2 4.29Å; L47-V58 HydrophobicContact CG-CG1 4.35Å; L47-V58 HydrophobicContact CG-CG2 4.17Å; I50-V58 HydrophobicContact CD1-CG2 4.11Å; A53-V58 HydrophobicContact CB-CG2 4.16Å; T54-V58 PolarHBondContact O-N 3.47Å; T54-V58 VanDerWaalsContact O-N 3.1Å; T55-V58 PolarHBondContact O-N 2.89Å; V58-Y60 PolarHBondContact O-N 2.86Å; V58-V61 PolarHBondContact O-N 3.41Å; V58-V62 HydrophobicContact CG1-CG2 4.23Å; V58-V62 WeakPolarHBondContact O-CB 3.5Å; V58-V62 VanDerWaalsContact O-CG2 3.26Å; V58-V62 WeakPolarHBondContact O-CG2 3.38Å; V58-V62 PolarHBondContact O-N 3.47Å |
| 59 | D | 89.4 | Confident | 89.8 | Confident | 109 Ų | 109 | 86.1 Ų | 86.1 | 58% | 0.583 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -60.9 | -45 | 178.2 | -170.4 | 57.2 | 0 | 0 | 0 | 111.8 | T55 R57 V61 V62 S63 | T55-D59 WeakPolarHBondContact O-CB 3.25Å; T55-D59 PolarHBondContact O-N 3.2Å; R57-D59 VanDerWaalsContact C-N 3.35Å; D59-V61 PolarHBondContact O-N 3.2Å; D59-V62 PolarHBondContact O-N 3.43Å; D59-S63 WeakPolarHBondContact O-CB 3.47Å; D59-S63 PolarHBondContact O-N 3.33Å |
| 60 | Y | 90.8 | Very high | 90 | Very high | 162 Ų | 162 | 82.5 Ų | 82.5 | 64% | 0.635 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -59.1 | -45.1 | 175.4 | 179.9 | -96.3 | 0 | 0 | 0 | 112.9 | D56 R57 V58 N64 | D56-Y60 WeakPolarHBondContact O-CB 3.31Å; D56-Y60 PolarHBondContact O-N 2.97Å; R57-Y60 PolarHBondContact O-N 3.24Å; V58-Y60 PolarHBondContact O-N 2.86Å; Y60-N64 WeakPolarHBondContact CE1-ND2 3.41Å; Y60-N64 WeakPolarHBondContact CE2-ND2 3.41Å; Y60-N64 WeakPolarHBondContact O-CB 3.23Å; Y60-N64 PolarHBondContact O-N 2.98Å; Y60-N64 VanDerWaalsContact O-N 3.11Å; Y60-N64 PolarHBondContact O-ND2 3.01Å |
| 61 | V | 91.8 | Very high | 90.4 | Very high | 60 Ų | 60 | 83.6 Ų | 83.6 | 36% | 0.364 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -67.4 | -45.9 | -179.8 | 170.9 | 0 | 0 | 0 | 0 | 110.9 | R57 V58 D59 S65 | R57-V61 VanDerWaalsContact O-CG2 3.29Å; R57-V61 WeakPolarHBondContact O-CG2 3.32Å; R57-V61 PolarHBondContact O-N 3.02Å; V58-V61 PolarHBondContact O-N 3.41Å; D59-V61 PolarHBondContact O-N 3.2Å; V61-S65 WeakPolarHBondContact O-CB 3.43Å; V61-S65 PolarHBondContact O-N 3Å; V61-S65 PolarHBondContact O-OG 2.97Å |
| 62 | V | 90.8 | Very high | 90.9 | Very high | 37 Ų | 37 | 81 Ų | 81 | 22% | 0.224 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -65.7 | -47.7 | -179.5 | 171.2 | 0 | 0 | 0 | 0 | 110.4 | L43 V58 D59 N64 S65 I66 | L43-V62 HydrophobicContact CD1-CG2 3.8Å; V58-V62 HydrophobicContact CG1-CG2 4.23Å; V58-V62 WeakPolarHBondContact O-CB 3.5Å; V58-V62 VanDerWaalsContact O-CG2 3.26Å; V58-V62 WeakPolarHBondContact O-CG2 3.38Å; V58-V62 PolarHBondContact O-N 3.47Å; D59-V62 PolarHBondContact O-N 3.43Å; V62-N64 PolarHBondContact O-N 3.35Å; V62-S65 PolarHBondContact O-N 2.91Å; V62-S65 VanDerWaalsContact O-N 3.16Å; V62-I66 HydrophobicContact CG1-CD1 3.62Å; V62-I66 HydrophobicContact CG1-CG1 4.3Å; V62-I66 WeakPolarHBondContact O-CB 3.33Å; V62-I66 VanDerWaalsContact O-CG1 3.3Å; V62-I66 WeakPolarHBondContact O-CG1 3.38Å; V62-I66 PolarHBondContact O-N 3.01Å |
| 63 | S | 91.1 | Very high | 91.4 | Very high | 50 Ų | 50 | 81.5 Ų | 81.5 | 35% | 0.35 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -59.4 | -46.7 | 179.7 | -177.9 | 0 | 0 | 0 | 0 | 112 | D59 S65 I66 N67 | D59-S63 WeakPolarHBondContact O-CB 3.47Å; D59-S63 PolarHBondContact O-N 3.33Å; S63-S65 PolarHBondContact O-N 3.05Å; S63-I66 PolarHBondContact O-N 3.39Å; S63-N67 WeakPolarHBondContact O-CB 3.41Å; S63-N67 VanDerWaalsContact O-CG 3.24Å; S63-N67 PolarHBondContact O-N 3.16Å; S63-N67 PolarHBondContact O-ND2 3.15Å |
| 64 | N | 93.6 | Very high | 91.9 | Very high | 59 Ų | 59 | 81.7 Ų | 81.7 | 32% | 0.316 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -62.9 | -40.3 | 175.2 | -79.5 | -53.2 | 0 | 0 | 0 | 112.8 | Y60 V62 N67 I68 | Y60-N64 WeakPolarHBondContact CE1-ND2 3.41Å; Y60-N64 WeakPolarHBondContact CE2-ND2 3.41Å; Y60-N64 WeakPolarHBondContact O-CB 3.23Å; Y60-N64 PolarHBondContact O-N 2.98Å; Y60-N64 VanDerWaalsContact O-N 3.11Å; Y60-N64 PolarHBondContact O-ND2 3.01Å; V62-N64 PolarHBondContact O-N 3.35Å; N64-N67 PolarHBondContact O-N 3Å; N64-I68 VanDerWaalsContact O-CG1 3.31Å; N64-I68 WeakPolarHBondContact O-CG1 3.34Å; N64-I68 PolarHBondContact O-N 3.03Å |
| 65 | S | 93.2 | Very high | 92.1 | Very high | 71 Ų | 71 | 80.2 Ų | 80.2 | 50% | 0.497 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -63.9 | -43.7 | 178.8 | -57.2 | 0 | 0 | 0 | 0 | 111.6 | V61 V62 S63 I68 C69 | V61-S65 WeakPolarHBondContact O-CB 3.43Å; V61-S65 PolarHBondContact O-N 3Å; V61-S65 PolarHBondContact O-OG 2.97Å; V62-S65 PolarHBondContact O-N 2.91Å; V62-S65 VanDerWaalsContact O-N 3.16Å; S63-S65 PolarHBondContact O-N 3.05Å; S65-I68 PolarHBondContact O-N 3.46Å; S65-C69 WeakPolarHBondContact O-CB 3.4Å; S65-C69 PolarHBondContact O-N 3.01Å |
| 66 | I | 92.7 | Very high | 92.3 | Very high | 55 Ų | 55 | 78.7 Ų | 78.7 | 28% | 0.282 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -63.2 | -43.7 | 176.1 | -71.1 | 175 | 0 | 0 | 0 | 110.6 | M37 V62 S63 C69 A70 | M37-I66 HydrophobicContact CE-CB 4.47Å; M37-I66 HydrophobicContact CE-CG2 3.44Å; M37-I66 VanDerWaalsContact CE-CG2 3.44Å; V62-I66 HydrophobicContact CG1-CD1 3.62Å; V62-I66 HydrophobicContact CG1-CG1 4.3Å; V62-I66 WeakPolarHBondContact O-CB 3.33Å; V62-I66 VanDerWaalsContact O-CG1 3.3Å; V62-I66 WeakPolarHBondContact O-CG1 3.38Å; V62-I66 PolarHBondContact O-N 3.01Å; S63-I66 PolarHBondContact O-N 3.39Å; I66-C69 WeakPolarHBondContact O-CB 3.49Å; I66-C69 PolarHBondContact O-N 3.05Å; I66-A70 WeakPolarHBondContact O-CB 3.26Å; I66-A70 PolarHBondContact O-N 2.87Å |
| 67 | N | 94.1 | Very high | 92.4 | Very high | 95 Ų | 95 | 74.5 Ų | 74.5 | 51% | 0.508 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -63.5 | -42.1 | 178.7 | -73.7 | -28.6 | 0 | 0 | 0 | 112.6 | S63 N64 C69 A70 A71 | S63-N67 WeakPolarHBondContact O-CB 3.41Å; S63-N67 VanDerWaalsContact O-CG 3.24Å; S63-N67 PolarHBondContact O-N 3.16Å; S63-N67 PolarHBondContact O-ND2 3.15Å; N64-N67 PolarHBondContact O-N 3Å; N67-C69 VanDerWaalsContact C-N 3.35Å; N67-A70 PolarHBondContact O-N 2.66Å; N67-A71 WeakPolarHBondContact O-CB 3.25Å; N67-A71 PolarHBondContact O-N 2.95Å |
| 68 | I | 95.5 | Very high | 92.3 | Very high | 109 Ų | 109 | 72.3 Ų | 72.3 | 56% | 0.559 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -64.2 | -42.9 | 175.6 | -67 | 165.9 | 0 | 0 | 0 | 110.4 | N64 S65 A71 M72 | N64-I68 VanDerWaalsContact O-CG1 3.31Å; N64-I68 WeakPolarHBondContact O-CG1 3.34Å; N64-I68 PolarHBondContact O-N 3.03Å; S65-I68 PolarHBondContact O-N 3.46Å; I68-A71 PolarHBondContact O-N 3.4Å; I68-M72 PolarHBondContact O-N 3.48Å |
| 69 | C | 94.5 | Very high | 92.2 | Very high | 39 Ų | 39 | 74.2 Ų | 74.2 | 26% | 0.264 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -60.8 | -48.5 | 176.6 | -167.9 | 0 | 0 | 0 | 0 | 111.6 | S65 I66 N67 A71 M72 Y73 | S65-C69 WeakPolarHBondContact O-CB 3.4Å; S65-C69 PolarHBondContact O-N 3.01Å; I66-C69 WeakPolarHBondContact O-CB 3.49Å; I66-C69 PolarHBondContact O-N 3.05Å; N67-C69 VanDerWaalsContact C-N 3.35Å; C69-A71 VanDerWaalsContact C-N 3.33Å; C69-A71 PolarHBondContact O-N 3.22Å; C69-M72 PolarHBondContact O-N 3.26Å; C69-Y73 PolarHBondContact O-N 3.49Å; C69-Y73 WeakPolarHBondContact SG-CE2 3.39Å; C69-Y73 VanDerWaalsContact SG-CZ 3.59Å |
| 70 | A | 93.9 | Very high | 92.2 | Very high | 36 Ų | 36 | 69.4 Ų | 69.4 | 30% | 0.298 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -59.1 | -42.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | M37 I66 N67 M72 Y73 A74 | M37-A70 HydrophobicContact CE-CB 3.81Å; M37-A70 HydrophobicContact SD-CB 4.36Å; I66-A70 WeakPolarHBondContact O-CB 3.26Å; I66-A70 PolarHBondContact O-N 2.87Å; N67-A70 PolarHBondContact O-N 2.66Å; A70-M72 PolarHBondContact O-N 3.44Å; A70-Y73 PolarHBondContact O-N 3.44Å; A70-A74 VanDerWaalsContact O-CB 3.29Å; A70-A74 WeakPolarHBondContact O-CB 3.42Å; A70-A74 PolarHBondContact O-N 2.98Å |
| 71 | A | 95.2 | Very high | 91.9 | Very high | 61 Ų | 61 | 65.7 Ų | 65.7 | 50% | 0.504 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -63.3 | -40.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112 | N67 I68 C69 A74 A75 | N67-A71 WeakPolarHBondContact O-CB 3.25Å; N67-A71 PolarHBondContact O-N 2.95Å; I68-A71 PolarHBondContact O-N 3.4Å; C69-A71 VanDerWaalsContact C-N 3.33Å; C69-A71 PolarHBondContact O-N 3.22Å; A71-A74 PolarHBondContact O-N 3.49Å; A71-A75 WeakPolarHBondContact O-CB 3.4Å; A71-A75 PolarHBondContact O-N 3.25Å |
| 72 | M | 94.9 | Very high | 91.6 | Very high | 122 Ų | 122 | 63.2 Ų | 63.2 | 60% | 0.601 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -66.2 | -44.1 | 175.3 | -76.1 | -144.4 | -85.5 | 0 | 0 | 112.2 | I68 C69 A70 A75 V76 | I68-M72 PolarHBondContact O-N 3.48Å; C69-M72 PolarHBondContact O-N 3.26Å; A70-M72 PolarHBondContact O-N 3.44Å; M72-A75 PolarHBondContact O-N 3.12Å; M72-V76 WeakPolarHBondContact O-CG2 3.34Å; M72-V76 PolarHBondContact O-N 3.01Å |
| 73 | Y | 93.8 | Very high | 91.3 | Very high | 121 Ų | 121 | 62 Ų | 62 | 48% | 0.475 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -62.9 | -41.8 | 175.3 | -68.6 | -24.2 | 0 | 0 | 0 | 112.3 | A36 M37 C69 A70 V76 G77 | A36-Y73 HydrophobicContact CB-CD2 4.3Å; A36-Y73 HydrophobicContact CB-CE2 3.76Å; M37-Y73 HydrophobicContact SD-CD2 3.97Å; M37-Y73 HydrophobicContact SD-CE2 4.19Å; C69-Y73 PolarHBondContact O-N 3.49Å; C69-Y73 WeakPolarHBondContact SG-CE2 3.39Å; C69-Y73 VanDerWaalsContact SG-CZ 3.59Å; A70-Y73 PolarHBondContact O-N 3.44Å; Y73-V76 PolarHBondContact O-N 3.12Å; Y73-G77 PolarHBondContact O-N 2.87Å |
| 74 | A | 92.5 | Very high | 90.9 | Very high | 58 Ų | 58 | 60.3 Ų | 60.3 | 48% | 0.479 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -61.9 | -45.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | A70 A71 G77 V78 | A70-A74 VanDerWaalsContact O-CB 3.29Å; A70-A74 WeakPolarHBondContact O-CB 3.42Å; A70-A74 PolarHBondContact O-N 2.98Å; A71-A74 PolarHBondContact O-N 3.49Å; A74-G77 PolarHBondContact O-N 3.47Å; A74-V78 WeakPolarHBondContact O-CB 3.45Å; A74-V78 VanDerWaalsContact O-CG2 3.25Å; A74-V78 WeakPolarHBondContact O-CG2 3.32Å; A74-V78 PolarHBondContact O-N 3.41Å |
| 75 | A | 92.1 | Very high | 90.2 | Very high | 38 Ų | 38 | 61.1 Ų | 61.1 | 31% | 0.314 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -60.4 | -51.2 | 177 | 0 | 0 | 0 | 0 | 0 | 111.4 | A71 M72 G77 V78 F79 | A71-A75 WeakPolarHBondContact O-CB 3.4Å; A71-A75 PolarHBondContact O-N 3.25Å; M72-A75 PolarHBondContact O-N 3.12Å; A75-G77 VanDerWaalsContact C-N 3.32Å; A75-G77 PolarHBondContact O-N 3.36Å; A75-V78 PolarHBondContact O-N 3.29Å; A75-F79 HydrophobicContact CB-CD2 4.36Å; A75-F79 HydrophobicContact CB-CE2 4.3Å; A75-F79 WeakPolarHBondContact O-CB 3.36Å; A75-F79 WeakPolarHBondContact O-CD2 3.33Å; A75-F79 PolarHBondContact O-N 3.18Å |
| 76 | V | 90.9 | Very high | 89.2 | Confident | 86 Ų | 86 | 61.4 Ų | 61.4 | 52% | 0.521 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -61.7 | -40.8 | 179.3 | 173.7 | 0 | 0 | 0 | 0 | 111.4 | M1 M72 Y73 G80 | M1-V76 HydrophobicContact CG-CG1 4.5Å; M72-V76 WeakPolarHBondContact O-CG2 3.34Å; M72-V76 PolarHBondContact O-N 3.01Å; Y73-V76 PolarHBondContact O-N 3.12Å; V76-G80 PolarHBondContact O-N 3.4Å |
| 77 | G | 89.8 | Confident | 88.3 | Confident | 44 Ų | 44 | 63.7 Ų | 63.7 | 45% | 0.454 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -64.4 | -47.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y73 A74 A75 G80 Y81 | Y73-G77 PolarHBondContact O-N 2.87Å; A74-G77 PolarHBondContact O-N 3.47Å; A75-G77 VanDerWaalsContact C-N 3.32Å; A75-G77 PolarHBondContact O-N 3.36Å; G77-G80 PolarHBondContact O-N 3.33Å; G77-Y81 WeakPolarHBondContact O-CB 3.33Å; G77-Y81 PolarHBondContact O-N 3.28Å |
| 78 | V | 88.1 | Confident | 87.3 | Confident | 87 Ų | 87 | 65.9 Ų | 65.9 | 53% | 0.527 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -64.6 | -50.7 | 178.6 | 171.7 | 0 | 0 | 0 | 0 | 110.9 | A74 A75 G80 Y81 V82 | A74-V78 WeakPolarHBondContact O-CB 3.45Å; A74-V78 VanDerWaalsContact O-CG2 3.25Å; A74-V78 WeakPolarHBondContact O-CG2 3.32Å; A74-V78 PolarHBondContact O-N 3.41Å; A75-V78 PolarHBondContact O-N 3.29Å; V78-G80 VanDerWaalsContact C-N 3.3Å; V78-G80 PolarHBondContact O-N 3.17Å; V78-Y81 PolarHBondContact O-N 3.36Å; V78-V82 WeakPolarHBondContact O-CG2 3.47Å; V78-V82 PolarHBondContact O-N 3.27Å |
| 79 | F | 88.4 | Confident | 86.3 | Confident | 59 Ų | 59 | 64.1 Ų | 64.1 | 26% | 0.259 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -66 | -33.8 | 179.3 | -69.4 | -60.5 | 0 | 0 | 0 | 112.4 | M2 S5 I9 A75 A83 | M2-F79 HydrophobicContact CE-CD2 4.36Å; M2-F79 HydrophobicContact CE-CE2 3.84Å; M2-F79 HydrophobicContact CE-CZ 4.15Å; M2-F79 HydrophobicContact CG-CB 4.3Å; M2-F79 HydrophobicContact CG-CD2 3.56Å; M2-F79 HydrophobicContact CG-CE2 4.02Å; M2-F79 HydrophobicContact CG-CG 3.92Å; M2-F79 HydrophobicContact SD-CD2 4.29Å; M2-F79 HydrophobicContact SD-CE2 4.28Å; S5-F79 WeakPolarHBondContact OG-CD1 3.43Å; I9-F79 HydrophobicContact CD1-CD1 4.16Å; I9-F79 HydrophobicContact CD1-CE1 4.13Å; A75-F79 HydrophobicContact CB-CD2 4.36Å; A75-F79 HydrophobicContact CB-CE2 4.3Å; A75-F79 WeakPolarHBondContact O-CB 3.36Å; A75-F79 WeakPolarHBondContact O-CD2 3.33Å; A75-F79 PolarHBondContact O-N 3.18Å; F79-A83 VanDerWaalsContact O-CB 3.26Å; F79-A83 WeakPolarHBondContact O-CB 3.35Å; F79-A83 PolarHBondContact O-N 3.23Å |
| 80 | G | 87.6 | Confident | 85.4 | Confident | 8 Ų | 8 | 68.5 Ų | 68.5 | 8% | 0.082 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -65.5 | -43.7 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | V76 G77 V78 A83 F84 | V76-G80 PolarHBondContact O-N 3.4Å; G77-G80 PolarHBondContact O-N 3.33Å; V78-G80 VanDerWaalsContact C-N 3.3Å; V78-G80 PolarHBondContact O-N 3.17Å; G80-A83 PolarHBondContact O-N 2.87Å; G80-F84 WeakPolarHBondContact O-CD2 3.39Å; G80-F84 PolarHBondContact O-N 3.39Å |
| 81 | Y | 86.5 | Confident | 84.6 | Confident | 85 Ų | 85 | 68.8 Ų | 68.8 | 33% | 0.333 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -65.3 | -42.2 | 177.9 | -170.4 | -121 | 0 | 0 | 0 | 112.1 | V18 V19 G77 V78 Y85 L89 | V18-Y81 HydrophobicContact CB-CE1 4.2Å; V18-Y81 HydrophobicContact CG1-CD1 4.03Å; V18-Y81 HydrophobicContact CG1-CE1 3.6Å; V18-Y81 HydrophobicContact CG2-CD1 4.32Å; V18-Y81 HydrophobicContact CG2-CE1 4.13Å; V19-Y81 PolarHBondContact N-OH 2.74Å; G77-Y81 WeakPolarHBondContact O-CB 3.33Å; G77-Y81 PolarHBondContact O-N 3.28Å; V78-Y81 PolarHBondContact O-N 3.36Å; Y81-Y85 PolarHBondContact O-N 3.47Å; Y81-L89 HydrophobicContact CD2-CD1 3.83Å; Y81-L89 HydrophobicContact CE2-CD1 4.32Å |
| 82 | V | 85.4 | Confident | 84.1 | Confident | 7 Ų | 7 | 68.6 Ų | 68.6 | 4% | 0.042 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -67.8 | -38.5 | 176.7 | 174.6 | 0 | 0 | 0 | 0 | 111.7 | T8 I9 W14 V78 F84 Y85 | T8-V82 HydrophobicContact CG2-CG1 4.27Å; T8-V82 WeakPolarHBondContact CG2-O 3.42Å; I9-V82 HydrophobicContact CD1-CG1 4.31Å; I9-V82 HydrophobicContact CG1-CG1 3.73Å; W14-V82 HydrophobicContact CB-CG1 4.16Å; W14-V82 HydrophobicContact CD2-CG1 3.93Å; W14-V82 HydrophobicContact CD2-CG2 4.47Å; W14-V82 HydrophobicContact CE3-CG1 4.02Å; W14-V82 HydrophobicContact CE3-CG2 3.76Å; W14-V82 HydrophobicContact CG-CG1 4.01Å; W14-V82 HydrophobicContact CZ3-CG2 3.9Å; V78-V82 WeakPolarHBondContact O-CG2 3.47Å; V78-V82 PolarHBondContact O-N 3.27Å; V82-F84 VanDerWaalsContact C-N 3.29Å; V82-F84 PolarHBondContact O-N 3.31Å; V82-Y85 WeakPolarHBondContact O-CD1 3.45Å |
| 83 | A | 84 | Confident | 83.7 | Confident | 13 Ų | 13 | 65.1 Ų | 65.1 | 11% | 0.107 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -63.8 | -33.1 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | E4 F79 G80 | E4-A83 HydrophobicContact CB-CB 4.32Å; F79-A83 VanDerWaalsContact O-CB 3.26Å; F79-A83 WeakPolarHBondContact O-CB 3.35Å; F79-A83 PolarHBondContact O-N 3.23Å; G80-A83 PolarHBondContact O-N 2.87Å |
| 84 | F | 82.2 | Confident | 83.1 | Confident | 14 Ų | 14 | 60.8 Ų | 60.8 | 6% | 0.061 | 35% | 0.349 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -120.5 | 26.7 | -170.6 | -61.8 | -65.4 | 0 | 0 | 0 | 113.4 | M1 G80 V82 S86 H87 L89 V93 Q96 F97 | M1-F84 HydrophobicContact CE-CE2 4.12Å; M1-F84 HydrophobicContact SD-CE2 3.79Å; G80-F84 WeakPolarHBondContact O-CD2 3.39Å; G80-F84 PolarHBondContact O-N 3.39Å; V82-F84 VanDerWaalsContact C-N 3.29Å; V82-F84 PolarHBondContact O-N 3.31Å; F84-S86 PolarHBondContact O-N 2.96Å; F84-H87 PolarHBondContact O-N 2.95Å; F84-L89 HydrophobicContact CB-CD2 3.64Å; F84-L89 HydrophobicContact CB-CG 4.42Å; F84-L89 HydrophobicContact CD2-CD2 4.3Å; F84-L89 HydrophobicContact CG-CD2 4.26Å; F84-V93 HydrophobicContact CD2-CG2 3.93Å; F84-V93 HydrophobicContact CE2-CG2 3.84Å; F84-Q96 HydrophobicContact CD1-CB 4.34Å; F84-Q96 HydrophobicContact CD1-CG 3.5Å; F84-Q96 HydrophobicContact CE1-CB 4.16Å; F84-Q96 HydrophobicContact CE1-CG 3.68Å; F84-Q96 HydrophobicContact CG-CG 4.01Å; F84-Q96 HydrophobicContact CZ-CB 4.33Å; F84-Q96 HydrophobicContact CZ-CG 4.32Å; F84-F97 HydrophobicContact CE2-CE1 4.41Å; F84-F97 HydrophobicContact CE2-CZ 4.33Å; F84-F97 AromaticContact CZ-CD1 3.96Å; F84-F97 HydrophobicContact CZ-CD1 3.96Å; F84-F97 HydrophobicContact CZ-CD2 4.43Å; F84-F97 AromaticContact CZ-CE1 3.99Å; F84-F97 HydrophobicContact CZ-CE1 3.99Å; F84-F97 HydrophobicContact CZ-CE2 4.48Å; F84-F97 HydrophobicContact CZ-CG 4.22Å; F84-F97 HydrophobicContact CZ-CZ 4.29Å |
| 85 | Y | 79.4 | Confident | 82.6 | Confident | 75 Ų | 75 | 61.3 Ų | 61.3 | 29% | 0.294 | 35% | 0.346 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.9 | -23.3 | -178 | 78.4 | -83.9 | 0 | 0 | 0 | 114.1 | T8 W14 H17 Y81 V82 | T8-Y85 HydrophobicContact CG2-CD1 3.65Å; T8-Y85 HydrophobicContact CG2-CE1 3.35Å; W14-Y85 HydrophobicContact CB-CD1 4.44Å; W14-Y85 HydrophobicContact CB-CE1 4.5Å; H17-Y85 HydrophobicContact CB-CD2 3.46Å; H17-Y85 VanDerWaalsContact CB-CD2 3.46Å; H17-Y85 HydrophobicContact CB-CE2 3.73Å; H17-Y85 AromaticContact CD2-CE2 3.8Å; H17-Y85 AromaticContact CG-CE2 3.92Å; Y81-Y85 PolarHBondContact O-N 3.47Å; V82-Y85 WeakPolarHBondContact O-CD1 3.45Å |
| 86 | S | 72.1 | Confident | 82.1 | Confident | 78 Ų | 78 | 61.9 Ų | 61.9 | 55% | 0.545 | 34% | 0.342 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86 | -10.5 | -179.6 | 56.3 | 0 | 0 | 0 | 0 | 114.4 | F84 | F84-S86 PolarHBondContact O-N 2.96Š|
| 87 | H | 73.4 | Confident | 81.7 | Confident | 103 Ų | 103 | 58.6 Ų | 58.6 | 48% | 0.477 | 32% | 0.321 | S | S | . | . | S | Bend | trans | -119.7 | 151.5 | -174.2 | -65.1 | -69.6 | 0 | 0 | 0 | 112.2 | F84 L89 | F84-H87 PolarHBondContact O-N 2.95Å; H87-L89 PolarHBondContact O-N 2.96Å; H87-L89 VanDerWaalsContact O-N 3.17Å |
| 88 | E | 73.3 | Confident | 81.3 | Confident | 141 Ų | 141 | 59.5 Ų | 59.5 | 66% | 0.659 | 32% | 0.319 | S | S | * | . | trans | -71.2 | 109 | 173.3 | -169.1 | 171.9 | -166.9 | 0 | 0 | 110.2 | H90 | E88-H90 PolarHBondContact O-N 3.41Å; E88-H90 PolarHBondContact O-ND1 3.35Å | ||
| 89 | L | 75.3 | Confident | 80.9 | Confident | 72 Ų | 72 | 60.6 Ų | 60.6 | 38% | 0.377 | 33% | 0.328 | S | S | . | . | trans | -73.4 | 121 | -177.7 | -75.3 | 172.5 | 0 | 0 | 0 | 110.9 | Y81 F84 H87 V93 | Y81-L89 HydrophobicContact CD2-CD1 3.83Å; Y81-L89 HydrophobicContact CE2-CD1 4.32Å; F84-L89 HydrophobicContact CB-CD2 3.64Å; F84-L89 HydrophobicContact CB-CG 4.42Å; F84-L89 HydrophobicContact CD2-CD2 4.3Å; F84-L89 HydrophobicContact CG-CD2 4.26Å; H87-L89 PolarHBondContact O-N 2.96Å; H87-L89 VanDerWaalsContact O-N 3.17Å; L89-V93 HydrophobicContact CD2-CG2 4.4Å | ||
| 90 | H | 74.9 | Confident | 80.9 | Confident | 130 Ų | 130 | 60.6 Ų | 60.6 | 60% | 0.602 | 33% | 0.333 | S | S | * | . | trans | -89.3 | 158.8 | 168 | -74.1 | 61.8 | 0 | 0 | 0 | 110.4 | E88 D92 | E88-H90 PolarHBondContact O-N 3.41Å; E88-H90 PolarHBondContact O-ND1 3.35Å; H90-D92 CarbonylContact O-C 3.55Å; H90-D92 PolarHBondContact O-N 3.26Å | ||
| 91 | G | 77.3 | Confident | 80.9 | Confident | 42 Ų | 42 | 67.5 Ų | 67.5 | 43% | 0.433 | 37% | 0.366 | S | S | . | . | S | Bend | trans | -54.8 | -19.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 115.9 | E173 | G91-E173 WeakPolarHBondContact CA-OE2 3.04Š|
| 92 | D | 85 | Confident | 80.9 | Confident | 58 Ų | 58 | 68.6 Ų | 68.6 | 31% | 0.31 | 38% | 0.381 | S | S | . | . | trans | -108.8 | 103 | 166.5 | -173 | 2.7 | 0 | 0 | 0 | 111.7 | H90 L94 V95 V172 | H90-D92 CarbonylContact O-C 3.55Å; H90-D92 PolarHBondContact O-N 3.26Å; D92-L94 PolarHBondContact O-N 3.34Å; D92-L94 VanDerWaalsContact OD1-CB 3.23Å; D92-L94 WeakPolarHBondContact OD1-CB 3.35Å; D92-L94 PolarHBondContact OD1-N 3.06Å; D92-V95 HydrophobicContact CB-CG2 4.05Å; D92-V95 WeakPolarHBondContact O-CB 3.49Å; D92-V95 PolarHBondContact O-N 3.25Å; D92-V172 HydrophobicContact CB-CG2 3.98Å | ||
| 93 | V | 84.6 | Confident | 80.9 | Confident | 49 Ų | 49 | 68.6 Ų | 68.6 | 30% | 0.297 | 38% | 0.381 | S | S | . | . | G | 310 helix | trans | -68.5 | -19.9 | 178.1 | 73.1 | 0 | 0 | 0 | 0 | 113.1 | M1 F84 L89 V95 Q96 F97 | M1-V93 HydrophobicContact CE-CB 3.81Å; M1-V93 HydrophobicContact CE-CG1 3.22Å; M1-V93 HydrophobicContact CE-CG2 3.27Å; M1-V93 HydrophobicContact SD-CG2 4.37Å; F84-V93 HydrophobicContact CD2-CG2 3.93Å; F84-V93 HydrophobicContact CE2-CG2 3.84Å; L89-V93 HydrophobicContact CD2-CG2 4.4Å; V93-V95 PolarHBondContact O-N 3.25Å; V93-Q96 PolarHBondContact O-N 2.9Å; V93-F97 WeakPolarHBondContact O-CD2 3.49Å |
| 94 | L | 82.3 | Confident | 81.1 | Confident | 29 Ų | 29 | 73.5 Ų | 73.5 | 15% | 0.152 | 40% | 0.402 | C | S | . | . | G | 310 helix | trans | -64.6 | -27.2 | 177.6 | -71.6 | 154 | 0 | 0 | 0 | 111.6 | D92 Q96 F97 K107 F110 | D92-L94 PolarHBondContact O-N 3.34Å; D92-L94 VanDerWaalsContact OD1-CB 3.23Å; D92-L94 WeakPolarHBondContact OD1-CB 3.35Å; D92-L94 PolarHBondContact OD1-N 3.06Å; L94-Q96 PolarHBondContact O-N 3.24Å; L94-F97 HydrophobicContact CD2-CE2 4.46Å; L94-K107 HydrophobicContact CD2-CG 4.29Å; L94-K107 WeakPolarHBondContact O-CE 3.01Å; L94-K107 PolarHBondContact O-NZ 3.17Å; L94-F110 HydrophobicContact CD1-CD1 3.66Å; L94-F110 HydrophobicContact CD1-CE1 3.62Å; L94-F110 HydrophobicContact CD1-CG 4.28Å; L94-F110 HydrophobicContact CD1-CZ 4.22Å |
| 95 | V | 81.7 | Confident | 81.5 | Confident | 69 Ų | 69 | 76.1 Ų | 76.1 | 42% | 0.418 | 42% | 0.422 | S | S | . | . | G | 310 helix | trans | -70.5 | -21.1 | 179.9 | 176.7 | 0 | 0 | 0 | 0 | 112.3 | D92 V93 K256 | D92-V95 HydrophobicContact CB-CG2 4.05Å; D92-V95 WeakPolarHBondContact O-CB 3.49Å; D92-V95 PolarHBondContact O-N 3.25Å; V93-V95 PolarHBondContact O-N 3.25Å; V95-K256 PolarHBondContact O-NZ 3.16Å; V95-K256 VanDerWaalsContact O-NZ 3.16Å |
| 96 | Q | 81.8 | Confident | 81.9 | Confident | 51 Ų | 51 | 77 Ų | 77 | 24% | 0.238 | 43% | 0.431 | C | S | . | . | G | 310 helix | trans | -86.7 | -16.4 | -177.3 | -164.3 | 56.7 | 27.1 | 0 | 0 | 113.7 | F84 V93 L94 | F84-Q96 HydrophobicContact CD1-CB 4.34Å; F84-Q96 HydrophobicContact CD1-CG 3.5Å; F84-Q96 HydrophobicContact CE1-CB 4.16Å; F84-Q96 HydrophobicContact CE1-CG 3.68Å; F84-Q96 HydrophobicContact CG-CG 4.01Å; F84-Q96 HydrophobicContact CZ-CB 4.33Å; F84-Q96 HydrophobicContact CZ-CG 4.32Å; V93-Q96 PolarHBondContact O-N 2.9Å; L94-Q96 PolarHBondContact O-N 3.24Å |
| 97 | F | 81.9 | Confident | 82.8 | Confident | 16 Ų | 16 | 76.8 Ų | 76.8 | 7% | 0.07 | 42% | 0.421 | C | S | . | . | S | Bend | trans | -69.8 | 139 | 179.2 | -73 | -86.3 | 0 | 0 | 0 | 112.5 | M1 E4 F84 V93 L94 T103 | M1-F97 HydrophobicContact CE-CE1 4.4Å; M1-F97 HydrophobicContact CE-CE2 3.26Å; M1-F97 HydrophobicContact CE-CZ 3.2Å; M1-F97 HydrophobicContact CG-CZ 4.16Å; M1-F97 HydrophobicContact SD-CE1 4.15Å; M1-F97 HydrophobicContact SD-CE2 4.06Å; M1-F97 HydrophobicContact SD-CZ 3.36Å; M1-F97 WeakPolarHBondContact SD-CZ 3.49Å; E4-F97 HydrophobicContact CG-CD1 4.06Å; E4-F97 HydrophobicContact CG-CE1 3.74Å; F84-F97 HydrophobicContact CE2-CE1 4.41Å; F84-F97 HydrophobicContact CE2-CZ 4.33Å; F84-F97 AromaticContact CZ-CD1 3.96Å; F84-F97 HydrophobicContact CZ-CD1 3.96Å; F84-F97 HydrophobicContact CZ-CD2 4.43Å; F84-F97 AromaticContact CZ-CE1 3.99Å; F84-F97 HydrophobicContact CZ-CE1 3.99Å; F84-F97 HydrophobicContact CZ-CE2 4.48Å; F84-F97 HydrophobicContact CZ-CG 4.22Å; F84-F97 HydrophobicContact CZ-CZ 4.29Å; V93-F97 WeakPolarHBondContact O-CD2 3.49Å; L94-F97 HydrophobicContact CD2-CE2 4.46Å; F97-T103 HydrophobicContact CB-CG2 3.94Å; F97-T103 HydrophobicContact CD1-CG2 4.08Å; F97-T103 HydrophobicContact CG-CG2 4.28Å |
| 98 | P | 81.3 | Confident | 83.6 | Confident | 63 Ų | 63 | 77.4 Ų | 77.4 | 41% | 0.409 | 43% | 0.427 | S | S | . | . | trans | -61 | 145.4 | 173 | 26.7 | -34 | 0 | 0 | 0 | 110.2 | T100 T103 | P98-T100 PolarHBondContact O-N 3.4Å; P98-T103 PolarHBondContact O-OG1 3.44Å | ||
| 99 | P | 81.3 | Confident | 84.6 | Confident | 110 Ų | 110 | 73.5 Ų | 73.5 | 71% | 0.714 | 42% | 0.419 | S | S | * | . | trans | -75.5 | 86.6 | -179.6 | 31.5 | -34.2 | 0 | 0 | 0 | 110.3 | ||||
| 100 | T | 88.2 | Confident | 85.4 | Confident | 60 Ų | 60 | 75.2 Ų | 75.2 | 37% | 0.368 | 42% | 0.423 | S | S | . | . | trans | -107.3 | 160.5 | 169.8 | 66.8 | 0 | 0 | 0 | 0 | 109.2 | P98 V102 T103 Q104 | P98-T100 PolarHBondContact O-N 3.4Å; T100-V102 PolarHBondContact O-N 2.99Å; T100-T103 PolarHBondContact N-OG1 2.9Å; T100-T103 PolarHBondContact O-N 3.45Å; T100-T103 VanDerWaalsContact O-N 3.17Å; T100-T103 PolarHBondContact O-OG1 3.49Å; T100-T103 VanDerWaalsContact O-OG1 3.04Å; T100-T103 WeakPolarHBondContact OG1-CG2 3.36Å; T100-T103 PolarHBondContact OG1-N 2.96Å; T100-T103 PolarHBondContact OG1-OG1 3.27Å; T100-Q104 WeakPolarHBondContact O-CB 3.24Å; T100-Q104 WeakPolarHBondContact O-CG 3.25Å; T100-Q104 PolarHBondContact O-N 3.27Å | ||
| 101 | I | 88.1 | Confident | 86.2 | Confident | 152 Ų | 152 | 74.2 Ų | 74.2 | 78% | 0.779 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -56.1 | -38.4 | 178.1 | -60.1 | 170 | 0 | 0 | 0 | 110.5 | S105 | I101-S105 WeakPolarHBondContact O-CB 3.29Å; I101-S105 PolarHBondContact O-N 2.95Å; I101-S105 PolarHBondContact O-OG 2.9Å |
| 102 | V | 86 | Confident | 87.1 | Confident | 108 Ų | 108 | 77.7 Ų | 77.7 | 66% | 0.655 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -64.9 | -50.1 | 177.9 | 177.3 | 0 | 0 | 0 | 0 | 111 | T100 Q104 S105 L106 | T100-V102 PolarHBondContact O-N 2.99Å; V102-Q104 VanDerWaalsContact C-N 3.35Å; V102-Q104 PolarHBondContact O-N 3.49Å; V102-S105 PolarHBondContact O-N 3.21Å; V102-S105 PolarHBondContact O-OG 3.46Å; V102-L106 PolarHBondContact O-N 2.97Å |
| 103 | T | 85.7 | Confident | 87.5 | Confident | 7 Ų | 7 | 78.3 Ų | 78.3 | 4% | 0.043 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -68.6 | -34.7 | -178.6 | 60.3 | 0 | 0 | 0 | 0 | 112 | F97 P98 T100 L106 K107 | F97-T103 HydrophobicContact CB-CG2 3.94Å; F97-T103 HydrophobicContact CD1-CG2 4.08Å; F97-T103 HydrophobicContact CG-CG2 4.28Å; P98-T103 PolarHBondContact O-OG1 3.44Å; T100-T103 PolarHBondContact N-OG1 2.9Å; T100-T103 PolarHBondContact O-N 3.45Å; T100-T103 VanDerWaalsContact O-N 3.17Å; T100-T103 PolarHBondContact O-OG1 3.49Å; T100-T103 VanDerWaalsContact O-OG1 3.04Å; T100-T103 WeakPolarHBondContact OG1-CG2 3.36Å; T100-T103 PolarHBondContact OG1-N 2.96Å; T100-T103 PolarHBondContact OG1-OG1 3.27Å; T103-L106 PolarHBondContact O-N 3.42Å; T103-K107 WeakPolarHBondContact O-CG 3.43Å; T103-K107 PolarHBondContact O-N 3.48Å |
| 104 | Q | 88 | Confident | 88 | Confident | 117 Ų | 117 | 79.4 Ų | 79.4 | 55% | 0.547 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -65.7 | -42.1 | 172.6 | -71.8 | -170.3 | -6.6 | 0 | 0 | 112 | T100 V102 L106 K107 L108 | T100-Q104 WeakPolarHBondContact O-CB 3.24Å; T100-Q104 WeakPolarHBondContact O-CG 3.25Å; T100-Q104 PolarHBondContact O-N 3.27Å; V102-Q104 VanDerWaalsContact C-N 3.35Å; V102-Q104 PolarHBondContact O-N 3.49Å; Q104-L106 VanDerWaalsContact C-N 3.3Å; Q104-L106 PolarHBondContact O-N 3.24Å; Q104-K107 PolarHBondContact O-N 2.88Å; Q104-L108 PolarHBondContact O-N 3.27Å |
| 105 | S | 89.4 | Confident | 88.5 | Confident | 68 Ų | 68 | 80.5 Ų | 80.5 | 48% | 0.476 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -62.3 | -38.1 | 175.1 | 75.4 | 0 | 0 | 0 | 0 | 112.1 | I101 V102 L108 A109 | I101-S105 WeakPolarHBondContact O-CB 3.29Å; I101-S105 PolarHBondContact O-N 2.95Å; I101-S105 PolarHBondContact O-OG 2.9Å; V102-S105 PolarHBondContact O-N 3.21Å; V102-S105 PolarHBondContact O-OG 3.46Å; S105-L108 PolarHBondContact O-N 3.41Å; S105-A109 WeakPolarHBondContact O-CB 3.36Å; S105-A109 PolarHBondContact O-N 3.16Å |
| 106 | L | 89.1 | Confident | 89.1 | Confident | 94 Ų | 94 | 81.3 Ų | 81.3 | 49% | 0.492 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -64.7 | -45.1 | 175.4 | -176 | 69.8 | 0 | 0 | 0 | 111.7 | V102 T103 Q104 L108 A109 F110 | V102-L106 PolarHBondContact O-N 2.97Å; T103-L106 PolarHBondContact O-N 3.42Å; Q104-L106 VanDerWaalsContact C-N 3.3Å; Q104-L106 PolarHBondContact O-N 3.24Å; L106-L108 VanDerWaalsContact C-N 3.32Å; L106-L108 PolarHBondContact O-N 3.17Å; L106-A109 PolarHBondContact O-N 3.11Å; L106-F110 WeakPolarHBondContact O-CB 3.2Å; L106-F110 PolarHBondContact O-N 3.14Å |
| 107 | K | 89.8 | Confident | 89.7 | Confident | 73 Ų | 73 | 80.9 Ų | 80.9 | 32% | 0.317 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -59.8 | -42.6 | 175.2 | -73.4 | 174.6 | -178.4 | -174.1 | 0 | 111.5 | L94 T103 Q104 F110 L111 | L94-K107 HydrophobicContact CD2-CG 4.29Å; L94-K107 WeakPolarHBondContact O-CE 3.01Å; L94-K107 PolarHBondContact O-NZ 3.17Å; T103-K107 WeakPolarHBondContact O-CG 3.43Å; T103-K107 PolarHBondContact O-N 3.48Å; Q104-K107 PolarHBondContact O-N 2.88Å; K107-F110 PolarHBondContact O-N 3.3Å; K107-L111 WeakPolarHBondContact O-CB 3.25Å; K107-L111 PolarHBondContact O-N 2.91Å |
| 108 | L | 91.4 | Very high | 90.1 | Very high | 117 Ų | 117 | 84 Ų | 84 | 61% | 0.613 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -65.3 | -43.4 | 177.2 | -176.5 | 63.1 | 0 | 0 | 0 | 111.9 | Q104 S105 L106 L111 L112 | Q104-L108 PolarHBondContact O-N 3.27Å; S105-L108 PolarHBondContact O-N 3.41Å; L106-L108 VanDerWaalsContact C-N 3.32Å; L106-L108 PolarHBondContact O-N 3.17Å; L108-L111 PolarHBondContact O-N 3.26Å; L108-L112 WeakPolarHBondContact O-CB 3.32Å; L108-L112 PolarHBondContact O-N 2.97Å |
| 109 | A | 93.3 | Very high | 90.6 | Very high | 59 Ų | 59 | 85 Ų | 85 | 49% | 0.488 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63 | -42.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | S105 L106 L112 S113 | S105-A109 WeakPolarHBondContact O-CB 3.36Å; S105-A109 PolarHBondContact O-N 3.16Å; L106-A109 PolarHBondContact O-N 3.11Å; A109-L112 PolarHBondContact O-N 3.23Å; A109-S113 WeakPolarHBondContact O-CB 3.37Å; A109-S113 PolarHBondContact O-N 3.44Å |
| 110 | F | 92.1 | Very high | 91 | Very high | 107 Ų | 107 | 85.8 Ų | 85.8 | 47% | 0.469 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.9 | -46.4 | 174.6 | 177.5 | -111.3 | 0 | 0 | 0 | 111.8 | L94 L106 K107 L112 S113 I114 | L94-F110 HydrophobicContact CD1-CD1 3.66Å; L94-F110 HydrophobicContact CD1-CE1 3.62Å; L94-F110 HydrophobicContact CD1-CG 4.28Å; L94-F110 HydrophobicContact CD1-CZ 4.22Å; L106-F110 WeakPolarHBondContact O-CB 3.2Å; L106-F110 PolarHBondContact O-N 3.14Å; K107-F110 PolarHBondContact O-N 3.3Å; F110-L112 VanDerWaalsContact C-N 3.35Å; F110-L112 PolarHBondContact O-N 3.43Å; F110-S113 WeakPolarHBondContact O-CB 3.34Å; F110-S113 PolarHBondContact O-N 3.48Å; F110-I114 HydrophobicContact CD1-CD1 3.88Å; F110-I114 HydrophobicContact CD2-CD1 4.4Å; F110-I114 HydrophobicContact CE1-CD1 3.38Å; F110-I114 HydrophobicContact CE2-CD1 3.95Å; F110-I114 HydrophobicContact CE2-CG1 4.41Å; F110-I114 HydrophobicContact CG-CD1 4.38Å; F110-I114 HydrophobicContact CZ-CD1 3.43Å; F110-I114 VanDerWaalsContact CZ-CD1 3.43Å; F110-I114 HydrophobicContact CZ-CG1 4.35Å; F110-I114 WeakPolarHBondContact O-CG1 3.29Å; F110-I114 PolarHBondContact O-N 3.1Å |
| 111 | L | 93 | Very high | 91.1 | Very high | 110 Ų | 110 | 89.4 Ų | 89.4 | 58% | 0.576 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -59.7 | -44.6 | 176.4 | -178.6 | 64.6 | 0 | 0 | 0 | 111.8 | K107 L108 S113 I114 A115 | K107-L111 WeakPolarHBondContact O-CB 3.25Å; K107-L111 PolarHBondContact O-N 2.91Å; L108-L111 PolarHBondContact O-N 3.26Å; L111-S113 VanDerWaalsContact C-N 3.34Å; L111-S113 PolarHBondContact O-N 2.92Å; L111-I114 PolarHBondContact O-N 3.4Å; L111-A115 WeakPolarHBondContact O-CB 3.14Å; L111-A115 PolarHBondContact O-N 3.39Å |
| 112 | L | 94.4 | Very high | 91.1 | Very high | 114 Ų | 114 | 83.4 Ų | 83.4 | 60% | 0.597 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -64.7 | -39.6 | 177.8 | -173.4 | 63.9 | 0 | 0 | 0 | 111.6 | L108 A109 F110 I114 A115 V116 | L108-L112 WeakPolarHBondContact O-CB 3.32Å; L108-L112 PolarHBondContact O-N 2.97Å; A109-L112 PolarHBondContact O-N 3.23Å; F110-L112 VanDerWaalsContact C-N 3.35Å; F110-L112 PolarHBondContact O-N 3.43Å; L112-I114 VanDerWaalsContact C-N 3.33Å; L112-I114 PolarHBondContact O-N 3.45Å; L112-A115 PolarHBondContact O-N 2.84Å; L112-V116 WeakPolarHBondContact O-CG2 3.43Å; L112-V116 PolarHBondContact O-N 3.33Å |
| 113 | S | 95.3 | Very high | 91.2 | Very high | 71 Ų | 71 | 84.6 Ų | 84.6 | 50% | 0.497 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -59.5 | -43.7 | 174.6 | -175.2 | 0 | 0 | 0 | 0 | 111.7 | A109 F110 L111 V116 S117 | A109-S113 WeakPolarHBondContact O-CB 3.37Å; A109-S113 PolarHBondContact O-N 3.44Å; F110-S113 WeakPolarHBondContact O-CB 3.34Å; F110-S113 PolarHBondContact O-N 3.48Å; L111-S113 VanDerWaalsContact C-N 3.34Å; L111-S113 PolarHBondContact O-N 2.92Å; S113-V116 PolarHBondContact O-N 3.46Å; S113-S117 WeakPolarHBondContact O-CB 3.37Å; S113-S117 PolarHBondContact O-N 3.38Å; S113-S117 PolarHBondContact O-OG 2.85Å |
| 114 | I | 93.4 | Very high | 91.2 | Very high | 72 Ų | 72 | 87.8 Ų | 87.8 | 37% | 0.369 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.9 | -45.3 | 175.6 | -68.4 | 168.3 | 0 | 0 | 0 | 110.5 | F110 L111 L112 V116 S117 I118 | F110-I114 HydrophobicContact CD1-CD1 3.88Å; F110-I114 HydrophobicContact CD2-CD1 4.4Å; F110-I114 HydrophobicContact CE1-CD1 3.38Å; F110-I114 HydrophobicContact CE2-CD1 3.95Å; F110-I114 HydrophobicContact CE2-CG1 4.41Å; F110-I114 HydrophobicContact CG-CD1 4.38Å; F110-I114 HydrophobicContact CZ-CD1 3.43Å; F110-I114 VanDerWaalsContact CZ-CD1 3.43Å; F110-I114 HydrophobicContact CZ-CG1 4.35Å; F110-I114 WeakPolarHBondContact O-CG1 3.29Å; F110-I114 PolarHBondContact O-N 3.1Å; L111-I114 PolarHBondContact O-N 3.4Å; L112-I114 VanDerWaalsContact C-N 3.33Å; L112-I114 PolarHBondContact O-N 3.45Å; I114-V116 VanDerWaalsContact C-N 3.26Å; I114-V116 PolarHBondContact O-N 2.87Å; I114-S117 WeakPolarHBondContact O-CB 3.31Å; I114-S117 PolarHBondContact O-N 3.4Å; I114-I118 HydrophobicContact CG2-CD1 4.11Å; I114-I118 HydrophobicContact CG2-CG1 4.39Å; I114-I118 WeakPolarHBondContact O-CG1 3.4Å; I114-I118 PolarHBondContact O-N 2.88Å |
| 115 | A | 92.8 | Very high | 91.2 | Very high | 52 Ų | 52 | 84.4 Ų | 84.4 | 43% | 0.43 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -57.6 | -39 | 180 | 0 | 0 | 0 | 0 | 0 | 112.3 | L111 L112 P119 | L111-A115 WeakPolarHBondContact O-CB 3.14Å; L111-A115 PolarHBondContact O-N 3.39Å; L112-A115 PolarHBondContact O-N 2.84Å; A115-P119 WeakPolarHBondContact O-CD 3.44Å |
| 116 | V | 94.7 | Very high | 91.2 | Very high | 87 Ų | 87 | 83.8 Ų | 83.8 | 53% | 0.527 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -75 | -30.2 | 175.6 | 175 | 0 | 0 | 0 | 0 | 112.3 | L112 S113 I114 P119 | L112-V116 WeakPolarHBondContact O-CG2 3.43Å; L112-V116 PolarHBondContact O-N 3.33Å; S113-V116 PolarHBondContact O-N 3.46Å; I114-V116 VanDerWaalsContact C-N 3.26Å; I114-V116 PolarHBondContact O-N 2.87Å; V116-P119 WeakPolarHBondContact O-CD 3.39Å |
| 117 | S | 94.1 | Very high | 90.9 | Very high | 41 Ų | 41 | 82.4 Ų | 82.4 | 29% | 0.287 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -72.3 | -33.7 | -179.9 | -61 | 0 | 0 | 0 | 0 | 112.9 | S113 I114 L120 M121 | S113-S117 WeakPolarHBondContact O-CB 3.37Å; S113-S117 PolarHBondContact O-N 3.38Å; S113-S117 PolarHBondContact O-OG 2.85Å; I114-S117 WeakPolarHBondContact O-CB 3.31Å; I114-S117 PolarHBondContact O-N 3.4Å; S117-L120 PolarHBondContact O-N 3.37Å; S117-L120 VanDerWaalsContact O-N 3.16Å; S117-M121 PolarHBondContact O-N 3.33Å |
| 118 | I | 91.9 | Very high | 90.8 | Very high | 83 Ų | 83 | 81.9 Ų | 81.9 | 43% | 0.426 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -55.1 | -54.6 | -179.2 | -71 | 164.2 | 0 | 0 | 0 | 111.5 | I114 L120 M121 M122 | I114-I118 HydrophobicContact CG2-CD1 4.11Å; I114-I118 HydrophobicContact CG2-CG1 4.39Å; I114-I118 WeakPolarHBondContact O-CG1 3.4Å; I114-I118 PolarHBondContact O-N 2.88Å; I118-L120 VanDerWaalsContact C-N 3.26Å; I118-L120 PolarHBondContact O-N 2.99Å; I118-M121 PolarHBondContact O-N 3.41Å; I118-M122 HydrophobicContact CG2-CG 4.12Å; I118-M122 WeakPolarHBondContact O-CB 3.31Å; I118-M122 WeakPolarHBondContact O-CG 3.36Å; I118-M122 PolarHBondContact O-N 3.35Å |
| 119 | P | 90.3 | Very high | 90.5 | Very high | 82 Ų | 82 | 78.7 Ų | 78.7 | 53% | 0.532 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -55.1 | -38.9 | 176.9 | -26.7 | 32.2 | 0 | 0 | 0 | 114.1 | A115 V116 M122 F123 | A115-P119 WeakPolarHBondContact O-CD 3.44Å; V116-P119 WeakPolarHBondContact O-CD 3.39Å; P119-M122 PolarHBondContact O-N 3.4Å; P119-F123 PolarHBondContact O-N 3Å |
| 120 | L | 90 | Very high | 90.1 | Very high | 127 Ų | 127 | 77.4 Ų | 77.4 | 67% | 0.665 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -67.4 | -39.9 | -179.2 | -64 | 175.7 | 0 | 0 | 0 | 111.7 | S117 I118 P124 | S117-L120 PolarHBondContact O-N 3.37Å; S117-L120 VanDerWaalsContact O-N 3.16Å; I118-L120 VanDerWaalsContact C-N 3.26Å; I118-L120 PolarHBondContact O-N 2.99Å; L120-P124 WeakPolarHBondContact O-CD 3.39Å |
| 121 | M | 90.5 | Very high | 89.7 | Confident | 136 Ų | 136 | 74.4 Ų | 74.4 | 67% | 0.67 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -76 | -28.9 | 177 | -65.6 | -172.6 | -176.2 | 0 | 0 | 112.9 | S117 I118 F123 P124 A125 | S117-M121 PolarHBondContact O-N 3.33Å; I118-M121 PolarHBondContact O-N 3.41Å; M121-F123 VanDerWaalsContact C-N 3.28Å; M121-F123 PolarHBondContact O-N 2.91Å; M121-P124 VanDerWaalsContact O-CD 3.25Å; M121-P124 WeakPolarHBondContact O-CD 3.34Å; M121-P124 WeakPolarHBondContact O-CG 3.39Å; M121-A125 WeakPolarHBondContact O-CB 3.38Å; M121-A125 PolarHBondContact O-N 3.36Å |
| 122 | M | 88.9 | Confident | 89.2 | Confident | 27 Ų | 27 | 75.9 Ų | 75.9 | 13% | 0.133 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -63.7 | -32.5 | 177.9 | -76.8 | -66.4 | -62.2 | 0 | 0 | 112.7 | I118 P119 R126 T155 I158 L159 | I118-M122 HydrophobicContact CG2-CG 4.12Å; I118-M122 WeakPolarHBondContact O-CB 3.31Å; I118-M122 WeakPolarHBondContact O-CG 3.36Å; I118-M122 PolarHBondContact O-N 3.35Å; P119-M122 PolarHBondContact O-N 3.4Å; M122-R126 WeakPolarHBondContact O-CB 3.34Å; M122-R126 PolarHBondContact O-N 2.8Å; M122-T155 HydrophobicContact CE-CG2 3.78Å; M122-I158 HydrophobicContact CE-CB 3.78Å; M122-I158 HydrophobicContact CE-CD1 4.21Å; M122-I158 HydrophobicContact CE-CG2 3.58Å; M122-I158 HydrophobicContact SD-CB 4.42Å; M122-I158 HydrophobicContact SD-CG2 3.55Å; M122-I158 VanDerWaalsContact SD-CG2 3.55Å; M122-L159 HydrophobicContact CE-CD2 4.14Å; M122-L159 HydrophobicContact CE-CG 3.97Å; M122-L159 HydrophobicContact SD-CD2 4.08Å |
| 123 | F | 86.4 | Confident | 88.6 | Confident | 133 Ų | 133 | 76 Ų | 76 | 58% | 0.583 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -60.1 | -58.2 | -179.9 | -179.9 | -94.3 | 0 | 0 | 0 | 113.5 | P119 M121 A125 R126 T127 | P119-F123 PolarHBondContact O-N 3Å; M121-F123 VanDerWaalsContact C-N 3.28Å; M121-F123 PolarHBondContact O-N 2.91Å; F123-A125 PolarHBondContact O-N 3.4Å; F123-R126 PolarHBondContact O-N 3.22Å; F123-T127 PolarHBondContact O-N 3.31Å; F123-T127 VanDerWaalsContact O-N 3.16Å; F123-T127 PolarHBondContact O-OG1 3.22Å |
| 124 | P | 87.4 | Confident | 87.6 | Confident | 74 Ų | 74 | 76.8 Ų | 76.8 | 48% | 0.481 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -65.9 | -35.9 | 177.1 | 25.8 | -34.1 | 0 | 0 | 0 | 112.5 | L120 M121 R126 T127 A128 | L120-P124 WeakPolarHBondContact O-CD 3.39Å; M121-P124 VanDerWaalsContact O-CD 3.25Å; M121-P124 WeakPolarHBondContact O-CD 3.34Å; M121-P124 WeakPolarHBondContact O-CG 3.39Å; P124-R126 VanDerWaalsContact C-N 3.34Å; P124-R126 PolarHBondContact O-N 3.35Å; P124-T127 PolarHBondContact O-N 2.91Å; P124-A128 WeakPolarHBondContact O-CB 3.47Å; P124-A128 PolarHBondContact O-N 3.4Å |
| 125 | A | 87.6 | Confident | 86.3 | Confident | 46 Ų | 46 | 81.7 Ų | 81.7 | 38% | 0.38 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -59.8 | -45.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | M121 F123 A128 L129 | M121-A125 WeakPolarHBondContact O-CB 3.38Å; M121-A125 PolarHBondContact O-N 3.36Å; F123-A125 PolarHBondContact O-N 3.4Å; A125-A128 PolarHBondContact O-N 2.91Å; A125-L129 WeakPolarHBondContact O-CB 2.9Å; A125-L129 PolarHBondContact O-N 3.01Å |
| 126 | R | 88.3 | Confident | 84.7 | Confident | 55 Ų | 55 | 85 Ų | 85 | 21% | 0.208 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -62.7 | -45.5 | 176.5 | -175.3 | -173.2 | 67.2 | 173.7 | -0.6 | 111.8 | M122 F123 P124 A128 L129 F130 L154 I158 | M122-R126 WeakPolarHBondContact O-CB 3.34Å; M122-R126 PolarHBondContact O-N 2.8Å; F123-R126 PolarHBondContact O-N 3.22Å; P124-R126 VanDerWaalsContact C-N 3.34Å; P124-R126 PolarHBondContact O-N 3.35Å; R126-A128 VanDerWaalsContact C-N 3.34Å; R126-A128 PolarHBondContact O-N 3.29Å; R126-L129 PolarHBondContact O-N 3.44Å; R126-F130 WeakPolarHBondContact O-CB 3.3Å; R126-F130 PolarHBondContact O-N 3.17Å; R126-L154 HydrophobicContact CG-CB 4.39Å; R126-L154 HydrophobicContact CG-CD2 3.57Å; R126-L154 HydrophobicContact CG-CG 4.03Å; R126-L154 WeakPolarHBondContact O-CD2 3.47Å; R126-I158 HydrophobicContact CB-CD1 4.31Å |
| 127 | T | 84.4 | Confident | 82.9 | Confident | 64 Ų | 64 | 90.7 Ų | 90.7 | 39% | 0.393 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62.3 | -42.9 | 178.3 | -58.7 | 0 | 0 | 0 | 0 | 111.3 | F123 P124 F130 C131 | F123-T127 PolarHBondContact O-N 3.31Å; F123-T127 VanDerWaalsContact O-N 3.16Å; F123-T127 PolarHBondContact O-OG1 3.22Å; P124-T127 PolarHBondContact O-N 2.91Å; T127-F130 PolarHBondContact O-N 2.86Å; T127-C131 WeakPolarHBondContact O-CB 3.47Å; T127-C131 PolarHBondContact O-N 3.42Å; T127-C131 PolarHBondContact O-SG 2.94Å; T127-C131 VanDerWaalsContact O-SG 3.37Å |
| 128 | A | 86.7 | Confident | 80.8 | Confident | 63 Ų | 63 | 97.2 Ų | 97.2 | 52% | 0.521 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.5 | -45.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | P124 A125 R126 C131 L132 | P124-A128 WeakPolarHBondContact O-CB 3.47Å; P124-A128 PolarHBondContact O-N 3.4Å; A125-A128 PolarHBondContact O-N 2.91Å; R126-A128 VanDerWaalsContact C-N 3.34Å; R126-A128 PolarHBondContact O-N 3.29Å; A128-C131 PolarHBondContact O-N 3.06Å; A128-L132 WeakPolarHBondContact O-CB 3.32Å; A128-L132 PolarHBondContact O-N 2.93Å |
| 129 | L | 85.9 | Confident | 78.7 | Confident | 49 Ų | 49 | 97.6 Ų | 97.6 | 26% | 0.257 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -67.3 | -40.7 | 179.7 | -168.3 | 61.3 | 0 | 0 | 0 | 112.2 | A125 R126 L132 I133 L154 I158 | A125-L129 WeakPolarHBondContact O-CB 2.9Å; A125-L129 PolarHBondContact O-N 3.01Å; R126-L129 PolarHBondContact O-N 3.44Å; L129-L132 PolarHBondContact O-N 3.21Å; L129-I133 HydrophobicContact CD1-CD1 3.51Å; L129-I133 HydrophobicContact CD1-CG1 4.06Å; L129-I133 HydrophobicContact CG-CD1 3.84Å; L129-I133 HydrophobicContact CG-CG1 4.49Å; L129-I133 PolarHBondContact O-N 3.29Å; L129-L154 HydrophobicContact CB-CD1 4.34Å; L129-L154 HydrophobicContact CB-CD2 4.45Å; L129-L154 HydrophobicContact CD2-CD1 3.39Å; L129-L154 HydrophobicContact CD2-CG 4.15Å; L129-L154 HydrophobicContact CG-CD1 3.78Å; L129-I158 HydrophobicContact CD2-CD1 3.84Å; L129-I158 HydrophobicContact CD2-CG1 3.67Å |
| 130 | F | 84.2 | Confident | 76.7 | Confident | 32 Ų | 32 | 101.4 Ų | 101.4 | 14% | 0.14 | 53% | 0.525 | C | S | . | . | H | α-helix | trans | -58.5 | -48.7 | 173.1 | 177.6 | -100.4 | 0 | 0 | 0 | 111.1 | R126 T127 L132 L134 R135 V144 L146 L154 | R126-F130 WeakPolarHBondContact O-CB 3.3Å; R126-F130 PolarHBondContact O-N 3.17Å; T127-F130 PolarHBondContact O-N 2.86Å; F130-L132 PolarHBondContact O-N 3.48Å; F130-L134 HydrophobicContact CD2-CB 3.73Å; F130-L134 HydrophobicContact CD2-CD1 3.46Å; F130-L134 VanDerWaalsContact CD2-CD1 3.46Å; F130-L134 HydrophobicContact CD2-CG 4.22Å; F130-L134 HydrophobicContact CE2-CB 3.44Å; F130-L134 VanDerWaalsContact CE2-CB 3.44Å; F130-L134 HydrophobicContact CE2-CD1 3.68Å; F130-L134 HydrophobicContact CE2-CG 4.14Å; F130-L134 HydrophobicContact CZ-CB 4.1Å; F130-L134 WeakPolarHBondContact O-CB 3.34Å; F130-L134 PolarHBondContact O-N 3.24Å; F130-R135 PolarHBondContact O-N 3.36Å; F130-V144 HydrophobicContact CE1-CG1 4.24Å; F130-V144 HydrophobicContact CE1-CG2 4.38Å; F130-V144 HydrophobicContact CZ-CG1 3.76Å; F130-L146 HydrophobicContact CD2-CD1 4.29Å; F130-L146 HydrophobicContact CD2-CD2 3.44Å; F130-L146 VanDerWaalsContact CD2-CD2 3.44Å; F130-L146 HydrophobicContact CE2-CD1 3.29Å; F130-L146 HydrophobicContact CE2-CD2 3.27Å; F130-L146 HydrophobicContact CE2-CG 3.9Å; F130-L146 HydrophobicContact CG-CD2 4.24Å; F130-L146 HydrophobicContact CZ-CD1 3.63Å; F130-L146 HydrophobicContact CZ-CD2 3.92Å; F130-L146 HydrophobicContact CZ-CG 4.33Å; F130-L154 HydrophobicContact CB-CD2 3.86Å |
| 131 | C | 82.8 | Confident | 74.5 | Confident | 45 Ų | 45 | 100.8 Ų | 100.8 | 30% | 0.304 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -65.8 | -22 | 177.8 | -72.7 | 0 | 0 | 0 | 0 | 114.2 | T127 A128 R135 | T127-C131 WeakPolarHBondContact O-CB 3.47Å; T127-C131 PolarHBondContact O-N 3.42Å; T127-C131 PolarHBondContact O-SG 2.94Å; T127-C131 VanDerWaalsContact O-SG 3.37Å; A128-C131 PolarHBondContact O-N 3.06Å; C131-R135 WeakPolarHBondContact O-CB 3.48Å |
| 132 | L | 83.4 | Confident | 72.4 | Confident | 141 Ų | 141 | 102.6 Ų | 102.6 | 74% | 0.738 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -85.2 | -42.4 | 179.2 | -175.2 | 66.5 | 0 | 0 | 0 | 112.4 | A128 L129 F130 | A128-L132 WeakPolarHBondContact O-CB 3.32Å; A128-L132 PolarHBondContact O-N 2.93Å; L129-L132 PolarHBondContact O-N 3.21Å; F130-L132 PolarHBondContact O-N 3.48Å |
| 133 | I | 81 | Confident | 70.3 | Confident | 117 Ų | 117 | 106.9 Ų | 106.9 | 60% | 0.6 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -95.3 | -41 | -171.7 | -60.1 | 179.6 | 0 | 0 | 0 | 112.2 | L129 | L129-I133 HydrophobicContact CD1-CD1 3.51Å; L129-I133 HydrophobicContact CD1-CG1 4.06Å; L129-I133 HydrophobicContact CG-CD1 3.84Å; L129-I133 HydrophobicContact CG-CG1 4.49Å; L129-I133 PolarHBondContact O-N 3.29Å |
| 134 | L | 74.2 | Confident | 68.6 | Low | 86 Ų | 86 | 105.1 Ų | 105.1 | 45% | 0.45 | 56% | 0.561 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -109.4 | -7.7 | -165.7 | -73.4 | 152.5 | 0 | 0 | 0 | 113.4 | F130 D136 T150 | F130-L134 HydrophobicContact CD2-CB 3.73Å; F130-L134 HydrophobicContact CD2-CD1 3.46Å; F130-L134 VanDerWaalsContact CD2-CD1 3.46Å; F130-L134 HydrophobicContact CD2-CG 4.22Å; F130-L134 HydrophobicContact CE2-CB 3.44Å; F130-L134 VanDerWaalsContact CE2-CB 3.44Å; F130-L134 HydrophobicContact CE2-CD1 3.68Å; F130-L134 HydrophobicContact CE2-CG 4.14Å; F130-L134 HydrophobicContact CZ-CB 4.1Å; F130-L134 WeakPolarHBondContact O-CB 3.34Å; F130-L134 PolarHBondContact O-N 3.24Å; L134-D136 PolarHBondContact O-N 3.44Å; L134-T150 HydrophobicContact CD1-CG2 3.89Å |
| 135 | R | 66.9 | Low | 66.8 | Low | 176 Ų | 176 | 109 Ų | 109 | 66% | 0.664 | 58% | 0.578 | S | S | * | * | trans | -76.8 | 108 | 178.4 | -176 | 152.8 | 65.9 | 162.7 | 3.9 | 110.5 | F130 C131 | F130-R135 PolarHBondContact O-N 3.36Å; C131-R135 WeakPolarHBondContact O-CB 3.48Å | ||
| 136 | D | 58.5 | Low | 65.2 | Low | 121 Ų | 121 | 108.2 Ų | 108.2 | 65% | 0.647 | 57% | 0.567 | S | S | * | * | trans | -71 | 141.8 | 167.4 | -155.4 | -7.3 | 0 | 0 | 0 | 110.7 | L134 E138 | L134-D136 PolarHBondContact O-N 3.44Å; D136-E138 VanDerWaalsContact C-N 3.26Å; D136-E138 PolarHBondContact O-N 3.17Å | ||
| 137 | K | 57 | Low | 64 | Low | 206 Ų | 206 | 112.2 Ų | 112.2 | 90% | 0.896 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.9 | -12.4 | -170.6 | -76.9 | 179 | 177.9 | 172.9 | 0 | 113.8 | ||
| 138 | E | 51.2 | Low | 63.3 | Low | 179 Ų | 179 | 117.2 Ų | 117.2 | 84% | 0.836 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106 | -8.9 | -174.4 | -72.3 | -164.6 | 147.8 | 0 | 0 | 115.8 | D136 I140 | D136-E138 VanDerWaalsContact C-N 3.26Å; D136-E138 PolarHBondContact O-N 3.17Å; E138-I140 PolarHBondContact O-N 3.39Å; E138-I140 VanDerWaalsContact O-N 3.15Å |
| 139 | S | 47 | Very low | 62.8 | Low | 90 Ų | 90 | 120.8 Ų | 120.8 | 63% | 0.629 | 61% | 0.608 | S | S | * | * | trans | -90.4 | 83 | -178.7 | -176 | 0 | 0 | 0 | 0 | 112 | T141 | S139-T141 PolarHBondContact O-N 3.01Š| ||
| 140 | I | 49.2 | Very low | 62.4 | Low | 162 Ų | 162 | 120.1 Ų | 120.1 | 83% | 0.831 | 61% | 0.606 | S | S | * | * | trans | -87.9 | 52.7 | 164.9 | -47 | 178.4 | 0 | 0 | 0 | 108.4 | E138 | E138-I140 PolarHBondContact O-N 3.39Å; E138-I140 VanDerWaalsContact O-N 3.15Å | ||
| 141 | T | 42.3 | Very low | 62.1 | Low | 115 Ų | 115 | 121.7 Ų | 121.7 | 71% | 0.706 | 61% | 0.613 | S | S | * | * | trans | -140.5 | 129 | 171.5 | -39.1 | 0 | 0 | 0 | 0 | 110.3 | S139 | S139-T141 PolarHBondContact O-N 3.01Š| ||
| 142 | H | 47.2 | Very low | 62.2 | Low | 174 Ų | 174 | 125.9 Ų | 125.9 | 81% | 0.806 | 63% | 0.628 | S | S | * | * | S | Bend | trans | -51.2 | 159.6 | -176.3 | -85.3 | -113.1 | 0 | 0 | 0 | 114.1 | ||
| 143 | T | 44 | Very low | 62.4 | Low | 117 Ų | 117 | 123 Ų | 123 | 72% | 0.718 | 61% | 0.613 | S | S | * | * | trans | 68.3 | 75.2 | 175.6 | 69.8 | 0 | 0 | 0 | 0 | 113.9 | D145 | T143-D145 PolarHBondContact O-N 2.97Š| ||
| 144 | V | 51.5 | Low | 62.7 | Low | 96 Ų | 96 | 118.2 Ų | 118.2 | 58% | 0.582 | 59% | 0.588 | S | S | * | * | trans | -65 | 86.1 | 151.6 | -155.4 | 0 | 0 | 0 | 0 | 106.1 | F130 L146 | F130-V144 HydrophobicContact CE1-CG1 4.24Å; F130-V144 HydrophobicContact CE1-CG2 4.38Å; F130-V144 HydrophobicContact CZ-CG1 3.76Å; V144-L146 HydrophobicContact CB-CB 4.36Å; V144-L146 HydrophobicContact CG1-CB 3.62Å; V144-L146 HydrophobicContact CG1-CD1 3.62Å; V144-L146 HydrophobicContact CG1-CG 4.18Å; V144-L146 PolarHBondContact O-N 2.97Å | ||
| 145 | D | 49.2 | Very low | 63.4 | Low | 155 Ų | 155 | 116.1 Ų | 116.1 | 83% | 0.829 | 58% | 0.579 | S | S | * | * | trans | -65.2 | 69.6 | 154.3 | -84 | -34.4 | 0 | 0 | 0 | 106.3 | T143 E147 | T143-D145 PolarHBondContact O-N 2.97Å; D145-E147 PolarHBondContact O-N 3.43Å; D145-E147 VanDerWaalsContact O-N 3.14Å | ||
| 146 | L | 54.9 | Low | 64.5 | Low | 29 Ų | 29 | 110.3 Ų | 110.3 | 15% | 0.152 | 57% | 0.569 | C | S | . | * | trans | -72.5 | 113.7 | 179.9 | -165.1 | 73.4 | 0 | 0 | 0 | 105.1 | F130 V144 K148 T150 F151 | F130-L146 HydrophobicContact CD2-CD1 4.29Å; F130-L146 HydrophobicContact CD2-CD2 3.44Å; F130-L146 VanDerWaalsContact CD2-CD2 3.44Å; F130-L146 HydrophobicContact CE2-CD1 3.29Å; F130-L146 HydrophobicContact CE2-CD2 3.27Å; F130-L146 HydrophobicContact CE2-CG 3.9Å; F130-L146 HydrophobicContact CG-CD2 4.24Å; F130-L146 HydrophobicContact CZ-CD1 3.63Å; F130-L146 HydrophobicContact CZ-CD2 3.92Å; F130-L146 HydrophobicContact CZ-CG 4.33Å; V144-L146 HydrophobicContact CB-CB 4.36Å; V144-L146 HydrophobicContact CG1-CB 3.62Å; V144-L146 HydrophobicContact CG1-CD1 3.62Å; V144-L146 HydrophobicContact CG1-CG 4.18Å; V144-L146 PolarHBondContact O-N 2.97Å; L146-K148 PolarHBondContact O-N 3.11Å; L146-K148 VanDerWaalsContact O-N 3.14Å; L146-T150 HydrophobicContact CD1-CG2 4.2Å; L146-T150 HydrophobicContact CD2-CG2 3.99Å; L146-T150 HydrophobicContact CG-CG2 4.14Å; L146-F151 HydrophobicContact CB-CD2 4.06Å; L146-F151 HydrophobicContact CB-CE2 3.45Å; L146-F151 VanDerWaalsContact CB-CE2 3.45Å; L146-F151 HydrophobicContact CB-CZ 3.78Å; L146-F151 HydrophobicContact CD2-CD1 4.1Å; L146-F151 HydrophobicContact CD2-CD2 4.11Å; L146-F151 HydrophobicContact CD2-CE1 3.87Å; L146-F151 HydrophobicContact CD2-CE2 3.95Å; L146-F151 HydrophobicContact CD2-CG 4.22Å; L146-F151 HydrophobicContact CD2-CZ 3.79Å; L146-F151 HydrophobicContact CG-CD2 4.34Å; L146-F151 HydrophobicContact CG-CE2 4.13Å; L146-F151 HydrophobicContact CG-CZ 4.38Å; L146-F151 VanDerWaalsContact O-CD2 3.3Å; L146-F151 WeakPolarHBondContact O-CD2 3.33Å; L146-F151 WeakPolarHBondContact O-CE2 3.2Å | ||
| 147 | E | 62.8 | Low | 66.1 | Low | 139 Ų | 139 | 108.6 Ų | 108.6 | 65% | 0.65 | 56% | 0.562 | S | S | * | * | trans | -36.3 | 121.7 | 176 | -146.4 | 171 | -170 | 0 | 0 | 108.8 | D145 F149 T150 | D145-E147 PolarHBondContact O-N 3.43Å; D145-E147 VanDerWaalsContact O-N 3.14Å; E147-F149 HydrophobicContact CG-CB 4.3Å; E147-F149 CarbonylContact O-C 3.55Å; E147-F149 PolarHBondContact O-N 3.07Å; E147-T150 PolarHBondContact O-N 3.03Å | ||
| 148 | K | 69.8 | Low | 67.7 | Low | 170 Ų | 170 | 99.8 Ų | 99.8 | 74% | 0.739 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -44.9 | -31.6 | -179.6 | -67.5 | 174.8 | -177.9 | 176 | 0 | 110.7 | L146 F151 H152 | L146-K148 PolarHBondContact O-N 3.11Å; L146-K148 VanDerWaalsContact O-N 3.14Å; K148-F151 WeakPolarHBondContact O-CB 3.44Å; K148-F151 PolarHBondContact O-N 3.35Å; K148-H152 PolarHBondContact O-N 3.19Å; K148-H152 VanDerWaalsContact O-N 3.07Å; K148-H152 PolarHBondContact O-ND1 3.31Å |
| 149 | F | 74.8 | Confident | 69.7 | Low | 138 Ų | 138 | 94.9 Ų | 94.9 | 61% | 0.605 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -56.1 | -49.8 | 173.9 | -164 | -114.5 | 0 | 0 | 0 | 115 | E147 F151 H152 I153 | E147-F149 HydrophobicContact CG-CB 4.3Å; E147-F149 CarbonylContact O-C 3.55Å; E147-F149 PolarHBondContact O-N 3.07Å; F149-F151 VanDerWaalsContact C-N 3.26Å; F149-F151 PolarHBondContact O-N 3.09Å; F149-H152 PolarHBondContact O-N 3.19Å; F149-H152 VanDerWaalsContact O-N 3.14Å; F149-I153 HydrophobicContact CD1-CD1 3.58Å; F149-I153 HydrophobicContact CD1-CG1 4.46Å; F149-I153 HydrophobicContact CE1-CD1 3.22Å; F149-I153 HydrophobicContact CE1-CG1 4.26Å; F149-I153 HydrophobicContact CE2-CD1 4.37Å; F149-I153 HydrophobicContact CG-CD1 4.31Å; F149-I153 HydrophobicContact CZ-CD1 3.66Å; F149-I153 HydrophobicContact CZ-CG1 4.36Å; F149-I153 WeakPolarHBondContact O-CG1 3.44Å; F149-I153 PolarHBondContact O-N 3.35Å |
| 150 | T | 78.4 | Confident | 71.9 | Confident | 34 Ų | 34 | 95.9 Ų | 95.9 | 21% | 0.209 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -61.2 | -37.3 | 177 | -46.5 | 0 | 0 | 0 | 0 | 111.4 | L134 L146 E147 I153 L154 | L134-T150 HydrophobicContact CD1-CG2 3.89Å; L146-T150 HydrophobicContact CD1-CG2 4.2Å; L146-T150 HydrophobicContact CD2-CG2 3.99Å; L146-T150 HydrophobicContact CG-CG2 4.14Å; E147-T150 PolarHBondContact O-N 3.03Å; T150-I153 PolarHBondContact O-N 2.92Å; T150-L154 WeakPolarHBondContact O-CB 3.39Å; T150-L154 PolarHBondContact O-N 3.37Å |
| 151 | F | 78.9 | Confident | 73.9 | Confident | 65 Ų | 65 | 93.8 Ų | 93.8 | 29% | 0.285 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -64.1 | -41.2 | 175.1 | -77.3 | -68.2 | 0 | 0 | 0 | 112.9 | L146 K148 F149 T155 | L146-F151 HydrophobicContact CB-CD2 4.06Å; L146-F151 HydrophobicContact CB-CE2 3.45Å; L146-F151 VanDerWaalsContact CB-CE2 3.45Å; L146-F151 HydrophobicContact CB-CZ 3.78Å; L146-F151 HydrophobicContact CD2-CD1 4.1Å; L146-F151 HydrophobicContact CD2-CD2 4.11Å; L146-F151 HydrophobicContact CD2-CE1 3.87Å; L146-F151 HydrophobicContact CD2-CE2 3.95Å; L146-F151 HydrophobicContact CD2-CG 4.22Å; L146-F151 HydrophobicContact CD2-CZ 3.79Å; L146-F151 HydrophobicContact CG-CD2 4.34Å; L146-F151 HydrophobicContact CG-CE2 4.13Å; L146-F151 HydrophobicContact CG-CZ 4.38Å; L146-F151 VanDerWaalsContact O-CD2 3.3Å; L146-F151 WeakPolarHBondContact O-CD2 3.33Å; L146-F151 WeakPolarHBondContact O-CE2 3.2Å; K148-F151 WeakPolarHBondContact O-CB 3.44Å; K148-F151 PolarHBondContact O-N 3.35Å; F149-F151 VanDerWaalsContact C-N 3.26Å; F149-F151 PolarHBondContact O-N 3.09Å; F151-T155 WeakPolarHBondContact O-CB 3.35Å; F151-T155 PolarHBondContact O-N 3.25Å; F151-T155 PolarHBondContact O-OG1 3.49Å |
| 152 | H | 84.1 | Confident | 76.3 | Confident | 133 Ų | 133 | 92.4 Ų | 92.4 | 62% | 0.616 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -69.2 | -43.1 | 177 | -71.1 | 91.9 | 0 | 0 | 0 | 111.2 | K148 F149 L154 T155 A156 | K148-H152 PolarHBondContact O-N 3.19Å; K148-H152 VanDerWaalsContact O-N 3.07Å; K148-H152 PolarHBondContact O-ND1 3.31Å; F149-H152 PolarHBondContact O-N 3.19Å; F149-H152 VanDerWaalsContact O-N 3.14Å; H152-L154 PolarHBondContact O-N 2.94Å; H152-T155 PolarHBondContact O-N 3.47Å; H152-A156 WeakPolarHBondContact O-CB 3.34Å; H152-A156 PolarHBondContact O-N 2.62Å |
| 153 | I | 87.8 | Confident | 78.4 | Confident | 81 Ų | 81 | 87.9 Ų | 87.9 | 42% | 0.415 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -59.4 | -49.2 | 176.6 | -71.4 | 174.9 | 0 | 0 | 0 | 110.7 | F149 T150 T155 A156 V157 | F149-I153 HydrophobicContact CD1-CD1 3.58Å; F149-I153 HydrophobicContact CD1-CG1 4.46Å; F149-I153 HydrophobicContact CE1-CD1 3.22Å; F149-I153 HydrophobicContact CE1-CG1 4.26Å; F149-I153 HydrophobicContact CE2-CD1 4.37Å; F149-I153 HydrophobicContact CG-CD1 4.31Å; F149-I153 HydrophobicContact CZ-CD1 3.66Å; F149-I153 HydrophobicContact CZ-CG1 4.36Å; F149-I153 WeakPolarHBondContact O-CG1 3.44Å; F149-I153 PolarHBondContact O-N 3.35Å; T150-I153 PolarHBondContact O-N 2.92Å; I153-T155 VanDerWaalsContact C-N 3.29Å; I153-T155 PolarHBondContact O-N 3.01Å; I153-A156 PolarHBondContact O-N 3.04Å; I153-A156 VanDerWaalsContact O-N 3.15Å; I153-V157 HydrophobicContact CG2-CG2 4.22Å; I153-V157 WeakPolarHBondContact O-CG2 3.48Å; I153-V157 PolarHBondContact O-N 2.96Å |
| 154 | L | 86.3 | Confident | 80.7 | Confident | 17 Ų | 17 | 86.2 Ų | 86.2 | 9% | 0.089 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -61.8 | -41.1 | -177.2 | -166.9 | 61.3 | 0 | 0 | 0 | 111.7 | R126 L129 F130 T150 H152 V157 I158 | R126-L154 HydrophobicContact CG-CB 4.39Å; R126-L154 HydrophobicContact CG-CD2 3.57Å; R126-L154 HydrophobicContact CG-CG 4.03Å; R126-L154 WeakPolarHBondContact O-CD2 3.47Å; L129-L154 HydrophobicContact CB-CD1 4.34Å; L129-L154 HydrophobicContact CB-CD2 4.45Å; L129-L154 HydrophobicContact CD2-CD1 3.39Å; L129-L154 HydrophobicContact CD2-CG 4.15Å; L129-L154 HydrophobicContact CG-CD1 3.78Å; F130-L154 HydrophobicContact CB-CD2 3.86Å; T150-L154 WeakPolarHBondContact O-CB 3.39Å; T150-L154 PolarHBondContact O-N 3.37Å; H152-L154 PolarHBondContact O-N 2.94Å; L154-V157 PolarHBondContact O-N 3.4Å; L154-I158 HydrophobicContact CG-CD1 4.34Å; L154-I158 WeakPolarHBondContact O-CD1 3.42Å; L154-I158 VanDerWaalsContact O-CG1 3.26Å; L154-I158 WeakPolarHBondContact O-CG1 3.4Å; L154-I158 PolarHBondContact O-N 3.01Å; L154-I158 VanDerWaalsContact O-N 3.08Å |
| 155 | T | 89.3 | Confident | 82.5 | Confident | 41 Ų | 41 | 85 Ų | 85 | 25% | 0.252 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -65 | -43.8 | 175.9 | -52.3 | 0 | 0 | 0 | 0 | 111 | M122 F151 H152 I153 I158 L159 | M122-T155 HydrophobicContact CE-CG2 3.78Å; F151-T155 WeakPolarHBondContact O-CB 3.35Å; F151-T155 PolarHBondContact O-N 3.25Å; F151-T155 PolarHBondContact O-OG1 3.49Å; H152-T155 PolarHBondContact O-N 3.47Å; I153-T155 VanDerWaalsContact C-N 3.29Å; I153-T155 PolarHBondContact O-N 3.01Å; T155-I158 PolarHBondContact O-N 3.45Å; T155-L159 HydrophobicContact CG2-CD1 4.16Å; T155-L159 WeakPolarHBondContact O-CB 3.28Å; T155-L159 WeakPolarHBondContact O-CG 3.32Å; T155-L159 PolarHBondContact O-N 3.18Å |
| 156 | A | 90.8 | Very high | 84.4 | Confident | 55 Ų | 55 | 80.7 Ų | 80.7 | 46% | 0.455 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -62.6 | -42.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112 | H152 I153 L159 L160 | H152-A156 WeakPolarHBondContact O-CB 3.34Å; H152-A156 PolarHBondContact O-N 2.62Å; I153-A156 PolarHBondContact O-N 3.04Å; I153-A156 VanDerWaalsContact O-N 3.15Å; A156-L159 PolarHBondContact O-N 2.92Å; A156-L160 WeakPolarHBondContact O-CB 3.48Å; A156-L160 PolarHBondContact O-N 2.92Å |
| 157 | V | 91 | Very high | 86.1 | Confident | 84 Ų | 84 | 85.5 Ų | 85.5 | 51% | 0.509 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -62.7 | -46.9 | 177.2 | 170.5 | 0 | 0 | 0 | 0 | 111.1 | I153 L154 L160 F161 | I153-V157 HydrophobicContact CG2-CG2 4.22Å; I153-V157 WeakPolarHBondContact O-CG2 3.48Å; I153-V157 PolarHBondContact O-N 2.96Å; L154-V157 PolarHBondContact O-N 3.4Å; V157-L160 PolarHBondContact O-N 2.86Å; V157-F161 VanDerWaalsContact O-CB 3.29Å; V157-F161 WeakPolarHBondContact O-CB 3.46Å; V157-F161 PolarHBondContact O-N 3.3Å |
| 158 | I | 91.1 | Very high | 87.3 | Confident | 21 Ų | 21 | 84.9 Ų | 84.9 | 11% | 0.108 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -61.8 | -47.7 | 178.2 | -65.5 | 163.9 | 0 | 0 | 0 | 110.4 | M122 R126 L129 L154 T155 F161 N162 | M122-I158 HydrophobicContact CE-CB 3.78Å; M122-I158 HydrophobicContact CE-CD1 4.21Å; M122-I158 HydrophobicContact CE-CG2 3.58Å; M122-I158 HydrophobicContact SD-CB 4.42Å; M122-I158 HydrophobicContact SD-CG2 3.55Å; M122-I158 VanDerWaalsContact SD-CG2 3.55Å; R126-I158 HydrophobicContact CB-CD1 4.31Å; L129-I158 HydrophobicContact CD2-CD1 3.84Å; L129-I158 HydrophobicContact CD2-CG1 3.67Å; L154-I158 HydrophobicContact CG-CD1 4.34Å; L154-I158 WeakPolarHBondContact O-CD1 3.42Å; L154-I158 VanDerWaalsContact O-CG1 3.26Å; L154-I158 WeakPolarHBondContact O-CG1 3.4Å; L154-I158 PolarHBondContact O-N 3.01Å; L154-I158 VanDerWaalsContact O-N 3.08Å; T155-I158 PolarHBondContact O-N 3.45Å; I158-F161 PolarHBondContact O-N 3.27Å; I158-N162 WeakPolarHBondContact CG2-ND2 3.29Å; I158-N162 PolarHBondContact O-N 2.83Å; I158-N162 PolarHBondContact O-ND2 3.24Å |
| 159 | L | 92.8 | Very high | 88 | Confident | 76 Ų | 76 | 78.3 Ų | 78.3 | 40% | 0.398 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -64.6 | -45.4 | -179.7 | -73.3 | 176.8 | 0 | 0 | 0 | 111.8 | M122 T155 A156 F161 N162 T163 | M122-L159 HydrophobicContact CE-CD2 4.14Å; M122-L159 HydrophobicContact CE-CG 3.97Å; M122-L159 HydrophobicContact SD-CD2 4.08Å; T155-L159 HydrophobicContact CG2-CD1 4.16Å; T155-L159 WeakPolarHBondContact O-CB 3.28Å; T155-L159 WeakPolarHBondContact O-CG 3.32Å; T155-L159 PolarHBondContact O-N 3.18Å; A156-L159 PolarHBondContact O-N 2.92Å; L159-F161 VanDerWaalsContact C-N 3.32Å; L159-F161 PolarHBondContact O-N 3.19Å; L159-N162 PolarHBondContact O-N 3.08Å; L159-T163 WeakPolarHBondContact O-CB 3.25Å; L159-T163 PolarHBondContact O-N 3.37Å; L159-T163 PolarHBondContact O-OG1 2.84Å |
| 160 | L | 93.6 | Very high | 88.3 | Confident | 111 Ų | 111 | 77.3 Ų | 77.3 | 58% | 0.581 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -61.5 | -41.8 | 179.1 | -175 | 145.4 | 0 | 0 | 0 | 111.3 | A156 V157 T163 I164 | A156-L160 WeakPolarHBondContact O-CB 3.48Å; A156-L160 PolarHBondContact O-N 2.92Å; V157-L160 PolarHBondContact O-N 2.86Å; L160-T163 PolarHBondContact O-N 3.35Å; L160-I164 HydrophobicContact CD2-CD1 3.46Å; L160-I164 VanDerWaalsContact CD2-CD1 3.46Å; L160-I164 HydrophobicContact CD2-CG1 4.37Å; L160-I164 HydrophobicContact CG-CD1 4.28Å; L160-I164 VanDerWaalsContact O-CG1 3.29Å; L160-I164 WeakPolarHBondContact O-CG1 3.47Å; L160-I164 PolarHBondContact O-N 3.31Å |
| 161 | F | 92 | Very high | 88.6 | Confident | 119 Ų | 119 | 78.2 Ų | 78.2 | 52% | 0.522 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -61 | -48.3 | 174.2 | 176.9 | -103.2 | 0 | 0 | 0 | 112.3 | V157 I158 L159 T163 I164 L165 | V157-F161 VanDerWaalsContact O-CB 3.29Å; V157-F161 WeakPolarHBondContact O-CB 3.46Å; V157-F161 PolarHBondContact O-N 3.3Å; I158-F161 PolarHBondContact O-N 3.27Å; L159-F161 VanDerWaalsContact C-N 3.32Å; L159-F161 PolarHBondContact O-N 3.19Å; F161-T163 VanDerWaalsContact C-N 3.34Å; F161-T163 PolarHBondContact O-N 3.38Å; F161-I164 PolarHBondContact O-N 2.86Å; F161-L165 HydrophobicContact CD1-CD1 4.02Å; F161-L165 HydrophobicContact CE1-CD1 3.38Å; F161-L165 HydrophobicContact CE1-CG 4.26Å; F161-L165 HydrophobicContact CE2-CD1 4.25Å; F161-L165 HydrophobicContact CE2-CG 4.38Å; F161-L165 HydrophobicContact CZ-CD1 3.52Å; F161-L165 HydrophobicContact CZ-CD2 4.49Å; F161-L165 HydrophobicContact CZ-CG 4.13Å; F161-L165 WeakPolarHBondContact O-CG 3.41Å; F161-L165 PolarHBondContact O-N 2.87Å |
| 162 | N | 91.9 | Very high | 88.9 | Confident | 85 Ų | 85 | 78.6 Ų | 78.6 | 46% | 0.455 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -62.9 | -39.4 | 177.3 | -78.1 | -78 | 0 | 0 | 0 | 112.1 | I158 L159 L165 A166 | I158-N162 WeakPolarHBondContact CG2-ND2 3.29Å; I158-N162 PolarHBondContact O-N 2.83Å; I158-N162 PolarHBondContact O-ND2 3.24Å; L159-N162 PolarHBondContact O-N 3.08Å; N162-L165 PolarHBondContact O-N 3.49Å; N162-A166 WeakPolarHBondContact O-CB 3.31Å; N162-A166 PolarHBondContact O-N 3.08Å |
| 163 | T | 91.8 | Very high | 89.1 | Confident | 80 Ų | 80 | 75.9 Ų | 75.9 | 49% | 0.491 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -64.3 | -43.2 | 176.8 | -60.2 | 0 | 0 | 0 | 0 | 111.6 | L159 L160 F161 A166 I167 | L159-T163 WeakPolarHBondContact O-CB 3.25Å; L159-T163 PolarHBondContact O-N 3.37Å; L159-T163 PolarHBondContact O-OG1 2.84Å; L160-T163 PolarHBondContact O-N 3.35Å; F161-T163 VanDerWaalsContact C-N 3.34Å; F161-T163 PolarHBondContact O-N 3.38Å; T163-A166 PolarHBondContact O-N 2.96Å; T163-I167 HydrophobicContact CG2-CD1 3.97Å; T163-I167 WeakPolarHBondContact O-CG1 3.42Å; T163-I167 PolarHBondContact O-N 3.36Å |
| 164 | I | 92.9 | Very high | 89.1 | Confident | 82 Ų | 82 | 73.4 Ų | 73.4 | 42% | 0.421 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -61.4 | -46.3 | 176 | -70.9 | 171.3 | 0 | 0 | 0 | 110.4 | L160 F161 A166 I167 L168 | L160-I164 HydrophobicContact CD2-CD1 3.46Å; L160-I164 VanDerWaalsContact CD2-CD1 3.46Å; L160-I164 HydrophobicContact CD2-CG1 4.37Å; L160-I164 HydrophobicContact CG-CD1 4.28Å; L160-I164 VanDerWaalsContact O-CG1 3.29Å; L160-I164 WeakPolarHBondContact O-CG1 3.47Å; L160-I164 PolarHBondContact O-N 3.31Å; F161-I164 PolarHBondContact O-N 2.86Å; I164-A166 VanDerWaalsContact C-N 3.32Å; I164-A166 PolarHBondContact O-N 3.32Å; I164-I167 PolarHBondContact O-N 2.88Å; I164-L168 HydrophobicContact CG2-CD1 3.68Å; I164-L168 HydrophobicContact CG2-CG 4.22Å; I164-L168 WeakPolarHBondContact O-CB 3.38Å; I164-L168 VanDerWaalsContact O-CG 3.3Å; I164-L168 WeakPolarHBondContact O-CG 3.43Å; I164-L168 PolarHBondContact O-N 3.42Å |
| 165 | L | 88.9 | Confident | 89.3 | Confident | 71 Ų | 71 | 75.7 Ų | 75.7 | 37% | 0.372 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -60.1 | -41.8 | 176.7 | -72.4 | -179.3 | 0 | 0 | 0 | 112.3 | F161 N162 I167 L168 T169 | F161-L165 HydrophobicContact CD1-CD1 4.02Å; F161-L165 HydrophobicContact CE1-CD1 3.38Å; F161-L165 HydrophobicContact CE1-CG 4.26Å; F161-L165 HydrophobicContact CE2-CD1 4.25Å; F161-L165 HydrophobicContact CE2-CG 4.38Å; F161-L165 HydrophobicContact CZ-CD1 3.52Å; F161-L165 HydrophobicContact CZ-CD2 4.49Å; F161-L165 HydrophobicContact CZ-CG 4.13Å; F161-L165 WeakPolarHBondContact O-CG 3.41Å; F161-L165 PolarHBondContact O-N 2.87Å; N162-L165 PolarHBondContact O-N 3.49Å; L165-I167 VanDerWaalsContact C-N 3.31Å; L165-I167 PolarHBondContact O-N 3.16Å; L165-L168 PolarHBondContact O-N 3.38Å; L165-T169 PolarHBondContact O-N 2.83Å |
| 166 | A | 89.3 | Confident | 89.3 | Confident | 63 Ų | 63 | 77.5 Ų | 77.5 | 52% | 0.521 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -64.4 | -35.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | N162 T163 I164 | N162-A166 WeakPolarHBondContact O-CB 3.31Å; N162-A166 PolarHBondContact O-N 3.08Å; T163-A166 PolarHBondContact O-N 2.96Å; I164-A166 VanDerWaalsContact C-N 3.32Å; I164-A166 PolarHBondContact O-N 3.32Å |
| 167 | I | 90 | Very high | 89.3 | Confident | 131 Ų | 131 | 74.9 Ų | 74.9 | 67% | 0.672 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -73.2 | -38.9 | 176 | -67.2 | 166.9 | 0 | 0 | 0 | 111.2 | T163 I164 L165 | T163-I167 HydrophobicContact CG2-CD1 3.97Å; T163-I167 WeakPolarHBondContact O-CG1 3.42Å; T163-I167 PolarHBondContact O-N 3.36Å; I164-I167 PolarHBondContact O-N 2.88Å; L165-I167 VanDerWaalsContact C-N 3.31Å; L165-I167 PolarHBondContact O-N 3.16Å |
| 168 | L | 87.6 | Confident | 89.3 | Confident | 125 Ų | 125 | 73.3 Ų | 73.3 | 65% | 0.654 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -74.3 | -27.9 | -177.8 | -71 | 175.6 | 0 | 0 | 0 | 113.3 | I164 L165 | I164-L168 HydrophobicContact CG2-CD1 3.68Å; I164-L168 HydrophobicContact CG2-CG 4.22Å; I164-L168 WeakPolarHBondContact O-CB 3.38Å; I164-L168 VanDerWaalsContact O-CG 3.3Å; I164-L168 WeakPolarHBondContact O-CG 3.43Å; I164-L168 PolarHBondContact O-N 3.42Å; L165-L168 PolarHBondContact O-N 3.38Å |
| 169 | T | 85.1 | Confident | 89.3 | Confident | 33 Ų | 33 | 74.3 Ų | 74.3 | 20% | 0.202 | 41% | 0.406 | C | S | . | . | trans | -134.8 | 87 | -173.6 | -51 | 0 | 0 | 0 | 0 | 111.2 | L165 N171 F174 I175 | L165-T169 PolarHBondContact O-N 2.83Å; T169-N171 HydrophobicContact CG2-CB 4.47Å; T169-N171 PolarHBondContact O-N 2.75Å; T169-F174 HydrophobicContact CG2-CD1 3.42Å; T169-F174 VanDerWaalsContact CG2-CD1 3.42Å; T169-F174 HydrophobicContact CG2-CE1 3.93Å; T169-F174 HydrophobicContact CG2-CG 4.28Å; T169-I175 HydrophobicContact CG2-CD1 4.41Å; T169-I175 HydrophobicContact CG2-CG1 4.1Å | ||
| 170 | P | 80.5 | Confident | 89.2 | Confident | 117 Ų | 117 | 70.7 Ų | 70.7 | 76% | 0.76 | 39% | 0.387 | S | S | * | . | trans | -79 | 29.7 | 179.4 | 34.7 | -36.7 | 0 | 0 | 0 | 113 | ||||
| 171 | N | 84.9 | Confident | 89.1 | Confident | 53 Ų | 53 | 65.4 Ų | 65.4 | 28% | 0.283 | 36% | 0.359 | S | S | . | . | trans | -119.6 | 105.3 | 179.2 | -172 | -26.4 | 0 | 0 | 0 | 110.3 | T169 E173 F174 I175 E246 | T169-N171 HydrophobicContact CG2-CB 4.47Å; T169-N171 PolarHBondContact O-N 2.75Å; N171-E173 VanDerWaalsContact C-N 3.32Å; N171-E173 PolarHBondContact O-N 3.33Å; N171-E173 WeakPolarHBondContact OD1-CB 3.17Å; N171-E173 PolarHBondContact OD1-N 3Å; N171-F174 HydrophobicContact CB-CB 3.95Å; N171-F174 PolarHBondContact O-N 3.28Å; N171-F174 PolarHBondContact OD1-N 3.25Å; N171-F174 VanDerWaalsContact OD1-N 3.09Å; N171-I175 PolarHBondContact O-N 3.39Å; N171-E246 PolarHBondContact ND2-OE1 3.23Å | ||
| 172 | V | 86 | Confident | 89.1 | Confident | 73 Ų | 73 | 64.2 Ų | 64.2 | 44% | 0.442 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -66.4 | -33.7 | -179.6 | -63 | 0 | 0 | 0 | 0 | 112.5 | D92 I175 L176 | D92-V172 HydrophobicContact CB-CG2 3.98Å; V172-I175 PolarHBondContact O-N 3.42Å; V172-L176 VanDerWaalsContact O-CB 3.31Å; V172-L176 WeakPolarHBondContact O-CB 3.46Å; V172-L176 WeakPolarHBondContact O-CG 3.28Å; V172-L176 PolarHBondContact O-N 2.88Å |
| 173 | E | 87.3 | Confident | 89 | Confident | 76 Ų | 76 | 65 Ų | 65 | 36% | 0.355 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -66.1 | -44 | 178.3 | -180 | -177.8 | 160.6 | 0 | 0 | 110.6 | I32 G91 N171 L176 G177 | I32-E173 HydrophobicContact CD1-CG 4Å; G91-E173 WeakPolarHBondContact CA-OE2 3.04Å; N171-E173 VanDerWaalsContact C-N 3.32Å; N171-E173 PolarHBondContact O-N 3.33Å; N171-E173 WeakPolarHBondContact OD1-CB 3.17Å; N171-E173 PolarHBondContact OD1-N 3Å; E173-L176 PolarHBondContact O-N 3.2Å; E173-G177 PolarHBondContact O-N 3.45Å |
| 174 | F | 87.9 | Confident | 88.8 | Confident | 29 Ų | 29 | 61.3 Ų | 61.3 | 13% | 0.127 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -60.3 | -48 | 176 | 175.2 | -96.4 | 0 | 0 | 0 | 111.8 | T169 N171 G177 L178 I242 L243 E246 | T169-F174 HydrophobicContact CG2-CD1 3.42Å; T169-F174 VanDerWaalsContact CG2-CD1 3.42Å; T169-F174 HydrophobicContact CG2-CE1 3.93Å; T169-F174 HydrophobicContact CG2-CG 4.28Å; N171-F174 HydrophobicContact CB-CB 3.95Å; N171-F174 PolarHBondContact O-N 3.28Å; N171-F174 PolarHBondContact OD1-N 3.25Å; N171-F174 VanDerWaalsContact OD1-N 3.09Å; F174-G177 PolarHBondContact O-N 2.93Å; F174-L178 HydrophobicContact CE1-CD2 4.12Å; F174-L178 HydrophobicContact CZ-CD2 4.16Å; F174-L178 VanDerWaalsContact O-CB 3.3Å; F174-L178 WeakPolarHBondContact O-CB 3.35Å; F174-L178 PolarHBondContact O-N 3.45Å; F174-I242 HydrophobicContact CD2-CG2 3.35Å; F174-I242 HydrophobicContact CE2-CG2 3.51Å; F174-I242 HydrophobicContact CG-CG2 4.36Å; F174-L243 HydrophobicContact CE2-CD2 4.28Å; F174-L243 HydrophobicContact CZ-CD2 4.35Å; F174-E246 HydrophobicContact CB-CG 4.48Å; F174-E246 HydrophobicContact CD2-CG 3.22Å; F174-E246 HydrophobicContact CE2-CG 3.53Å; F174-E246 HydrophobicContact CG-CG 3.99Å; F174-E246 HydrophobicContact CZ-CG 4.48Å |
| 175 | I | 90 | Very high | 88.7 | Confident | 65 Ų | 65 | 57.6 Ų | 57.6 | 33% | 0.333 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -64 | -44.4 | -179.9 | -66.8 | -177.1 | 0 | 0 | 0 | 110.9 | T169 N171 V172 T179 | T169-I175 HydrophobicContact CG2-CD1 4.41Å; T169-I175 HydrophobicContact CG2-CG1 4.1Å; N171-I175 PolarHBondContact O-N 3.39Å; V172-I175 PolarHBondContact O-N 3.42Å; I175-T179 WeakPolarHBondContact O-CB 3.2Å; I175-T179 PolarHBondContact O-N 2.96Å; I175-T179 PolarHBondContact O-OG1 3.07Å |
| 176 | L | 90.1 | Very high | 88.8 | Confident | 78 Ų | 78 | 58 Ų | 58 | 41% | 0.408 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -65.1 | -41.5 | 178 | -72.1 | 172.2 | 0 | 0 | 0 | 111.6 | I32 M35 V172 E173 G180 | I32-L176 HydrophobicContact CG1-CB 4.37Å; I32-L176 HydrophobicContact CG2-CB 4.48Å; M35-L176 HydrophobicContact CE-CD2 4.36Å; M35-L176 HydrophobicContact SD-CD2 4.38Å; V172-L176 VanDerWaalsContact O-CB 3.31Å; V172-L176 WeakPolarHBondContact O-CB 3.46Å; V172-L176 WeakPolarHBondContact O-CG 3.28Å; V172-L176 PolarHBondContact O-N 2.88Å; E173-L176 PolarHBondContact O-N 3.2Å; L176-G180 PolarHBondContact O-N 2.69Å |
| 177 | G | 91.1 | Very high | 88.8 | Confident | 1 Ų | 1 | 56.9 Ų | 56.9 | 1% | 0.01 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -62.2 | -50.5 | 176 | 0 | 0 | 0 | 0 | 0 | 111.6 | E173 F174 G180 A181 I242 | E173-G177 PolarHBondContact O-N 3.45Å; F174-G177 PolarHBondContact O-N 2.93Å; G177-G180 PolarHBondContact O-N 3.42Å; G177-A181 WeakPolarHBondContact O-CB 3.46Å; G177-A181 PolarHBondContact O-N 3.47Å; G177-I242 VanDerWaalsContact O-CD1 3.25Å; G177-I242 WeakPolarHBondContact O-CD1 3.49Å |
| 178 | L | 90.9 | Very high | 88.6 | Confident | 51 Ų | 51 | 52.2 Ų | 52.2 | 27% | 0.267 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -64.3 | -45.3 | -178.6 | -172.6 | 68.9 | 0 | 0 | 0 | 111 | F174 G180 A181 F182 T239 | F174-L178 HydrophobicContact CE1-CD2 4.12Å; F174-L178 HydrophobicContact CZ-CD2 4.16Å; F174-L178 VanDerWaalsContact O-CB 3.3Å; F174-L178 WeakPolarHBondContact O-CB 3.35Å; F174-L178 PolarHBondContact O-N 3.45Å; L178-G180 VanDerWaalsContact C-N 3.31Å; L178-G180 PolarHBondContact O-N 2.87Å; L178-A181 PolarHBondContact O-N 3.18Å; L178-F182 HydrophobicContact CD1-CD2 3.86Å; L178-F182 HydrophobicContact CD1-CE2 3.69Å; L178-F182 HydrophobicContact CG-CD2 4.19Å; L178-F182 HydrophobicContact CG-CE2 4.41Å; L178-F182 WeakPolarHBondContact O-CD2 3.41Å; L178-F182 PolarHBondContact O-N 3.36Å; L178-T239 HydrophobicContact CD1-CG2 4.25Å |
| 179 | T | 90.9 | Very high | 88.5 | Confident | 41 Ų | 41 | 47.5 Ų | 47.5 | 25% | 0.252 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -62.7 | -40.9 | 178.1 | -55.7 | 0 | 0 | 0 | 0 | 111 | M35 I175 I183 G184 | M35-T179 HydrophobicContact CE-CG2 3.47Å; M35-T179 VanDerWaalsContact CE-CG2 3.47Å; M35-T179 HydrophobicContact SD-CG2 3.77Å; I175-T179 WeakPolarHBondContact O-CB 3.2Å; I175-T179 PolarHBondContact O-N 2.96Å; I175-T179 PolarHBondContact O-OG1 3.07Å; T179-I183 HydrophobicContact CG2-CB 4.41Å; T179-I183 HydrophobicContact CG2-CD1 3.59Å; T179-I183 HydrophobicContact CG2-CG1 4.21Å; T179-I183 WeakPolarHBondContact O-CA 3.22Å; T179-I183 VanDerWaalsContact O-CB 3.31Å; T179-I183 WeakPolarHBondContact O-CB 3.25Å; T179-I183 PolarHBondContact O-N 3.15Å; T179-G184 PolarHBondContact O-N 3.35Å |
| 180 | G | 90.9 | Very high | 88.8 | Confident | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 26% | 0.258 | C | S | . | . | I | π-helix | trans | -67.2 | -40.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | P31 L176 G177 L178 F182 G184 S185 | P31-G180 WeakPolarHBondContact O-CA 3.48Å; L176-G180 PolarHBondContact O-N 2.69Å; G177-G180 PolarHBondContact O-N 3.42Å; L178-G180 VanDerWaalsContact C-N 3.31Å; L178-G180 PolarHBondContact O-N 2.87Å; G180-F182 PolarHBondContact O-N 3.17Å; G180-G184 WeakPolarHBondContact O-CA 3.33Å; G180-G184 PolarHBondContact O-N 2.81Å; G180-S185 PolarHBondContact O-N 3.14Å |
| 181 | A | 91.8 | Very high | 89.3 | Confident | 0 Ų | 0 | 46.1 Ų | 46.1 | 0% | 0 | 25% | 0.247 | C | C | . | . | I | π-helix | trans | -62.6 | -44.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | P31 G177 L178 S185 L235 I242 | P31-A181 HydrophobicContact CB-CB 3.92Å; P31-A181 VanDerWaalsContact CB-N 3.34Å; G177-A181 WeakPolarHBondContact O-CB 3.46Å; G177-A181 PolarHBondContact O-N 3.47Å; L178-A181 PolarHBondContact O-N 3.18Å; A181-S185 WeakPolarHBondContact O-CB 3.34Å; A181-S185 PolarHBondContact O-OG 3.48Å; A181-L235 WeakPolarHBondContact O-CD1 3.41Å; A181-I242 HydrophobicContact CB-CD1 4.14Å |
| 182 | F | 91.9 | Very high | 89.5 | Confident | 95 Ų | 95 | 46.4 Ų | 46.4 | 42% | 0.417 | 25% | 0.252 | S | S | . | . | I | π-helix | trans | -77.5 | -71.1 | 177.8 | -84.7 | -90.3 | 0 | 0 | 0 | 112.9 | L178 G180 L186 L235 T239 | L178-F182 HydrophobicContact CD1-CD2 3.86Å; L178-F182 HydrophobicContact CD1-CE2 3.69Å; L178-F182 HydrophobicContact CG-CD2 4.19Å; L178-F182 HydrophobicContact CG-CE2 4.41Å; L178-F182 WeakPolarHBondContact O-CD2 3.41Å; L178-F182 PolarHBondContact O-N 3.36Å; G180-F182 PolarHBondContact O-N 3.17Å; F182-L186 WeakPolarHBondContact O-CB 3.4Å; F182-L186 WeakPolarHBondContact O-CD1 3.44Å; F182-L186 WeakPolarHBondContact O-CG 3.34Å; F182-L186 PolarHBondContact O-N 3.22Å; F182-L235 HydrophobicContact CD1-CD1 4.04Å; F182-L235 HydrophobicContact CE1-CD1 4.38Å; F182-L235 HydrophobicContact CG-CD1 4.14Å; F182-T239 HydrophobicContact CE2-CG2 3.78Å; F182-T239 HydrophobicContact CZ-CG2 4.3Å |
| 183 | I | 89.6 | Confident | 89.6 | Confident | 101 Ų | 101 | 43.3 Ų | 43.3 | 52% | 0.518 | 23% | 0.233 | S | C | . | . | I | π-helix | trans | -70.4 | -42.2 | -169.9 | -58.7 | 178.5 | 0 | 0 | 0 | 110.2 | T179 L186 V187 | T179-I183 HydrophobicContact CG2-CB 4.41Å; T179-I183 HydrophobicContact CG2-CD1 3.59Å; T179-I183 HydrophobicContact CG2-CG1 4.21Å; T179-I183 WeakPolarHBondContact O-CA 3.22Å; T179-I183 VanDerWaalsContact O-CB 3.31Å; T179-I183 WeakPolarHBondContact O-CB 3.25Å; T179-I183 PolarHBondContact O-N 3.15Å; I183-L186 PolarHBondContact O-N 3.4Å; I183-V187 HydrophobicContact CG2-CG2 4.08Å; I183-V187 WeakPolarHBondContact O-CB 3.4Å; I183-V187 WeakPolarHBondContact O-CG2 3.35Å; I183-V187 PolarHBondContact O-N 3.42Å |
| 184 | G | 87.6 | Confident | 89.6 | Confident | 3 Ų | 3 | 42.9 Ų | 42.9 | 3% | 0.031 | 24% | 0.236 | C | C | . | . | I | π-helix | trans | -59.8 | -53 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | T179 G180 L186 A188 | T179-G184 PolarHBondContact O-N 3.35Å; G180-G184 WeakPolarHBondContact O-CA 3.33Å; G180-G184 PolarHBondContact O-N 2.81Å; G184-L186 PolarHBondContact O-N 3.13Å; G184-A188 WeakPolarHBondContact O-CA 3.39Å; G184-A188 WeakPolarHBondContact O-CB 3.44Å; G184-A188 PolarHBondContact O-N 3.14Å |
| 185 | S | 89.9 | Confident | 89.7 | Confident | 4 Ų | 4 | 45.6 Ų | 45.6 | 3% | 0.028 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -62.7 | -43 | 178.2 | -50.4 | 0 | 0 | 0 | 0 | 112.3 | G180 A181 T189 I190 I234 | G180-S185 PolarHBondContact O-N 3.14Å; A181-S185 WeakPolarHBondContact O-CB 3.34Å; A181-S185 PolarHBondContact O-OG 3.48Å; S185-T189 PolarHBondContact O-N 3.49Å; S185-T189 PolarHBondContact O-OG1 3.5Å; S185-I190 PolarHBondContact O-N 2.9Å; S185-I234 WeakPolarHBondContact OG-CG2 3.43Å |
| 186 | L | 90.8 | Very high | 89.4 | Confident | 78 Ų | 78 | 47 Ų | 47 | 41% | 0.408 | 25% | 0.253 | S | S | . | . | I | π-helix | trans | -62.6 | -51.2 | -179.5 | -76.7 | 169.6 | 0 | 0 | 0 | 112.2 | F182 I183 G184 I190 L191 | F182-L186 WeakPolarHBondContact O-CB 3.4Å; F182-L186 WeakPolarHBondContact O-CD1 3.44Å; F182-L186 WeakPolarHBondContact O-CG 3.34Å; F182-L186 PolarHBondContact O-N 3.22Å; I183-L186 PolarHBondContact O-N 3.4Å; G184-L186 PolarHBondContact O-N 3.13Å; L186-I190 HydrophobicContact CD2-CB 4.47Å; L186-I190 HydrophobicContact CD2-CD1 3.92Å; L186-I190 HydrophobicContact CD2-CG2 4.42Å; L186-I190 HydrophobicContact CG-CD1 4.5Å; L186-I190 PolarHBondContact O-N 2.94Å; L186-L191 WeakPolarHBondContact O-CB 3.3Å; L186-L191 PolarHBondContact O-N 3.24Å |
| 187 | V | 89.7 | Confident | 89.2 | Confident | 41 Ų | 41 | 45.3 Ų | 45.3 | 25% | 0.248 | 24% | 0.244 | C | C | . | . | I | π-helix | trans | -80.2 | -39.6 | -173.8 | 176.4 | 0 | 0 | 0 | 0 | 111.7 | Q40 T41 I183 P192 | Q40-V187 HydrophobicContact CB-CG1 3.97Å; T41-V187 HydrophobicContact CG2-CG1 4.1Å; I183-V187 HydrophobicContact CG2-CG2 4.08Å; I183-V187 WeakPolarHBondContact O-CB 3.4Å; I183-V187 WeakPolarHBondContact O-CG2 3.35Å; I183-V187 PolarHBondContact O-N 3.42Å; V187-P192 WeakPolarHBondContact O-CD 3.39Å |
| 188 | A | 85.7 | Confident | 89 | Confident | 32 Ų | 32 | 47.7 Ų | 47.7 | 26% | 0.264 | 26% | 0.263 | S | S | . | . | I | π-helix | trans | -77.7 | -34.3 | -174.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | G184 P192 | G184-A188 WeakPolarHBondContact O-CA 3.39Å; G184-A188 WeakPolarHBondContact O-CB 3.44Å; G184-A188 PolarHBondContact O-N 3.14Å; A188-P192 WeakPolarHBondContact O-CG 3.4Å |
| 189 | T | 86.1 | Confident | 88.6 | Confident | 26 Ų | 26 | 50.5 Ų | 50.5 | 16% | 0.16 | 28% | 0.278 | C | S | . | . | I | π-helix | trans | -125.8 | -51.1 | -170 | 62.6 | 0 | 0 | 0 | 0 | 113.1 | S185 S193 G231 | S185-T189 PolarHBondContact O-N 3.49Å; S185-T189 PolarHBondContact O-OG1 3.5Å; T189-S193 WeakPolarHBondContact O-CB 3.36Å; T189-S193 PolarHBondContact O-N 3.35Å; T189-S193 PolarHBondContact O-OG 3.09Å; T189-G231 WeakPolarHBondContact OG1-CA 3.09Å |
| 190 | I | 91.5 | Very high | 88 | Confident | 22 Ų | 22 | 49.9 Ų | 49.9 | 11% | 0.113 | 27% | 0.273 | C | S | . | . | I | π-helix | trans | -69.2 | -56 | -171.4 | -62.6 | 169.5 | 0 | 0 | 0 | 110.6 | S185 L186 S193 T194 L232 L235 | S185-I190 PolarHBondContact O-N 2.9Å; L186-I190 HydrophobicContact CD2-CB 4.47Å; L186-I190 HydrophobicContact CD2-CD1 3.92Å; L186-I190 HydrophobicContact CD2-CG2 4.42Å; L186-I190 HydrophobicContact CG-CD1 4.5Å; L186-I190 PolarHBondContact O-N 2.94Å; I190-S193 PolarHBondContact O-N 3.4Å; I190-T194 WeakPolarHBondContact O-CB 3.27Å; I190-T194 PolarHBondContact O-N 3.47Å; I190-T194 PolarHBondContact O-OG1 2.88Å; I190-L232 HydrophobicContact CD1-CD2 4.2Å; I190-L235 HydrophobicContact CD1-CD2 4.11Å |
| 191 | L | 90.4 | Very high | 87.1 | Confident | 100 Ų | 100 | 52.4 Ų | 52.4 | 52% | 0.524 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -59 | -52.6 | -176.4 | -170.4 | 125.2 | 0 | 0 | 0 | 113.2 | L186 S193 T194 I195 | L186-L191 WeakPolarHBondContact O-CB 3.3Å; L186-L191 PolarHBondContact O-N 3.24Å; L191-S193 VanDerWaalsContact C-N 3.34Å; L191-S193 PolarHBondContact O-N 2.66Å; L191-T194 PolarHBondContact O-N 3.49Å; L191-I195 HydrophobicContact CD2-CD1 3.57Å; L191-I195 HydrophobicContact CG-CD1 3.88Å; L191-I195 VanDerWaalsContact O-CG1 3.28Å; L191-I195 WeakPolarHBondContact O-CG1 3.47Å; L191-I195 PolarHBondContact O-N 3.47Å |
| 192 | P | 88.6 | Confident | 86.3 | Confident | 58 Ų | 58 | 54.6 Ų | 54.6 | 38% | 0.377 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -61.9 | -40 | 177.7 | 22 | -32.2 | 0 | 0 | 0 | 112.4 | V187 A188 T194 I195 Y196 | V187-P192 WeakPolarHBondContact O-CD 3.39Å; A188-P192 WeakPolarHBondContact O-CG 3.4Å; P192-T194 PolarHBondContact O-N 2.86Å; P192-I195 PolarHBondContact O-N 3.4Å; P192-Y196 WeakPolarHBondContact O-CB 3.39Å; P192-Y196 PolarHBondContact O-N 3.32Å |
| 193 | S | 88.3 | Confident | 85.2 | Confident | 8 Ų | 8 | 52.5 Ų | 52.5 | 6% | 0.056 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -63.6 | -42.5 | 177.1 | -60.4 | 0 | 0 | 0 | 0 | 112.1 | T189 I190 L191 Y196 I197 A224 C227 | T189-S193 WeakPolarHBondContact O-CB 3.36Å; T189-S193 PolarHBondContact O-N 3.35Å; T189-S193 PolarHBondContact O-OG 3.09Å; I190-S193 PolarHBondContact O-N 3.4Å; L191-S193 VanDerWaalsContact C-N 3.34Å; L191-S193 PolarHBondContact O-N 2.66Å; S193-Y196 PolarHBondContact O-N 3.06Å; S193-I197 WeakPolarHBondContact O-CB 3.23Å; S193-I197 WeakPolarHBondContact O-CD1 3.46Å; S193-I197 VanDerWaalsContact O-CG1 3.25Å; S193-I197 WeakPolarHBondContact O-CG1 3.48Å; S193-I197 PolarHBondContact O-N 3.4Å; S193-A224 WeakPolarHBondContact CB-O 3.37Å; S193-A224 PolarHBondContact OG-O 3.01Å; S193-C227 WeakPolarHBondContact OG-CB 3.3Å |
| 194 | T | 88.6 | Confident | 84.2 | Confident | 68 Ų | 68 | 52 Ų | 52 | 42% | 0.417 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -67.5 | -42.9 | -179.5 | -41.3 | 0 | 0 | 0 | 0 | 110.9 | I190 L191 P192 I197 A198 | I190-T194 WeakPolarHBondContact O-CB 3.27Å; I190-T194 PolarHBondContact O-N 3.47Å; I190-T194 PolarHBondContact O-OG1 2.88Å; L191-T194 PolarHBondContact O-N 3.49Å; P192-T194 PolarHBondContact O-N 2.86Å; T194-I197 PolarHBondContact O-N 3.23Å; T194-A198 VanDerWaalsContact O-CB 3.27Å; T194-A198 WeakPolarHBondContact O-CB 3.21Å; T194-A198 PolarHBondContact O-N 2.88Å |
| 195 | I | 88.5 | Confident | 83.1 | Confident | 85 Ų | 85 | 58.9 Ų | 58.9 | 44% | 0.436 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -62.2 | -44.1 | 176 | -67.8 | 167.8 | 0 | 0 | 0 | 110.5 | L191 P192 A198 N199 | L191-I195 HydrophobicContact CD2-CD1 3.57Å; L191-I195 HydrophobicContact CG-CD1 3.88Å; L191-I195 VanDerWaalsContact O-CG1 3.28Å; L191-I195 WeakPolarHBondContact O-CG1 3.47Å; L191-I195 PolarHBondContact O-N 3.47Å; P192-I195 PolarHBondContact O-N 3.4Å; I195-A198 PolarHBondContact O-N 2.97Å; I195-N199 WeakPolarHBondContact O-CB 3.14Å; I195-N199 PolarHBondContact O-N 3.21Å; I195-N199 PolarHBondContact O-ND2 2.95Å |
| 196 | Y | 85.6 | Confident | 82 | Confident | 95 Ų | 95 | 65.1 Ų | 65.1 | 37% | 0.373 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -62.1 | -48.1 | 178.7 | -174.1 | -91.2 | 0 | 0 | 0 | 112 | P192 S193 A198 N199 Q200 T220 A224 | P192-Y196 WeakPolarHBondContact O-CB 3.39Å; P192-Y196 PolarHBondContact O-N 3.32Å; S193-Y196 PolarHBondContact O-N 3.06Å; Y196-A198 PolarHBondContact O-N 2.91Å; Y196-N199 PolarHBondContact O-N 3.24Å; Y196-Q200 WeakPolarHBondContact O-CB 3.47Å; Y196-Q200 PolarHBondContact O-N 3.48Å; Y196-T220 HydrophobicContact CE1-CG2 4.17Å; Y196-T220 HydrophobicContact CE2-CG2 4.49Å; Y196-T220 WeakPolarHBondContact OH-CB 3.14Å; Y196-T220 WeakPolarHBondContact OH-CG2 3.14Å; Y196-A224 HydrophobicContact CD1-CB 3.63Å; Y196-A224 HydrophobicContact CE1-CB 4.23Å; Y196-A224 HydrophobicContact CG-CB 4.44Å |
| 197 | I | 85.3 | Confident | 80.7 | Confident | 43 Ų | 43 | 65.2 Ų | 65.2 | 22% | 0.221 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -62.9 | -42.3 | 177.7 | -67.5 | 164.8 | 0 | 0 | 0 | 110.9 | S193 T194 Q200 S201 A224 K225 L228 | S193-I197 WeakPolarHBondContact O-CB 3.23Å; S193-I197 WeakPolarHBondContact O-CD1 3.46Å; S193-I197 VanDerWaalsContact O-CG1 3.25Å; S193-I197 WeakPolarHBondContact O-CG1 3.48Å; S193-I197 PolarHBondContact O-N 3.4Å; T194-I197 PolarHBondContact O-N 3.23Å; I197-Q200 PolarHBondContact O-N 3.29Å; I197-S201 WeakPolarHBondContact O-CB 3.36Å; I197-S201 PolarHBondContact O-N 2.99Å; I197-S201 PolarHBondContact O-OG 3.25Å; I197-A224 HydrophobicContact CD1-CB 4.37Å; I197-A224 HydrophobicContact CG1-CB 4.05Å; I197-K225 HydrophobicContact CD1-CG 3.84Å; I197-K225 HydrophobicContact CG1-CG 4.46Å; I197-L228 HydrophobicContact CD1-CD1 4.09Å |
| 198 | A | 86.3 | Confident | 79.1 | Confident | 51 Ų | 51 | 72.7 Ų | 72.7 | 42% | 0.421 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -61.5 | -47.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | T194 I195 Y196 Q200 S201 A202 | T194-A198 VanDerWaalsContact O-CB 3.27Å; T194-A198 WeakPolarHBondContact O-CB 3.21Å; T194-A198 PolarHBondContact O-N 2.88Å; I195-A198 PolarHBondContact O-N 2.97Å; Y196-A198 PolarHBondContact O-N 2.91Å; A198-Q200 PolarHBondContact O-N 2.86Å; A198-S201 PolarHBondContact O-N 2.62Å; A198-S201 PolarHBondContact O-OG 3.43Å; A198-A202 PolarHBondContact O-N 3.4Å |
| 199 | N | 83.1 | Confident | 77.7 | Confident | 109 Ų | 109 | 75.8 Ų | 75.8 | 58% | 0.583 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -63.4 | -41.9 | 177.7 | -78.1 | -21.4 | 0 | 0 | 0 | 112.4 | I195 Y196 A202 S203 | I195-N199 WeakPolarHBondContact O-CB 3.14Å; I195-N199 PolarHBondContact O-N 3.21Å; I195-N199 PolarHBondContact O-ND2 2.95Å; Y196-N199 PolarHBondContact O-N 3.24Å; N199-A202 PolarHBondContact O-N 3.47Å; N199-S203 WeakPolarHBondContact O-CB 3.35Å; N199-S203 PolarHBondContact O-N 3.33Å |
| 200 | Q | 77.4 | Confident | 76.3 | Confident | 28 Ų | 28 | 79.9 Ų | 79.9 | 13% | 0.131 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -63.9 | -44.5 | 175.8 | -171.4 | 173.2 | 40 | 0 | 0 | 111.1 | Y196 I197 A198 A202 S203 D204 A217 S221 | Y196-Q200 WeakPolarHBondContact O-CB 3.47Å; Y196-Q200 PolarHBondContact O-N 3.48Å; I197-Q200 PolarHBondContact O-N 3.29Å; A198-Q200 PolarHBondContact O-N 2.86Å; Q200-A202 VanDerWaalsContact C-N 3.27Å; Q200-A202 PolarHBondContact O-N 2.82Å; Q200-S203 CarbonylContact O-C 3.6Å; Q200-S203 PolarHBondContact O-N 3.48Å; Q200-S203 VanDerWaalsContact O-N 3.14Å; Q200-D204 WeakPolarHBondContact O-CB 3.44Å; Q200-D204 VanDerWaalsContact O-CG 3.26Å; Q200-D204 PolarHBondContact O-N 2.94Å; Q200-A217 PolarHBondContact NE2-O 2.94Å; Q200-A217 VanDerWaalsContact NE2-O 3.08Å; Q200-S221 PolarHBondContact OE1-OG 3.35Å |
| 201 | S | 73.6 | Confident | 74.5 | Confident | 53 Ų | 53 | 89.8 Ų | 89.8 | 37% | 0.371 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -63.9 | -31.3 | 178.4 | 77.7 | 0 | 0 | 0 | 0 | 113.3 | I197 A198 K205 | I197-S201 WeakPolarHBondContact O-CB 3.36Å; I197-S201 PolarHBondContact O-N 2.99Å; I197-S201 PolarHBondContact O-OG 3.25Å; A198-S201 PolarHBondContact O-N 2.62Å; A198-S201 PolarHBondContact O-OG 3.43Å; S201-K205 WeakPolarHBondContact O-CG 2.99Å; S201-K205 PolarHBondContact O-N 2.98Å |
| 202 | A | 74.8 | Confident | 72.5 | Confident | 46 Ų | 46 | 94.6 Ų | 94.6 | 38% | 0.38 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -72.2 | -44.1 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | A198 N199 Q200 K205 I206 | A198-A202 PolarHBondContact O-N 3.4Å; N199-A202 PolarHBondContact O-N 3.47Å; Q200-A202 VanDerWaalsContact C-N 3.27Å; Q200-A202 PolarHBondContact O-N 2.82Å; A202-K205 PolarHBondContact O-N 3.48Å; A202-I206 WeakPolarHBondContact O-CG1 3.48Å; A202-I206 PolarHBondContact O-N 3.39Å |
| 203 | S | 68.9 | Low | 70.9 | Confident | 52 Ų | 52 | 97.8 Ų | 97.8 | 36% | 0.364 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.2 | -40.4 | 176.3 | -159.5 | 0 | 0 | 0 | 0 | 112.2 | N199 Q200 K205 I206 N207 | N199-S203 WeakPolarHBondContact O-CB 3.35Å; N199-S203 PolarHBondContact O-N 3.33Å; Q200-S203 CarbonylContact O-C 3.6Å; Q200-S203 PolarHBondContact O-N 3.48Å; Q200-S203 VanDerWaalsContact O-N 3.14Å; S203-K205 VanDerWaalsContact C-N 3.3Å; S203-K205 PolarHBondContact O-N 3.23Å; S203-I206 PolarHBondContact O-N 3.47Å; S203-I206 VanDerWaalsContact O-N 3.11Å; S203-N207 VanDerWaalsContact O-CB 3.28Å; S203-N207 WeakPolarHBondContact O-CB 3.31Å; S203-N207 PolarHBondContact O-N 2.9Å; S203-N207 PolarHBondContact O-ND2 3.05Å; S203-N207 PolarHBondContact OG-ND2 3.43Å |
| 204 | D | 67.3 | Low | 69.2 | Low | 90 Ų | 90 | 102.3 Ų | 102.3 | 48% | 0.481 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -67 | -27.2 | 177.4 | -73.7 | -19.8 | 0 | 0 | 0 | 113 | Q200 R208 | Q200-D204 WeakPolarHBondContact O-CB 3.44Å; Q200-D204 VanDerWaalsContact O-CG 3.26Å; Q200-D204 PolarHBondContact O-N 2.94Å; D204-R208 WeakPolarHBondContact O-CG 3.2Å |
| 205 | K | 65.4 | Low | 67.5 | Low | 148 Ų | 148 | 107.9 Ų | 107.9 | 64% | 0.643 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -71.2 | -36.3 | 171.5 | -74.1 | 171.9 | -173.9 | 178.5 | 0 | 111.5 | S201 A202 S203 | S201-K205 WeakPolarHBondContact O-CG 2.99Å; S201-K205 PolarHBondContact O-N 2.98Å; A202-K205 PolarHBondContact O-N 3.48Å; S203-K205 VanDerWaalsContact C-N 3.3Å; S203-K205 PolarHBondContact O-N 3.23Å |
| 206 | I | 66.3 | Low | 65.8 | Low | 135 Ų | 135 | 107 Ų | 107 | 69% | 0.692 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -78.1 | -40 | 179.9 | -63.8 | 167.3 | 0 | 0 | 0 | 111 | A202 S203 R208 | A202-I206 WeakPolarHBondContact O-CG1 3.48Å; A202-I206 PolarHBondContact O-N 3.39Å; S203-I206 PolarHBondContact O-N 3.47Å; S203-I206 VanDerWaalsContact O-N 3.11Å; I206-R208 PolarHBondContact O-N 3.46Å |
| 207 | N | 63.8 | Low | 64.3 | Low | 80 Ų | 80 | 104 Ų | 104 | 43% | 0.428 | 56% | 0.555 | S | S | . | * | G | 310 helix | trans | -89.7 | 10.4 | -170.5 | -71.8 | -32.1 | 0 | 0 | 0 | 115.5 | S203 A209 T210 | S203-N207 VanDerWaalsContact O-CB 3.28Å; S203-N207 WeakPolarHBondContact O-CB 3.31Å; S203-N207 PolarHBondContact O-N 2.9Å; S203-N207 PolarHBondContact O-ND2 3.05Å; S203-N207 PolarHBondContact OG-ND2 3.43Å; N207-A209 PolarHBondContact O-N 3.45Å; N207-T210 PolarHBondContact O-N 3.22Å |
| 208 | R | 55.8 | Low | 62.7 | Low | 198 Ų | 198 | 105 Ų | 105 | 75% | 0.747 | 57% | 0.571 | S | S | * | * | G | 310 helix | trans | -59.1 | -17.2 | 175.2 | -60.5 | -166.2 | -173.1 | -170.8 | 1.7 | 113.7 | D204 I206 | D204-R208 WeakPolarHBondContact O-CG 3.2Å; I206-R208 PolarHBondContact O-N 3.46Å |
| 209 | A | 56.8 | Low | 61.3 | Low | 96 Ų | 96 | 105.4 Ų | 105.4 | 79% | 0.793 | 57% | 0.574 | S | S | * | * | G | 310 helix | trans | -80.1 | -18 | 174.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | N207 | N207-A209 PolarHBondContact O-N 3.45Š|
| 210 | T | 56.2 | Low | 60.4 | Low | 112 Ų | 112 | 103.4 Ų | 103.4 | 69% | 0.687 | 57% | 0.566 | S | S | * | * | trans | -128.9 | 59.5 | -173.3 | -43.3 | 0 | 0 | 0 | 0 | 110.7 | N207 K212 | N207-T210 PolarHBondContact O-N 3.22Å; T210-K212 PolarHBondContact O-N 3.49Å | ||
| 211 | R | 52.9 | Low | 60 | Low | 231 Ų | 231 | 103 Ų | 103 | 87% | 0.872 | 57% | 0.566 | S | S | * | * | trans | -90.3 | 69.8 | -174.3 | -174.2 | -171.9 | 147.2 | -178.4 | -4.8 | 111.8 | ||||
| 212 | K | 49.4 | Very low | 60.2 | Low | 201 Ų | 201 | 103.7 Ų | 103.7 | 87% | 0.874 | 57% | 0.571 | S | S | * | * | trans | -154 | 40.2 | 166.1 | -79.1 | -157.4 | -178.7 | 176.6 | 0 | 113.9 | T210 | T210-K212 PolarHBondContact O-N 3.49Š| ||
| 213 | V | 53.9 | Low | 60.5 | Low | 124 Ų | 124 | 106 Ų | 106 | 75% | 0.752 | 58% | 0.581 | S | S | * | * | trans | -150.3 | 135.7 | 161.5 | -151.6 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 214 | N | 54.1 | Low | 61.1 | Low | 103 Ų | 103 | 104.1 Ų | 104.1 | 55% | 0.551 | 57% | 0.568 | S | S | * | * | trans | 118.8 | 69.4 | 155.5 | -57.2 | -18.7 | 0 | 0 | 0 | 117.5 | A216 A217 A218 | N214-A216 PolarHBondContact O-N 3.07Å; N214-A217 HydrophobicContact CB-CB 3.42Å; N214-A217 VanDerWaalsContact CB-CB 3.42Å; N214-A217 PolarHBondContact O-N 3.35Å; N214-A218 PolarHBondContact O-N 3.22Å | ||
| 215 | E | 53 | Low | 62 | Low | 185 Ų | 185 | 105.2 Ų | 105.2 | 86% | 0.864 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -57.8 | -30.2 | 150.1 | -72.1 | 171.8 | 160.9 | 0 | 0 | 111.4 | A217 A218 A219 | E215-A217 PolarHBondContact O-N 2.95Å; E215-A218 PolarHBondContact O-N 2.69Å; E215-A219 PolarHBondContact O-N 3.26Å |
| 216 | A | 52.1 | Low | 63.1 | Low | 68 Ų | 68 | 103.1 Ų | 103.1 | 56% | 0.562 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -66 | -31.4 | 174 | 0 | 0 | 0 | 0 | 0 | 114.2 | N214 T220 | N214-A216 PolarHBondContact O-N 3.07Å; A216-T220 PolarHBondContact O-N 3.2Å; A216-T220 PolarHBondContact O-OG1 2.92Å |
| 217 | A | 53.3 | Low | 64.1 | Low | 30 Ų | 30 | 98.8 Ų | 98.8 | 25% | 0.248 | 54% | 0.543 | C | S | . | . | H | α-helix | trans | -77.6 | -28.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q200 N214 E215 S221 | Q200-A217 PolarHBondContact NE2-O 2.94Å; Q200-A217 VanDerWaalsContact NE2-O 3.08Å; N214-A217 HydrophobicContact CB-CB 3.42Å; N214-A217 VanDerWaalsContact CB-CB 3.42Å; N214-A217 PolarHBondContact O-N 3.35Å; E215-A217 PolarHBondContact O-N 2.95Å; A217-S221 WeakPolarHBondContact O-CB 3.41Å; A217-S221 PolarHBondContact O-N 2.89Å |
| 218 | A | 52.9 | Low | 65.4 | Low | 66 Ų | 66 | 97 Ų | 97 | 55% | 0.545 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -70.8 | -41.4 | 174 | 0 | 0 | 0 | 0 | 0 | 111.7 | N214 E215 S221 S222 | N214-A218 PolarHBondContact O-N 3.22Å; E215-A218 PolarHBondContact O-N 2.69Å; A218-S221 WeakPolarHBondContact O-CB 3.46Å; A218-S221 PolarHBondContact O-N 3.41Å; A218-S222 PolarHBondContact O-N 3.17Å; A218-S222 VanDerWaalsContact O-N 3.15Å |
| 219 | A | 56 | Low | 67.1 | Low | 58 Ų | 58 | 92.5 Ų | 92.5 | 48% | 0.479 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -60.9 | -46.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | E215 S221 S222 T223 | E215-A219 PolarHBondContact O-N 3.26Å; A219-S221 VanDerWaalsContact C-N 3.32Å; A219-S221 PolarHBondContact O-N 3.46Å; A219-S222 PolarHBondContact O-N 3.2Å; A219-T223 PolarHBondContact O-N 3.46Å; A219-T223 VanDerWaalsContact O-N 3.14Å; A219-T223 PolarHBondContact O-OG1 3.04Å; A219-T223 VanDerWaalsContact O-OG1 3.13Å |
| 220 | T | 65.5 | Low | 68.7 | Low | 68 Ų | 68 | 92 Ų | 92 | 42% | 0.417 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -67.8 | -31.5 | 179.7 | -42 | 0 | 0 | 0 | 0 | 112.5 | Y196 A216 T223 A224 | Y196-T220 HydrophobicContact CE1-CG2 4.17Å; Y196-T220 HydrophobicContact CE2-CG2 4.49Å; Y196-T220 WeakPolarHBondContact OH-CB 3.14Å; Y196-T220 WeakPolarHBondContact OH-CG2 3.14Å; A216-T220 PolarHBondContact O-N 3.2Å; A216-T220 PolarHBondContact O-OG1 2.92Å; T220-T223 PolarHBondContact O-N 3.48Å; T220-A224 PolarHBondContact O-N 3.16Å; T220-A224 VanDerWaalsContact O-N 3.14Å |
| 221 | S | 68.1 | Low | 70.3 | Confident | 19 Ų | 19 | 86.7 Ų | 86.7 | 13% | 0.133 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -65.3 | -40.3 | 173.1 | -164.4 | 0 | 0 | 0 | 0 | 112.6 | Q200 A217 A218 A219 A224 K225 | Q200-S221 PolarHBondContact OE1-OG 3.35Å; A217-S221 WeakPolarHBondContact O-CB 3.41Å; A217-S221 PolarHBondContact O-N 2.89Å; A218-S221 WeakPolarHBondContact O-CB 3.46Å; A218-S221 PolarHBondContact O-N 3.41Å; A219-S221 VanDerWaalsContact C-N 3.32Å; A219-S221 PolarHBondContact O-N 3.46Å; S221-A224 PolarHBondContact O-N 3.38Å; S221-K225 WeakPolarHBondContact O-CG 3.11Å; S221-K225 PolarHBondContact O-N 2.99Å |
| 222 | S | 76.8 | Confident | 72.1 | Confident | 68 Ų | 68 | 79.2 Ų | 79.2 | 48% | 0.476 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -65.9 | -43.1 | 177.2 | -175.6 | 0 | 0 | 0 | 0 | 111 | A218 A219 A224 K225 M226 | A218-S222 PolarHBondContact O-N 3.17Å; A218-S222 VanDerWaalsContact O-N 3.15Å; A219-S222 PolarHBondContact O-N 3.2Å; S222-A224 PolarHBondContact O-N 2.73Å; S222-K225 PolarHBondContact O-N 2.92Å; S222-M226 WeakPolarHBondContact O-CG 3.12Å; S222-M226 PolarHBondContact O-N 2.97Å |
| 223 | T | 81.1 | Confident | 74.1 | Confident | 95 Ų | 95 | 75.8 Ų | 75.8 | 58% | 0.583 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -59.9 | -42.4 | 176.5 | -52.3 | 0 | 0 | 0 | 0 | 112.5 | A219 T220 K225 M226 C227 | A219-T223 PolarHBondContact O-N 3.46Å; A219-T223 VanDerWaalsContact O-N 3.14Å; A219-T223 PolarHBondContact O-OG1 3.04Å; A219-T223 VanDerWaalsContact O-OG1 3.13Å; T220-T223 PolarHBondContact O-N 3.48Å; T223-K225 PolarHBondContact O-N 3.11Å; T223-M226 PolarHBondContact O-N 3.45Å; T223-C227 WeakPolarHBondContact O-CB 3.44Å; T223-C227 PolarHBondContact O-N 3.44Å |
| 224 | A | 82.7 | Confident | 75.8 | Confident | 11 Ų | 11 | 71.1 Ų | 71.1 | 9% | 0.091 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -64.3 | -40.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | S193 Y196 I197 T220 S221 S222 C227 L228 | S193-A224 WeakPolarHBondContact CB-O 3.37Å; S193-A224 PolarHBondContact OG-O 3.01Å; Y196-A224 HydrophobicContact CD1-CB 3.63Å; Y196-A224 HydrophobicContact CE1-CB 4.23Å; Y196-A224 HydrophobicContact CG-CB 4.44Å; I197-A224 HydrophobicContact CD1-CB 4.37Å; I197-A224 HydrophobicContact CG1-CB 4.05Å; T220-A224 PolarHBondContact O-N 3.16Å; T220-A224 VanDerWaalsContact O-N 3.14Å; S221-A224 PolarHBondContact O-N 3.38Å; S222-A224 PolarHBondContact O-N 2.73Å; A224-C227 PolarHBondContact O-N 3.38Å; A224-L228 PolarHBondContact O-N 3.28Å |
| 225 | K | 85.4 | Confident | 77.6 | Confident | 114 Ų | 114 | 67.6 Ų | 67.6 | 50% | 0.496 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -66 | -41.4 | 175.5 | -69 | 173.6 | -173.1 | 176.4 | 0 | 112 | I197 S221 S222 T223 L228 I229 | I197-K225 HydrophobicContact CD1-CG 3.84Å; I197-K225 HydrophobicContact CG1-CG 4.46Å; S221-K225 WeakPolarHBondContact O-CG 3.11Å; S221-K225 PolarHBondContact O-N 2.99Å; S222-K225 PolarHBondContact O-N 2.92Å; T223-K225 PolarHBondContact O-N 3.11Å; K225-L228 PolarHBondContact O-N 3.29Å; K225-I229 WeakPolarHBondContact O-CG1 3.19Å; K225-I229 PolarHBondContact O-N 2.99Å |
| 226 | M | 88.9 | Confident | 79.5 | Confident | 104 Ų | 104 | 64 Ų | 64 | 51% | 0.512 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -62 | -44.2 | 174.9 | -71.3 | -62.9 | -68.6 | 0 | 0 | 111.3 | S222 T223 L228 I229 I230 | S222-M226 WeakPolarHBondContact O-CG 3.12Å; S222-M226 PolarHBondContact O-N 2.97Å; T223-M226 PolarHBondContact O-N 3.45Å; M226-L228 VanDerWaalsContact C-N 3.3Å; M226-L228 PolarHBondContact O-N 3.42Å; M226-I229 PolarHBondContact O-N 3.5Å; M226-I230 WeakPolarHBondContact O-CB 3.34Å; M226-I230 WeakPolarHBondContact O-CD1 3.33Å; M226-I230 VanDerWaalsContact O-CG1 3.24Å; M226-I230 WeakPolarHBondContact O-CG1 3.12Å; M226-I230 PolarHBondContact O-N 2.81Å |
| 227 | C | 87.9 | Confident | 81.3 | Confident | 43 Ų | 43 | 61.7 Ų | 61.7 | 29% | 0.291 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -61.2 | -38.6 | 176.9 | -169.4 | 0 | 0 | 0 | 0 | 112.1 | S193 T223 A224 I230 G231 | S193-C227 WeakPolarHBondContact OG-CB 3.3Å; T223-C227 WeakPolarHBondContact O-CB 3.44Å; T223-C227 PolarHBondContact O-N 3.44Å; A224-C227 PolarHBondContact O-N 3.38Å; C227-I230 PolarHBondContact O-N 2.89Å; C227-G231 PolarHBondContact O-N 3.4Å |
| 228 | L | 90.7 | Very high | 83.1 | Confident | 42 Ų | 42 | 60.2 Ų | 60.2 | 22% | 0.22 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -63.3 | -46.6 | 174.4 | -169.6 | 158.6 | 0 | 0 | 0 | 111.9 | I197 A224 K225 M226 G231 L232 | I197-L228 HydrophobicContact CD1-CD1 4.09Å; A224-L228 PolarHBondContact O-N 3.28Å; K225-L228 PolarHBondContact O-N 3.29Å; M226-L228 VanDerWaalsContact C-N 3.3Å; M226-L228 PolarHBondContact O-N 3.42Å; L228-G231 PolarHBondContact O-N 3.09Å; L228-L232 HydrophobicContact CD2-CD1 3.52Å; L228-L232 HydrophobicContact CD2-CG 4.19Å; L228-L232 PolarHBondContact O-N 3.1Å |
| 229 | I | 91.1 | Very high | 84.9 | Confident | 104 Ų | 104 | 58 Ų | 58 | 53% | 0.533 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -62.8 | -44.7 | 178.4 | -65.8 | 165.6 | 0 | 0 | 0 | 110.5 | K225 M226 G231 L232 F233 | K225-I229 WeakPolarHBondContact O-CG1 3.19Å; K225-I229 PolarHBondContact O-N 2.99Å; M226-I229 PolarHBondContact O-N 3.5Å; I229-G231 VanDerWaalsContact C-N 3.34Å; I229-G231 PolarHBondContact O-N 3.12Å; I229-L232 PolarHBondContact O-N 3.19Å; I229-F233 WeakPolarHBondContact O-CB 3.29Å; I229-F233 PolarHBondContact O-N 3.27Å |
| 230 | I | 89.6 | Confident | 86.6 | Confident | 86 Ų | 86 | 58.1 Ų | 58.1 | 44% | 0.441 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -60.6 | -44.8 | 176.3 | -68.9 | 162.5 | 0 | 0 | 0 | 110.3 | M226 C227 L232 F233 I234 | M226-I230 WeakPolarHBondContact O-CB 3.34Å; M226-I230 WeakPolarHBondContact O-CD1 3.33Å; M226-I230 VanDerWaalsContact O-CG1 3.24Å; M226-I230 WeakPolarHBondContact O-CG1 3.12Å; M226-I230 PolarHBondContact O-N 2.81Å; C227-I230 PolarHBondContact O-N 2.89Å; I230-L232 PolarHBondContact O-N 2.99Å; I230-F233 PolarHBondContact O-N 3.32Å; I230-I234 HydrophobicContact CG2-CD1 3.71Å; I230-I234 HydrophobicContact CG2-CG1 4.35Å; I230-I234 VanDerWaalsContact O-CG1 3.29Å; I230-I234 WeakPolarHBondContact O-CG1 3.39Å; I230-I234 PolarHBondContact O-N 2.91Å |
| 231 | G | 90 | Very high | 87.7 | Confident | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -59.9 | -43.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | T189 C227 L228 I229 I234 L235 | T189-G231 WeakPolarHBondContact OG1-CA 3.09Å; C227-G231 PolarHBondContact O-N 3.4Å; L228-G231 PolarHBondContact O-N 3.09Å; I229-G231 VanDerWaalsContact C-N 3.34Å; I229-G231 PolarHBondContact O-N 3.12Å; G231-I234 PolarHBondContact O-N 3.27Å; G231-L235 WeakPolarHBondContact O-CB 3.23Å; G231-L235 PolarHBondContact O-N 2.87Å |
| 232 | L | 91.8 | Very high | 88.6 | Confident | 74 Ų | 74 | 55.6 Ų | 55.6 | 39% | 0.387 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -65.2 | -40.4 | 174.6 | -76.8 | 172.8 | 0 | 0 | 0 | 112.2 | I190 L228 I229 I230 L235 I236 | I190-L232 HydrophobicContact CD1-CD2 4.2Å; L228-L232 HydrophobicContact CD2-CD1 3.52Å; L228-L232 HydrophobicContact CD2-CG 4.19Å; L228-L232 PolarHBondContact O-N 3.1Å; I229-L232 PolarHBondContact O-N 3.19Å; I230-L232 PolarHBondContact O-N 2.99Å; L232-L235 PolarHBondContact O-N 3.45Å; L232-I236 WeakPolarHBondContact O-CG1 3.44Å; L232-I236 PolarHBondContact O-N 2.86Å |
| 233 | F | 90.9 | Very high | 89.1 | Confident | 129 Ų | 129 | 56.4 Ų | 56.4 | 57% | 0.566 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -62.4 | -48.4 | 176.1 | 176.4 | -96.9 | 0 | 0 | 0 | 111 | I229 I230 L235 I236 A237 | I229-F233 WeakPolarHBondContact O-CB 3.29Å; I229-F233 PolarHBondContact O-N 3.27Å; I230-F233 PolarHBondContact O-N 3.32Å; F233-L235 VanDerWaalsContact C-N 3.32Å; F233-L235 PolarHBondContact O-N 3.46Å; F233-I236 PolarHBondContact O-N 2.9Å; F233-A237 HydrophobicContact CD1-CB 4.49Å; F233-A237 HydrophobicContact CD2-CB 4.46Å; F233-A237 HydrophobicContact CE1-CB 4.15Å; F233-A237 HydrophobicContact CE2-CB 4.12Å; F233-A237 HydrophobicContact CZ-CB 3.96Å; F233-A237 WeakPolarHBondContact O-CB 3.5Å; F233-A237 PolarHBondContact O-N 2.99Å |
| 234 | I | 89 | Confident | 89.2 | Confident | 27 Ų | 27 | 58.3 Ų | 58.3 | 14% | 0.138 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -59.6 | -45.1 | 176.9 | -67.1 | 166.8 | 0 | 0 | 0 | 110.1 | L30 S185 I230 G231 I236 S238 | L30-I234 HydrophobicContact CD2-CB 4.28Å; L30-I234 HydrophobicContact CD2-CD1 4.02Å; L30-I234 HydrophobicContact CD2-CG1 3.84Å; L30-I234 HydrophobicContact CD2-CG2 3.47Å; L30-I234 VanDerWaalsContact CD2-CG2 3.47Å; S185-I234 WeakPolarHBondContact OG-CG2 3.43Å; I230-I234 HydrophobicContact CG2-CD1 3.71Å; I230-I234 HydrophobicContact CG2-CG1 4.35Å; I230-I234 VanDerWaalsContact O-CG1 3.29Å; I230-I234 WeakPolarHBondContact O-CG1 3.39Å; I230-I234 PolarHBondContact O-N 2.91Å; G231-I234 PolarHBondContact O-N 3.27Å; I234-I236 PolarHBondContact O-N 3.46Å; I234-S238 WeakPolarHBondContact O-CB 3.26Å; I234-S238 PolarHBondContact O-N 2.89Å; I234-S238 PolarHBondContact O-OG 3.07Å |
| 235 | L | 92.5 | Very high | 88.6 | Confident | 29 Ų | 29 | 59.4 Ų | 59.4 | 15% | 0.152 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -57.2 | -51.1 | 178.3 | 176.7 | 64.3 | 0 | 0 | 0 | 111.7 | A181 F182 I190 G231 L232 F233 T239 | A181-L235 WeakPolarHBondContact O-CD1 3.41Å; F182-L235 HydrophobicContact CD1-CD1 4.04Å; F182-L235 HydrophobicContact CE1-CD1 4.38Å; F182-L235 HydrophobicContact CG-CD1 4.14Å; I190-L235 HydrophobicContact CD1-CD2 4.11Å; G231-L235 WeakPolarHBondContact O-CB 3.23Å; G231-L235 PolarHBondContact O-N 2.87Å; L232-L235 PolarHBondContact O-N 3.45Å; F233-L235 VanDerWaalsContact C-N 3.32Å; F233-L235 PolarHBondContact O-N 3.46Å; L235-T239 WeakPolarHBondContact O-CB 3.42Å; L235-T239 PolarHBondContact O-N 3.28Å; L235-T239 PolarHBondContact O-OG1 3.06Å |
| 236 | I | 92.7 | Very high | 87.7 | Confident | 109 Ų | 109 | 57 Ų | 57 | 56% | 0.559 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -74.3 | -53.3 | -175.6 | -62.5 | 166.6 | 0 | 0 | 0 | 110.8 | L232 F233 I234 S238 T239 C240 | L232-I236 WeakPolarHBondContact O-CG1 3.44Å; L232-I236 PolarHBondContact O-N 2.86Å; F233-I236 PolarHBondContact O-N 2.9Å; I234-I236 PolarHBondContact O-N 3.46Å; I236-S238 PolarHBondContact O-N 2.93Å; I236-T239 PolarHBondContact O-N 2.72Å; I236-C240 WeakPolarHBondContact O-CB 3.44Å; I236-C240 PolarHBondContact O-N 3.03Å; I236-C240 PolarHBondContact O-SG 3.47Å; I236-C240 VanDerWaalsContact O-SG 3.35Å |
| 237 | A | 90.9 | Very high | 86 | Confident | 19 Ų | 19 | 60 Ų | 60 | 16% | 0.157 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -63.9 | -42.8 | -174.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | L27 F233 A241 | L27-A237 HydrophobicContact CD2-CB 4.49Å; F233-A237 HydrophobicContact CD1-CB 4.49Å; F233-A237 HydrophobicContact CD2-CB 4.46Å; F233-A237 HydrophobicContact CE1-CB 4.15Å; F233-A237 HydrophobicContact CE2-CB 4.12Å; F233-A237 HydrophobicContact CZ-CB 3.96Å; F233-A237 WeakPolarHBondContact O-CB 3.5Å; F233-A237 PolarHBondContact O-N 2.99Å; A237-A241 VanDerWaalsContact O-CB 3.32Å; A237-A241 WeakPolarHBondContact O-CB 3.35Å; A237-A241 PolarHBondContact O-N 3.45Å |
| 238 | S | 90.3 | Very high | 83.9 | Confident | 0 Ų | 0 | 66.5 Ų | 66.5 | 0% | 0 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -71.2 | -40.7 | -179.9 | -43.7 | 0 | 0 | 0 | 0 | 111.2 | L27 I234 I236 C240 A241 I242 | L27-S238 WeakPolarHBondContact O-CB 3.45Å; I234-S238 WeakPolarHBondContact O-CB 3.26Å; I234-S238 PolarHBondContact O-N 2.89Å; I234-S238 PolarHBondContact O-OG 3.07Å; I236-S238 PolarHBondContact O-N 2.93Å; S238-C240 PolarHBondContact O-N 3.24Å; S238-A241 PolarHBondContact O-N 2.66Å; S238-I242 WeakPolarHBondContact O-CB 3.38Å; S238-I242 VanDerWaalsContact O-CD1 3.32Å; S238-I242 WeakPolarHBondContact O-CD1 3.47Å; S238-I242 WeakPolarHBondContact O-CG1 3.19Å; S238-I242 PolarHBondContact O-N 3.08Å |
| 239 | T | 91.9 | Very high | 81.6 | Confident | 19 Ų | 19 | 68.8 Ų | 68.8 | 12% | 0.117 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -61.9 | -44.5 | 176 | -59 | 0 | 0 | 0 | 0 | 111.3 | L178 F182 L235 I236 I242 L243 | L178-T239 HydrophobicContact CD1-CG2 4.25Å; F182-T239 HydrophobicContact CE2-CG2 3.78Å; F182-T239 HydrophobicContact CZ-CG2 4.3Å; L235-T239 WeakPolarHBondContact O-CB 3.42Å; L235-T239 PolarHBondContact O-N 3.28Å; L235-T239 PolarHBondContact O-OG1 3.06Å; I236-T239 PolarHBondContact O-N 2.72Å; T239-I242 PolarHBondContact O-N 3.5Å; T239-L243 HydrophobicContact CG2-CD1 3.96Å; T239-L243 HydrophobicContact CG2-CG 4.48Å; T239-L243 WeakPolarHBondContact O-CB 3.33Å; T239-L243 VanDerWaalsContact O-CG 3.28Å; T239-L243 WeakPolarHBondContact O-CG 3.28Å; T239-L243 PolarHBondContact O-N 3.19Å |
| 240 | C | 89.9 | Confident | 78.8 | Confident | 61 Ų | 61 | 68.6 Ų | 68.6 | 41% | 0.412 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -61.5 | -43.7 | 174.6 | -72 | 0 | 0 | 0 | 0 | 112 | I236 S238 L243 M244 | I236-C240 WeakPolarHBondContact O-CB 3.44Å; I236-C240 PolarHBondContact O-N 3.03Å; I236-C240 PolarHBondContact O-SG 3.47Å; I236-C240 VanDerWaalsContact O-SG 3.35Å; S238-C240 PolarHBondContact O-N 3.24Å; C240-L243 PolarHBondContact O-N 2.67Å; C240-M244 WeakPolarHBondContact O-CB 3.25Å; C240-M244 VanDerWaalsContact O-CG 3.29Å; C240-M244 WeakPolarHBondContact O-CG 3.28Å; C240-M244 PolarHBondContact O-N 3.25Å |
| 241 | A | 89.3 | Confident | 76.3 | Confident | 23 Ų | 23 | 69.5 Ų | 69.5 | 19% | 0.19 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -62.1 | -44.3 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | L27 T28 A237 S238 M244 G245 | L27-A241 HydrophobicContact CB-CB 3.78Å; T28-A241 HydrophobicContact CG2-CB 4.03Å; A237-A241 VanDerWaalsContact O-CB 3.32Å; A237-A241 WeakPolarHBondContact O-CB 3.35Å; A237-A241 PolarHBondContact O-N 3.45Å; S238-A241 PolarHBondContact O-N 2.66Å; A241-M244 PolarHBondContact O-N 3.21Å; A241-G245 PolarHBondContact O-N 3.06Å |
| 242 | I | 88.3 | Confident | 73.7 | Confident | 10 Ų | 10 | 74 Ų | 74 | 5% | 0.051 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -64 | -44.7 | 178.8 | -67.8 | 159 | 0 | 0 | 0 | 110.8 | T28 P31 F174 G177 A181 S238 T239 M244 G245 E246 | T28-I242 HydrophobicContact CG2-CG1 4.18Å; P31-I242 HydrophobicContact CG-CD1 3.93Å; F174-I242 HydrophobicContact CD2-CG2 3.35Å; F174-I242 HydrophobicContact CE2-CG2 3.51Å; F174-I242 HydrophobicContact CG-CG2 4.36Å; G177-I242 VanDerWaalsContact O-CD1 3.25Å; G177-I242 WeakPolarHBondContact O-CD1 3.49Å; A181-I242 HydrophobicContact CB-CD1 4.14Å; S238-I242 WeakPolarHBondContact O-CB 3.38Å; S238-I242 VanDerWaalsContact O-CD1 3.32Å; S238-I242 WeakPolarHBondContact O-CD1 3.47Å; S238-I242 WeakPolarHBondContact O-CG1 3.19Å; S238-I242 PolarHBondContact O-N 3.08Å; T239-I242 PolarHBondContact O-N 3.5Å; I242-M244 PolarHBondContact O-N 2.75Å; I242-G245 PolarHBondContact O-N 3.44Å; I242-E246 PolarHBondContact O-N 3.31Å |
| 243 | L | 86.6 | Confident | 71.2 | Confident | 86 Ų | 86 | 78.9 Ų | 78.9 | 45% | 0.45 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -68.5 | -33 | 178.7 | -69.7 | 173 | 0 | 0 | 0 | 113.3 | F174 T239 C240 | F174-L243 HydrophobicContact CE2-CD2 4.28Å; F174-L243 HydrophobicContact CZ-CD2 4.35Å; T239-L243 HydrophobicContact CG2-CD1 3.96Å; T239-L243 HydrophobicContact CG2-CG 4.48Å; T239-L243 WeakPolarHBondContact O-CB 3.33Å; T239-L243 VanDerWaalsContact O-CG 3.28Å; T239-L243 WeakPolarHBondContact O-CG 3.28Å; T239-L243 PolarHBondContact O-N 3.19Å; C240-L243 PolarHBondContact O-N 2.67Å |
| 244 | M | 82.9 | Confident | 68.6 | Low | 135 Ų | 135 | 79.7 Ų | 79.7 | 67% | 0.665 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -75.2 | -30.8 | 174.4 | -72.9 | -176.8 | 178.7 | 0 | 0 | 112.1 | C240 A241 I242 | C240-M244 WeakPolarHBondContact O-CB 3.25Å; C240-M244 VanDerWaalsContact O-CG 3.29Å; C240-M244 WeakPolarHBondContact O-CG 3.28Å; C240-M244 PolarHBondContact O-N 3.25Å; A241-M244 PolarHBondContact O-N 3.21Å; I242-M244 PolarHBondContact O-N 2.75Å |
| 245 | G | 70.9 | Confident | 66 | Low | 33 Ų | 33 | 82.4 Ų | 82.4 | 34% | 0.34 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -63 | -47.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | A241 I242 K247 K248 T249 | A241-G245 PolarHBondContact O-N 3.06Å; I242-G245 PolarHBondContact O-N 3.44Å; G245-K247 VanDerWaalsContact C-N 3.29Å; G245-K247 PolarHBondContact O-N 3.05Å; G245-K248 PolarHBondContact O-N 3.48Å; G245-T249 PolarHBondContact O-N 3Å |
| 246 | E | 66.4 | Low | 63.3 | Low | 65 Ų | 65 | 88.5 Ų | 88.5 | 30% | 0.304 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -58.5 | -36.7 | 178.3 | -85.2 | -95.4 | 137.2 | 0 | 0 | 113.6 | N171 F174 I242 K248 T249 S250 | N171-E246 PolarHBondContact ND2-OE1 3.23Å; F174-E246 HydrophobicContact CB-CG 4.48Å; F174-E246 HydrophobicContact CD2-CG 3.22Å; F174-E246 HydrophobicContact CE2-CG 3.53Å; F174-E246 HydrophobicContact CG-CG 3.99Å; F174-E246 HydrophobicContact CZ-CG 4.48Å; I242-E246 PolarHBondContact O-N 3.31Å; E246-K248 PolarHBondContact O-N 2.86Å; E246-T249 WeakPolarHBondContact CA-OG1 3.19Å; E246-T249 PolarHBondContact O-N 3.44Å; E246-T249 PolarHBondContact O-OG1 3.32Å; E246-T249 VanDerWaalsContact O-OG1 3.07Å; E246-S250 PolarHBondContact O-N 2.91Å |
| 247 | K | 52.9 | Low | 60.6 | Low | 166 Ų | 166 | 86 Ų | 86 | 72% | 0.722 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -65.4 | -20.2 | 178.8 | -70.4 | -176.7 | -178.2 | -176 | 0 | 113.3 | G245 | G245-K247 VanDerWaalsContact C-N 3.29Å; G245-K247 PolarHBondContact O-N 3.05Å |
| 248 | K | 44.2 | Very low | 58 | Low | 179 Ų | 179 | 94.8 Ų | 94.8 | 78% | 0.778 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -87.3 | -29.1 | 174.6 | -86.9 | -176.4 | 173.2 | -176.1 | 0 | 112.8 | G245 E246 | G245-K248 PolarHBondContact O-N 3.48Å; E246-K248 PolarHBondContact O-N 2.86Å |
| 249 | T | 42.4 | Very low | 55.4 | Low | 91 Ų | 91 | 100.9 Ų | 100.9 | 56% | 0.558 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -87 | -11.4 | -178.1 | 49.1 | 0 | 0 | 0 | 0 | 113.8 | G245 E246 V251 | G245-T249 PolarHBondContact O-N 3Å; E246-T249 WeakPolarHBondContact CA-OG1 3.19Å; E246-T249 PolarHBondContact O-N 3.44Å; E246-T249 PolarHBondContact O-OG1 3.32Å; E246-T249 VanDerWaalsContact O-OG1 3.07Å; T249-V251 PolarHBondContact O-N 2.86Å |
| 250 | S | 31.2 | Very low | 52.9 | Low | 99 Ų | 99 | 107.5 Ų | 107.5 | 69% | 0.692 | 57% | 0.569 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.2 | 7.3 | 173.9 | 83.5 | 0 | 0 | 0 | 0 | 114.2 | E246 | E246-S250 PolarHBondContact O-N 2.91Š|
| 251 | V | 37.3 | Very low | 50.4 | Low | 105 Ų | 105 | 107.9 Ų | 107.9 | 64% | 0.636 | 57% | 0.572 | S | S | * | * | S | Bend | trans | -96.8 | 93.4 | 169.6 | -176.3 | 0 | 0 | 0 | 0 | 107.5 | T249 | T249-V251 PolarHBondContact O-N 2.86Š|
| 252 | V | 35.6 | Very low | 48.4 | Very low | 94 Ų | 94 | 109.7 Ų | 109.7 | 57% | 0.57 | 59% | 0.593 | S | S | * | * | trans | 62.3 | 99.8 | 166.7 | -168 | 0 | 0 | 0 | 0 | 116 | K254 | V252-K254 PolarHBondContact O-N 3.37Š| ||
| 253 | E | 38.4 | Very low | 46.2 | Very low | 177 Ų | 177 | 117.8 Ų | 117.8 | 83% | 0.827 | 63% | 0.631 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 118.4 | 158.9 | -95 | 179.8 | 145.1 | 0 | 0 | 109.6 | P255 | E253-P255 WeakPolarHBondContact O-CD 3.39Š|
| 254 | K | 37.5 | Very low | 44.1 | Very low | 146 Ų | 146 | 120.7 Ų | 120.7 | 64% | 0.635 | 65% | 0.645 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 121.2 | 169.5 | -73 | 177.2 | -179.1 | 170.5 | 0 | 108.8 | V252 K256 | V252-K254 PolarHBondContact O-N 3.37Å; K254-K256 PolarHBondContact O-N 2.8Å |
| 255 | P | 34.8 | Very low | 42.3 | Very low | 84 Ų | 84 | 118.4 Ų | 118.4 | 55% | 0.545 | 63% | 0.629 | S | S | . | * | P | Polyproline II helix | trans | -63.3 | 123.1 | 171 | 23.8 | -30 | 0 | 0 | 0 | 109.1 | E253 A257 | E253-P255 WeakPolarHBondContact O-CD 3.39Å; P255-A257 PolarHBondContact O-N 3.43Å |
| 256 | K | 35.9 | Very low | 41.4 | Very low | 158 Ų | 158 | 123.7 Ų | 123.7 | 69% | 0.687 | 65% | 0.645 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 123 | -178.5 | -147.8 | 176.1 | -173.2 | -176.9 | 0 | 109.8 | V95 K254 | V95-K256 PolarHBondContact O-NZ 3.16Å; V95-K256 VanDerWaalsContact O-NZ 3.16Å; K254-K256 PolarHBondContact O-N 2.8Å |
| 257 | A | 35.1 | Very low | 40.6 | Very low | 57 Ų | 57 | 128.6 Ų | 128.6 | 47% | 0.471 | 67% | 0.668 | S | S | . | * | P | Polyproline II helix | trans | -66.4 | 131.2 | 171 | 0 | 0 | 0 | 0 | 0 | 110.6 | P255 | P255-A257 PolarHBondContact O-N 3.43Š|
| 258 | K | 35.7 | Very low | 40.4 | Very low | 202 Ų | 202 | 124.6 Ų | 124.6 | 88% | 0.878 | 65% | 0.651 | S | S | * | * | trans | -88.8 | 115.5 | 158.7 | -163.3 | 174.8 | -177.9 | -179 | 0 | 105.9 | D260 | K258-D260 PolarHBondContact O-N 2.69Š| ||
| 259 | D | 36.7 | Very low | 40.8 | Very low | 128 Ų | 128 | 120.6 Ų | 120.6 | 68% | 0.684 | 64% | 0.638 | S | S | * | * | trans | -80.3 | 111.3 | -171.5 | -49.7 | -43 | 0 | 0 | 0 | 110 | ||||
| 260 | D | 39 | Very low | 41.4 | Very low | 159 Ų | 159 | 123.5 Ų | 123.5 | 85% | 0.85 | 64% | 0.643 | S | S | * | * | -169.9 | 90.7 | 127.5 | -145 | 5.3 | 0 | 0 | 0 | 110.3 | K258 | K258-D260 PolarHBondContact O-N 2.69Š| |||
| 261 | S | 36.8 | Very low | 42.6 | Very low | 68 Ų | 68 | 121.3 Ų | 121.3 | 48% | 0.476 | 63% | 0.628 | S | S | . | * | trans | 177.1 | 98.4 | 157.6 | 53.9 | 0 | 0 | 0 | 0 | 107.8 | R265 | S261-R265 PolarHBondContact O-NE 3.1Å; S261-R265 VanDerWaalsContact O-NE 3.16Å; S261-R265 PolarHBondContact O-NH2 3.34Å | ||
| 262 | G | 48.1 | Very low | 43.2 | Very low | 62 Ų | 62 | 118.7 Ų | 118.7 | 64% | 0.639 | 61% | 0.61 | S | S | * | * | trans | -67.9 | 162.8 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | I264 | G262-I264 PolarHBondContact O-N 3.2Š| ||
| 263 | E | 40.8 | Very low | 44.2 | Very low | 179 Ų | 179 | 120 Ų | 120 | 84% | 0.836 | 61% | 0.61 | S | S | * | * | S | Bend | trans | 79.5 | -48.7 | 172.3 | -62.5 | -173.1 | 140.5 | 0 | 0 | 118.4 | R265 | E263-R265 PolarHBondContact O-N 3.42Š|
| 264 | I | 43.1 | Very low | 45.3 | Very low | 147 Ų | 147 | 113.9 Ų | 113.9 | 75% | 0.754 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.8 | -22.6 | -173.5 | -54.4 | 175.6 | 0 | 0 | 0 | 113.1 | G262 | G262-I264 PolarHBondContact O-N 3.2Š|
| 265 | R | 45.9 | Very low | 46.3 | Very low | 88 Ų | 88 | 108.5 Ų | 108.5 | 33% | 0.332 | 57% | 0.565 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -81 | -10.4 | -179.6 | -68.5 | -177.4 | -68.9 | 161.9 | 2.1 | 114.5 | S261 E263 L269 | S261-R265 PolarHBondContact O-NE 3.1Å; S261-R265 VanDerWaalsContact O-NE 3.16Å; S261-R265 PolarHBondContact O-NH2 3.34Å; E263-R265 PolarHBondContact O-N 3.42Å; R265-L269 HydrophobicContact CB-CD1 4.46Å; R265-L269 WeakPolarHBondContact O-CB 3.14Å; R265-L269 PolarHBondContact O-N 2.99Å; R265-L269 VanDerWaalsContact O-N 3.12Å |
| 266 | H | 50.8 | Low | 47.3 | Very low | 143 Ų | 143 | 109.5 Ų | 109.5 | 66% | 0.662 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -73 | -36.3 | -171.5 | -109.4 | -58.3 | 0 | 0 | 0 | 113.3 | K270 | H266-K270 WeakPolarHBondContact O-CB 3.21Å; H266-K270 PolarHBondContact O-N 3.01Å; H266-K270 VanDerWaalsContact O-N 3.11Å |
| 267 | E | 51.1 | Low | 48.6 | Very low | 168 Ų | 168 | 108 Ų | 108 | 79% | 0.785 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -71.4 | -40.6 | 178.6 | -81.9 | -145.2 | 151.4 | 0 | 0 | 112.9 | K270 S271 | E267-K270 PolarHBondContact O-N 3.29Å; E267-S271 PolarHBondContact O-N 3.44Å |
| 268 | E | 48.3 | Very low | 49.8 | Very low | 82 Ų | 82 | 111.6 Ų | 111.6 | 38% | 0.383 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -75.2 | -30.5 | -180 | -67.2 | -170 | 157 | 0 | 0 | 112.6 | S271 L272 | E268-S271 WeakPolarHBondContact CA-OG 3.47Å; E268-S271 PolarHBondContact O-OG 3.06Å; E268-L272 WeakPolarHBondContact O-CB 3.4Å; E268-L272 PolarHBondContact O-N 3.41Å |
| 269 | L | 51.7 | Low | 50.8 | Low | 96 Ų | 96 | 102.8 Ų | 102.8 | 50% | 0.503 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.9 | -41.3 | 167.4 | -108.2 | 84.6 | 0 | 0 | 0 | 111.5 | R265 S271 L272 E273 | R265-L269 HydrophobicContact CB-CD1 4.46Å; R265-L269 WeakPolarHBondContact O-CB 3.14Å; R265-L269 PolarHBondContact O-N 2.99Å; R265-L269 VanDerWaalsContact O-N 3.12Å; L269-S271 VanDerWaalsContact C-N 3.31Å; L269-S271 PolarHBondContact O-N 3.19Å; L269-L272 WeakPolarHBondContact O-CB 3.31Å; L269-L272 PolarHBondContact O-N 2.9Å; L269-E273 PolarHBondContact O-N 3.41Å |
| 270 | K | 55.6 | Low | 51.6 | Low | 151 Ų | 151 | 101.9 Ų | 101.9 | 66% | 0.657 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65.9 | -36.8 | 178.9 | -138.5 | 175 | -172.6 | 179.7 | 0 | 111.6 | H266 E267 S274 | H266-K270 WeakPolarHBondContact O-CB 3.21Å; H266-K270 PolarHBondContact O-N 3.01Å; H266-K270 VanDerWaalsContact O-N 3.11Å; E267-K270 PolarHBondContact O-N 3.29Å; K270-S274 VanDerWaalsContact O-CB 3.28Å; K270-S274 WeakPolarHBondContact O-CB 3.09Å; K270-S274 PolarHBondContact O-N 3.42Å; K270-S274 PolarHBondContact O-OG 2.91Å |
| 271 | S | 55.7 | Low | 52.6 | Low | 54 Ų | 54 | 99 Ų | 99 | 38% | 0.378 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -68.5 | -38.8 | 175.5 | 73.1 | 0 | 0 | 0 | 0 | 111.1 | E267 E268 L269 S274 L275 | E267-S271 PolarHBondContact O-N 3.44Å; E268-S271 WeakPolarHBondContact CA-OG 3.47Å; E268-S271 PolarHBondContact O-OG 3.06Å; L269-S271 VanDerWaalsContact C-N 3.31Å; L269-S271 PolarHBondContact O-N 3.19Å; S271-S274 PolarHBondContact O-OG 3.31Å; S271-L275 VanDerWaalsContact O-CB 3.27Å; S271-L275 WeakPolarHBondContact O-CB 3.39Å; S271-L275 PolarHBondContact O-N 2.91Å |
| 272 | L | 50.5 | Low | 53.5 | Low | 49 Ų | 49 | 97.2 Ų | 97.2 | 26% | 0.257 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.6 | -48.9 | 171.9 | -104.4 | 160.2 | 0 | 0 | 0 | 112.7 | E268 L269 S274 L275 E276 | E268-L272 WeakPolarHBondContact O-CB 3.4Å; E268-L272 PolarHBondContact O-N 3.41Å; L269-L272 WeakPolarHBondContact O-CB 3.31Å; L269-L272 PolarHBondContact O-N 2.9Å; L272-S274 PolarHBondContact O-N 2.92Å; L272-L275 PolarHBondContact O-N 3.46Å; L272-L275 VanDerWaalsContact O-N 3.13Å; L272-E276 WeakPolarHBondContact O-CB 3.27Å; L272-E276 PolarHBondContact O-N 3.38Å |
| 273 | E | 57.2 | Low | 53.8 | Low | 123 Ų | 123 | 97.6 Ų | 97.6 | 58% | 0.575 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -59.9 | -45.2 | 176.1 | -78 | 179.7 | 164.5 | 0 | 0 | 111.4 | L269 L275 E276 E277 | L269-E273 PolarHBondContact O-N 3.41Å; E273-L275 PolarHBondContact O-N 3.41Å; E273-E276 PolarHBondContact O-N 2.95Å; E273-E277 WeakPolarHBondContact O-CB 3.42Å; E273-E277 PolarHBondContact O-N 2.91Å |
| 274 | S | 61.2 | Low | 54.5 | Low | 47 Ų | 47 | 94.3 Ų | 94.3 | 33% | 0.329 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -65.1 | -26.1 | 177.9 | 78.8 | 0 | 0 | 0 | 0 | 113.2 | K270 S271 L272 K278 | K270-S274 VanDerWaalsContact O-CB 3.28Å; K270-S274 WeakPolarHBondContact O-CB 3.09Å; K270-S274 PolarHBondContact O-N 3.42Å; K270-S274 PolarHBondContact O-OG 2.91Å; S271-S274 PolarHBondContact O-OG 3.31Å; L272-S274 PolarHBondContact O-N 2.92Å; S274-K278 WeakPolarHBondContact O-CD 3.44Å; S274-K278 WeakPolarHBondContact O-CG 3.48Å; S274-K278 PolarHBondContact O-N 3.01Å |
| 275 | L | 58.2 | Low | 55.4 | Low | 34 Ų | 34 | 91.1 Ų | 91.1 | 18% | 0.178 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -84.3 | -35.4 | 178.5 | -159.5 | 64.1 | 0 | 0 | 0 | 110.7 | S271 L272 E273 K278 V279 L322 Q326 | S271-L275 VanDerWaalsContact O-CB 3.27Å; S271-L275 WeakPolarHBondContact O-CB 3.39Å; S271-L275 PolarHBondContact O-N 2.91Å; L272-L275 PolarHBondContact O-N 3.46Å; L272-L275 VanDerWaalsContact O-N 3.13Å; E273-L275 PolarHBondContact O-N 3.41Å; L275-K278 PolarHBondContact O-N 3.44Å; L275-V279 VanDerWaalsContact O-CG2 3.25Å; L275-V279 WeakPolarHBondContact O-CG2 3.33Å; L275-V279 PolarHBondContact O-N 3.48Å; L275-L322 HydrophobicContact CD1-CD2 4.22Å; L275-Q326 HydrophobicContact CD2-CG 3.62Å; L275-Q326 HydrophobicContact CG-CG 4.46Å |
| 276 | E | 56.5 | Low | 55.9 | Low | 104 Ų | 104 | 88 Ų | 88 | 49% | 0.486 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -65.4 | -43.1 | 172.5 | -166.4 | 177.2 | 168.1 | 0 | 0 | 111.4 | L272 E273 K278 V279 L280 | L272-E276 WeakPolarHBondContact O-CB 3.27Å; L272-E276 PolarHBondContact O-N 3.38Å; E273-E276 PolarHBondContact O-N 2.95Å; E276-K278 PolarHBondContact O-N 2.92Å; E276-V279 PolarHBondContact O-N 3.16Å; E276-L280 WeakPolarHBondContact O-CB 3.4Å; E276-L280 PolarHBondContact O-N 3.33Å |
| 277 | E | 62.1 | Low | 56.1 | Low | 127 Ų | 127 | 84.4 Ų | 84.4 | 59% | 0.593 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -59.5 | -45 | 173.3 | -171 | 175.8 | -166.1 | 0 | 0 | 111.2 | E273 V279 L280 D281 | E273-E277 WeakPolarHBondContact O-CB 3.42Å; E273-E277 PolarHBondContact O-N 2.91Å; E277-V279 VanDerWaalsContact C-N 3.34Å; E277-V279 PolarHBondContact O-N 3.26Å; E277-L280 PolarHBondContact O-N 2.87Å; E277-D281 WeakPolarHBondContact O-CB 3.43Å; E277-D281 PolarHBondContact O-N 3.42Å |
| 278 | K | 60.5 | Low | 56.6 | Low | 132 Ų | 132 | 78.8 Ų | 78.8 | 57% | 0.574 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -63.5 | -36.4 | 175.4 | -75.9 | 171.1 | -175.3 | 173.1 | 0 | 113.3 | S274 L275 E276 A282 | S274-K278 WeakPolarHBondContact O-CD 3.44Å; S274-K278 WeakPolarHBondContact O-CG 3.48Å; S274-K278 PolarHBondContact O-N 3.01Å; L275-K278 PolarHBondContact O-N 3.44Å; E276-K278 PolarHBondContact O-N 2.92Å; K278-A282 VanDerWaalsContact O-CB 3.32Å; K278-A282 WeakPolarHBondContact O-CB 3.29Å; K278-A282 PolarHBondContact O-N 2.97Å |
| 279 | V | 56.9 | Low | 57.2 | Low | 18 Ų | 18 | 77.7 Ų | 77.7 | 11% | 0.109 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -71.9 | -36.4 | 176.6 | 169.6 | 0 | 0 | 0 | 0 | 110.8 | L275 E276 E277 N283 | L275-V279 VanDerWaalsContact O-CG2 3.25Å; L275-V279 WeakPolarHBondContact O-CG2 3.33Å; L275-V279 PolarHBondContact O-N 3.48Å; E276-V279 PolarHBondContact O-N 3.16Å; E277-V279 VanDerWaalsContact C-N 3.34Å; E277-V279 PolarHBondContact O-N 3.26Å; V279-N283 WeakPolarHBondContact O-CB 3.45Å; V279-N283 PolarHBondContact O-N 3.39Å |
| 280 | L | 53.2 | Low | 57.4 | Low | 109 Ų | 109 | 77.5 Ų | 77.5 | 57% | 0.571 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -67.7 | -44.6 | 176.4 | -171.4 | 66.5 | 0 | 0 | 0 | 111.7 | E276 E277 A282 N283 L284 | E276-L280 WeakPolarHBondContact O-CB 3.4Å; E276-L280 PolarHBondContact O-N 3.33Å; E277-L280 PolarHBondContact O-N 2.87Å; L280-A282 VanDerWaalsContact C-N 3.35Å; L280-N283 PolarHBondContact O-N 2.93Å; L280-L284 PolarHBondContact O-N 3.5Å |
| 281 | D | 60.8 | Low | 57.4 | Low | 98 Ų | 98 | 75.6 Ų | 75.6 | 52% | 0.524 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -63.1 | -40.4 | 174.9 | -82.6 | -14.7 | 0 | 0 | 0 | 111.9 | E277 N283 L284 N285 | E277-D281 WeakPolarHBondContact O-CB 3.43Å; E277-D281 PolarHBondContact O-N 3.42Å; D281-N283 VanDerWaalsContact C-N 3.35Å; D281-N283 PolarHBondContact O-N 3.37Å; D281-L284 PolarHBondContact O-N 3.47Å; D281-N285 WeakPolarHBondContact O-CB 3.23Å; D281-N285 PolarHBondContact O-N 3.49Å |
| 282 | A | 55.5 | Low | 57.7 | Low | 31 Ų | 31 | 77.2 Ų | 77.2 | 26% | 0.256 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -62.1 | -41.2 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | K278 L280 N285 I286 | K278-A282 VanDerWaalsContact O-CB 3.32Å; K278-A282 WeakPolarHBondContact O-CB 3.29Å; K278-A282 PolarHBondContact O-N 2.97Å; L280-A282 VanDerWaalsContact C-N 3.35Å; A282-N285 PolarHBondContact O-N 3.4Å; A282-I286 WeakPolarHBondContact O-CB 3.29Å; A282-I286 WeakPolarHBondContact O-CD1 3.4Å; A282-I286 WeakPolarHBondContact O-CG1 3.48Å; A282-I286 PolarHBondContact O-N 3.46Å |
| 283 | N | 53.6 | Low | 58.1 | Low | 69 Ų | 69 | 75.7 Ų | 75.7 | 37% | 0.369 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -66.5 | -37.7 | 177 | -90.4 | -29.6 | 0 | 0 | 0 | 113.3 | V279 L280 D281 S287 Q319 | V279-N283 WeakPolarHBondContact O-CB 3.45Å; V279-N283 PolarHBondContact O-N 3.39Å; L280-N283 PolarHBondContact O-N 2.93Å; D281-N283 VanDerWaalsContact C-N 3.35Å; D281-N283 PolarHBondContact O-N 3.37Å; N283-S287 PolarHBondContact O-N 2.94Å; N283-S287 PolarHBondContact O-OG 3.43Å; N283-Q319 PolarHBondContact OD1-NE2 3.32Å |
| 284 | L | 57.1 | Low | 58 | Low | 110 Ų | 110 | 73.3 Ų | 73.3 | 58% | 0.576 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -65.5 | -42 | 174.2 | -79.1 | 164.4 | 0 | 0 | 0 | 111.2 | L280 D281 S287 A288 | L280-L284 PolarHBondContact O-N 3.5Å; D281-L284 PolarHBondContact O-N 3.47Å; L284-S287 PolarHBondContact O-N 3.46Å; L284-A288 PolarHBondContact O-N 2.98Å |
| 285 | N | 60.9 | Low | 57.9 | Low | 81 Ų | 81 | 76.3 Ų | 76.3 | 43% | 0.433 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -67.7 | -37.4 | 177.2 | -162.4 | 6.3 | 0 | 0 | 0 | 112.2 | D281 A282 A288 K289 | D281-N285 WeakPolarHBondContact O-CB 3.23Å; D281-N285 PolarHBondContact O-N 3.49Å; A282-N285 PolarHBondContact O-N 3.4Å; N285-A288 PolarHBondContact O-N 3.32Å; N285-K289 WeakPolarHBondContact O-CB 3.46Å; N285-K289 WeakPolarHBondContact O-CG 3.31Å; N285-K289 PolarHBondContact O-N 3.43Å |
| 286 | I | 57.5 | Low | 57.9 | Low | 21 Ų | 21 | 76.7 Ų | 76.7 | 11% | 0.108 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -64.9 | -41.4 | 173.8 | -71.4 | 166.5 | 0 | 0 | 0 | 111.2 | A282 L290 M312 | A282-I286 WeakPolarHBondContact O-CB 3.29Å; A282-I286 WeakPolarHBondContact O-CD1 3.4Å; A282-I286 WeakPolarHBondContact O-CG1 3.48Å; A282-I286 PolarHBondContact O-N 3.46Å; I286-L290 WeakPolarHBondContact O-CB 3.41Å; I286-L290 PolarHBondContact O-N 3.28Å; I286-M312 HydrophobicContact CG2-CE 3.69Å |
| 287 | S | 54 | Low | 57.9 | Low | 69 Ų | 69 | 74.5 Ų | 74.5 | 48% | 0.483 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -65.4 | -43.3 | 175.3 | -73.2 | 0 | 0 | 0 | 0 | 112.1 | N283 L284 K289 L290 D291 | N283-S287 PolarHBondContact O-N 2.94Å; N283-S287 PolarHBondContact O-OG 3.43Å; L284-S287 PolarHBondContact O-N 3.46Å; S287-K289 PolarHBondContact O-N 3Å; S287-L290 PolarHBondContact O-N 2.82Å; S287-L290 VanDerWaalsContact O-N 3.16Å; S287-D291 PolarHBondContact O-N 2.88Å |
| 288 | A | 62.5 | Low | 57.7 | Low | 50 Ų | 50 | 72.7 Ų | 72.7 | 41% | 0.413 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -61.3 | -44.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | L284 N285 L290 D291 D292 | L284-A288 PolarHBondContact O-N 2.98Å; N285-A288 PolarHBondContact O-N 3.32Å; A288-L290 VanDerWaalsContact C-N 3.3Å; A288-L290 PolarHBondContact O-N 2.97Å; A288-D291 PolarHBondContact O-N 3.48Å; A288-D292 PolarHBondContact O-N 2.79Å |
| 289 | K | 60 | Low | 57.6 | Low | 58 Ų | 58 | 73.4 Ų | 73.4 | 25% | 0.252 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -64.6 | -32.1 | 174.6 | -75.1 | -168 | 173.5 | -162.5 | 0 | 112.9 | N285 S287 I293 E311 | N285-K289 WeakPolarHBondContact O-CB 3.46Å; N285-K289 WeakPolarHBondContact O-CG 3.31Å; N285-K289 PolarHBondContact O-N 3.43Å; S287-K289 PolarHBondContact O-N 3Å; K289-I293 WeakPolarHBondContact O-CD1 3.41Å; K289-I293 WeakPolarHBondContact O-CG1 3.41Å; K289-I293 PolarHBondContact O-N 3.43Å; K289-E311 IonicContact NZ-OE2 2.86Å |
| 290 | L | 56.6 | Low | 57.5 | Low | 93 Ų | 93 | 75.2 Ų | 75.2 | 49% | 0.487 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -71 | -36.4 | 177.2 | -169.1 | 66.1 | 0 | 0 | 0 | 111.9 | I286 S287 A288 I293 S294 M312 | I286-L290 WeakPolarHBondContact O-CB 3.41Å; I286-L290 PolarHBondContact O-N 3.28Å; S287-L290 PolarHBondContact O-N 2.82Å; S287-L290 VanDerWaalsContact O-N 3.16Å; A288-L290 VanDerWaalsContact C-N 3.3Å; A288-L290 PolarHBondContact O-N 2.97Å; L290-I293 PolarHBondContact O-N 3.02Å; L290-S294 PolarHBondContact O-N 3.14Å; L290-M312 HydrophobicContact CB-CE 4.17Å; L290-M312 HydrophobicContact CD1-CE 4.14Å |
| 291 | D | 55.8 | Low | 57.7 | Low | 110 Ų | 110 | 73.5 Ų | 73.5 | 59% | 0.588 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -65.8 | -42.9 | 172.9 | -76.3 | -17.5 | 0 | 0 | 0 | 111 | S287 A288 I293 S294 E295 | S287-D291 PolarHBondContact O-N 2.88Å; A288-D291 PolarHBondContact O-N 3.48Å; D291-I293 PolarHBondContact O-N 2.79Å; D291-S294 WeakPolarHBondContact O-CB 3.33Å; D291-S294 PolarHBondContact O-N 3.31Å; D291-S294 VanDerWaalsContact O-N 3.15Å; D291-S294 PolarHBondContact O-OG 3.4Å; D291-E295 PolarHBondContact O-N 3.3Å |
| 292 | D | 61.4 | Low | 57.6 | Low | 89 Ų | 89 | 74.4 Ų | 74.4 | 48% | 0.476 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -63.8 | -38.5 | 175.3 | -76.7 | -18.9 | 0 | 0 | 0 | 112.8 | A288 S294 E295 L296 | A288-D292 PolarHBondContact O-N 2.79Å; D292-S294 VanDerWaalsContact C-N 3.32Å; D292-E295 PolarHBondContact O-N 2.98Å; D292-L296 WeakPolarHBondContact O-CB 3.35Å; D292-L296 WeakPolarHBondContact O-CG 3.3Å; D292-L296 PolarHBondContact O-N 2.91Å |
| 293 | I | 57.6 | Low | 57.8 | Low | 16 Ų | 16 | 78.3 Ų | 78.3 | 8% | 0.082 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -65.6 | -37 | 174.3 | -68.8 | 162.2 | 0 | 0 | 0 | 110.7 | K289 L290 D291 E295 L296 A297 A305 M308 M312 | K289-I293 WeakPolarHBondContact O-CD1 3.41Å; K289-I293 WeakPolarHBondContact O-CG1 3.41Å; K289-I293 PolarHBondContact O-N 3.43Å; L290-I293 PolarHBondContact O-N 3.02Å; D291-I293 PolarHBondContact O-N 2.79Å; I293-E295 VanDerWaalsContact C-N 3.3Å; I293-E295 PolarHBondContact O-N 2.76Å; I293-L296 PolarHBondContact O-N 2.59Å; I293-A297 VanDerWaalsContact O-CB 3.25Å; I293-A297 WeakPolarHBondContact O-CB 3.41Å; I293-A297 PolarHBondContact O-N 2.86Å; I293-A305 HydrophobicContact CG2-CB 4.44Å; I293-M308 HydrophobicContact CD1-CB 3.8Å; I293-M308 HydrophobicContact CG1-CB 3.97Å; I293-M308 HydrophobicContact CG1-CE 4.48Å; I293-M308 HydrophobicContact CG1-SD 4.06Å; I293-M312 HydrophobicContact CD1-SD 3.36Å; I293-M312 WeakPolarHBondContact CD1-SD 3.39Å |
| 294 | S | 56.1 | Low | 58.2 | Low | 74 Ų | 74 | 80 Ų | 80 | 52% | 0.517 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -65.2 | -35.7 | 175.6 | 84.8 | 0 | 0 | 0 | 0 | 111.9 | L290 D291 D292 A298 | L290-S294 PolarHBondContact O-N 3.14Å; D291-S294 WeakPolarHBondContact O-CB 3.33Å; D291-S294 PolarHBondContact O-N 3.31Å; D291-S294 VanDerWaalsContact O-N 3.15Å; D291-S294 PolarHBondContact O-OG 3.4Å; D292-S294 VanDerWaalsContact C-N 3.32Å; S294-A298 PolarHBondContact O-N 2.95Å |
| 295 | E | 59.5 | Low | 58.2 | Low | 110 Ų | 110 | 75.2 Ų | 75.2 | 51% | 0.514 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -73.7 | -37.6 | 176.5 | -159.2 | -170.4 | 141.9 | 0 | 0 | 112.3 | D291 D292 I293 A298 K299 | D291-E295 PolarHBondContact O-N 3.3Å; D292-E295 PolarHBondContact O-N 2.98Å; I293-E295 VanDerWaalsContact C-N 3.3Å; I293-E295 PolarHBondContact O-N 2.76Å; E295-A298 WeakPolarHBondContact O-CB 3.46Å; E295-A298 PolarHBondContact O-N 2.88Å; E295-K299 PolarHBondContact O-N 3.3Å; E295-K299 IonicContact OE1-NZ 2.79Å; E295-K299 PolarHBondContact OE1-NZ 3.24Å |
| 296 | L | 57.7 | Low | 58 | Low | 42 Ų | 42 | 75.6 Ų | 75.6 | 22% | 0.22 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -73.4 | -35.5 | 177 | -78 | 163.2 | 0 | 0 | 0 | 112.9 | D292 I293 A298 K299 G300 M308 | D292-L296 WeakPolarHBondContact O-CB 3.35Å; D292-L296 WeakPolarHBondContact O-CG 3.3Å; D292-L296 PolarHBondContact O-N 2.91Å; I293-L296 PolarHBondContact O-N 2.59Å; L296-A298 VanDerWaalsContact C-N 3.27Å; L296-A298 PolarHBondContact O-N 2.81Å; L296-K299 PolarHBondContact O-N 3.33Å; L296-G300 PolarHBondContact O-N 3.23Å; L296-M308 HydrophobicContact CD1-CE 3.34Å |
| 297 | A | 55.8 | Low | 58.4 | Low | 58 Ų | 58 | 81.4 Ų | 81.4 | 48% | 0.479 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -64.1 | -33.2 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | I293 K299 G300 | I293-A297 VanDerWaalsContact O-CB 3.25Å; I293-A297 WeakPolarHBondContact O-CB 3.41Å; I293-A297 PolarHBondContact O-N 2.86Å; A297-K299 PolarHBondContact O-N 3Å; A297-G300 PolarHBondContact O-N 3.49Å |
| 298 | A | 58.3 | Low | 58.7 | Low | 88 Ų | 88 | 80 Ų | 80 | 73% | 0.727 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -67.8 | -22.4 | 172.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | S294 E295 L296 | S294-A298 PolarHBondContact O-N 2.95Å; E295-A298 WeakPolarHBondContact O-CB 3.46Å; E295-A298 PolarHBondContact O-N 2.88Å; L296-A298 VanDerWaalsContact C-N 3.27Å; L296-A298 PolarHBondContact O-N 2.81Å |
| 299 | K | 59.2 | Low | 58.4 | Low | 147 Ų | 147 | 81.9 Ų | 81.9 | 64% | 0.639 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93 | -3.5 | 177.1 | -74.4 | 172.8 | -175.2 | 152 | 0 | 114.1 | E295 L296 A297 | E295-K299 PolarHBondContact O-N 3.3Å; E295-K299 IonicContact OE1-NZ 2.79Å; E295-K299 PolarHBondContact OE1-NZ 3.24Å; L296-K299 PolarHBondContact O-N 3.33Å; A297-K299 PolarHBondContact O-N 3Å |
| 300 | G | 54.1 | Low | 58.5 | Low | 57 Ų | 57 | 83.3 Ų | 83.3 | 59% | 0.588 | 47% | 0.474 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 75.6 | 24.8 | 171.3 | 0 | 0 | 0 | 0 | 0 | 116 | L296 A297 | L296-G300 PolarHBondContact O-N 3.23Å; A297-G300 PolarHBondContact O-N 3.49Å |
| 301 | N | 58 | Low | 59 | Low | 73 Ų | 73 | 82.7 Ų | 82.7 | 39% | 0.39 | 47% | 0.469 | S | S | . | . | trans | -102.8 | 81.3 | 177.2 | -164.3 | 14.9 | 0 | 0 | 0 | 111.5 | T303 E304 | N301-T303 VanDerWaalsContact C-N 3.25Å; N301-T303 PolarHBondContact O-N 2.92Å; N301-E304 PolarHBondContact ND2-OE2 3.35Å | ||
| 302 | D | 59.3 | Low | 59 | Low | 116 Ų | 116 | 78.3 Ų | 78.3 | 62% | 0.62 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -68.6 | -17.6 | -168.3 | -61.1 | -33.5 | 0 | 0 | 0 | 114.5 | V306 | D302-V306 VanDerWaalsContact O-CG2 3.23Å; D302-V306 WeakPolarHBondContact O-CG2 3.4Å; D302-V306 PolarHBondContact O-N 3.21Å |
| 303 | T | 59.2 | Low | 58.6 | Low | 114 Ų | 114 | 81.1 Ų | 81.1 | 70% | 0.699 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -81.3 | -36.2 | -171.5 | -44.9 | 0 | 0 | 0 | 0 | 112.7 | N301 K307 | N301-T303 VanDerWaalsContact C-N 3.25Å; N301-T303 PolarHBondContact O-N 2.92Å; T303-K307 PolarHBondContact O-N 2.89Å |
| 304 | E | 60.7 | Low | 58.9 | Low | 103 Ų | 103 | 86.4 Ų | 86.4 | 48% | 0.481 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -75.4 | -36.9 | 175.3 | -82.3 | 177.7 | 150.5 | 0 | 0 | 112.2 | N301 V306 K307 M308 | N301-E304 PolarHBondContact ND2-OE2 3.35Å; E304-V306 VanDerWaalsContact C-N 3.3Å; E304-V306 PolarHBondContact O-N 3.37Å; E304-K307 PolarHBondContact O-N 3.42Å; E304-M308 PolarHBondContact O-N 3.25Å |
| 305 | A | 57.1 | Low | 59 | Low | 11 Ų | 11 | 86.6 Ų | 86.6 | 9% | 0.091 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -59.9 | -40.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | I293 M308 L309 | I293-A305 HydrophobicContact CG2-CB 4.44Å; A305-M308 PolarHBondContact O-N 3.49Å; A305-L309 VanDerWaalsContact O-CG 3.31Å; A305-L309 WeakPolarHBondContact O-CG 3.41Å; A305-L309 PolarHBondContact O-N 3.18Å |
| 306 | V | 58 | Low | 58.7 | Low | 88 Ų | 88 | 86.1 Ų | 86.1 | 53% | 0.533 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -66.3 | -38.5 | 176 | 172.1 | 0 | 0 | 0 | 0 | 111.8 | D302 E304 L309 V310 | D302-V306 VanDerWaalsContact O-CG2 3.23Å; D302-V306 WeakPolarHBondContact O-CG2 3.4Å; D302-V306 PolarHBondContact O-N 3.21Å; E304-V306 VanDerWaalsContact C-N 3.3Å; E304-V306 PolarHBondContact O-N 3.37Å; V306-L309 PolarHBondContact O-N 3Å; V306-V310 WeakPolarHBondContact O-CG2 3.06Å; V306-V310 PolarHBondContact O-N 3.27Å; V306-V310 VanDerWaalsContact O-N 3.12Å |
| 307 | K | 66.4 | Low | 58.7 | Low | 144 Ų | 144 | 91.6 Ų | 91.6 | 63% | 0.626 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -65.7 | -42.6 | 177.4 | -166.8 | -179.5 | 177 | -170.1 | 0 | 111.6 | T303 E304 V310 E311 | T303-K307 PolarHBondContact O-N 2.89Å; E304-K307 PolarHBondContact O-N 3.42Å; K307-V310 PolarHBondContact O-N 3.04Å; K307-E311 PolarHBondContact O-N 2.73Å; K307-E311 VanDerWaalsContact O-N 3.12Å |
| 308 | M | 58.7 | Low | 59 | Low | 40 Ų | 40 | 93.2 Ų | 93.2 | 20% | 0.197 | 49% | 0.489 | C | S | . | . | H | α-helix | trans | -66.5 | -35.5 | 174.6 | -80.7 | -169 | -97.6 | 0 | 0 | 113.1 | I293 L296 E304 A305 V310 E311 M312 | I293-M308 HydrophobicContact CD1-CB 3.8Å; I293-M308 HydrophobicContact CG1-CB 3.97Å; I293-M308 HydrophobicContact CG1-CE 4.48Å; I293-M308 HydrophobicContact CG1-SD 4.06Å; L296-M308 HydrophobicContact CD1-CE 3.34Å; E304-M308 PolarHBondContact O-N 3.25Å; A305-M308 PolarHBondContact O-N 3.49Å; M308-V310 VanDerWaalsContact C-N 3.29Å; M308-V310 PolarHBondContact O-N 3.46Å; M308-E311 PolarHBondContact O-N 2.91Å; M308-M312 WeakPolarHBondContact O-CB 3.36Å; M308-M312 VanDerWaalsContact O-CG 3.29Å; M308-M312 WeakPolarHBondContact O-CG 3.25Å; M308-M312 PolarHBondContact O-N 3.49Å |
| 309 | L | 55.9 | Low | 58.6 | Low | 89 Ų | 89 | 90.4 Ų | 90.4 | 47% | 0.466 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -64.1 | -32.7 | 173.4 | -76.6 | 171.8 | 0 | 0 | 0 | 113.1 | A305 V306 K313 | A305-L309 VanDerWaalsContact O-CG 3.31Å; A305-L309 WeakPolarHBondContact O-CG 3.41Å; A305-L309 PolarHBondContact O-N 3.18Å; V306-L309 PolarHBondContact O-N 3Å; L309-K313 PolarHBondContact O-N 3.43Å; L309-K313 VanDerWaalsContact O-N 3.11Å |
| 310 | V | 64.1 | Low | 58.1 | Low | 88 Ų | 88 | 89.9 Ų | 89.9 | 53% | 0.533 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -69.3 | -45.3 | 174.1 | 172.8 | 0 | 0 | 0 | 0 | 110.5 | V306 K307 M308 M312 K313 E314 | V306-V310 WeakPolarHBondContact O-CG2 3.06Å; V306-V310 PolarHBondContact O-N 3.27Å; V306-V310 VanDerWaalsContact O-N 3.12Å; K307-V310 PolarHBondContact O-N 3.04Å; M308-V310 VanDerWaalsContact C-N 3.29Å; M308-V310 PolarHBondContact O-N 3.46Å; V310-M312 VanDerWaalsContact C-N 3.33Å; V310-M312 PolarHBondContact O-N 3.01Å; V310-K313 PolarHBondContact O-N 3.35Å; V310-E314 PolarHBondContact O-N 3.03Å; V310-E314 VanDerWaalsContact O-N 3.14Å |
| 311 | E | 65.4 | Low | 58.4 | Low | 80 Ų | 80 | 92.5 Ų | 92.5 | 37% | 0.374 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -61.4 | -39.6 | 174.7 | -74 | 179.3 | -166.9 | 0 | 0 | 112.3 | K289 K307 M308 K313 E314 Q315 | K289-E311 IonicContact NZ-OE2 2.86Å; K307-E311 PolarHBondContact O-N 2.73Å; K307-E311 VanDerWaalsContact O-N 3.12Å; M308-E311 PolarHBondContact O-N 2.91Å; E311-K313 PolarHBondContact O-N 3.29Å; E311-E314 PolarHBondContact O-N 3.04Å; E311-Q315 WeakPolarHBondContact O-CG 3.47Å; E311-Q315 PolarHBondContact O-N 3.48Å |
| 312 | M | 56.9 | Low | 58.3 | Low | 18 Ų | 18 | 91.6 Ų | 91.6 | 9% | 0.089 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -64.1 | -38.7 | 175.7 | -73.3 | -178.3 | 85.5 | 0 | 0 | 112.4 | I286 L290 I293 M308 V310 E314 Q315 Q316 | I286-M312 HydrophobicContact CG2-CE 3.69Å; L290-M312 HydrophobicContact CB-CE 4.17Å; L290-M312 HydrophobicContact CD1-CE 4.14Å; I293-M312 HydrophobicContact CD1-SD 3.36Å; I293-M312 WeakPolarHBondContact CD1-SD 3.39Å; M308-M312 WeakPolarHBondContact O-CB 3.36Å; M308-M312 VanDerWaalsContact O-CG 3.29Å; M308-M312 WeakPolarHBondContact O-CG 3.25Å; M308-M312 PolarHBondContact O-N 3.49Å; V310-M312 VanDerWaalsContact C-N 3.33Å; V310-M312 PolarHBondContact O-N 3.01Å; M312-E314 VanDerWaalsContact C-N 3.28Å; M312-E314 PolarHBondContact O-N 3.31Å; M312-Q315 PolarHBondContact O-N 2.92Å; M312-Q316 WeakPolarHBondContact O-CB 3.19Å; M312-Q316 WeakPolarHBondContact O-CG 3.48Å; M312-Q316 PolarHBondContact O-N 3.39Å |
| 313 | K | 53.5 | Low | 58 | Low | 147 Ų | 147 | 89.3 Ų | 89.3 | 64% | 0.639 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -64.8 | -33.5 | 174.5 | -87.9 | -174.2 | 176.8 | 178 | 0 | 112.5 | L309 V310 E311 K317 | L309-K313 PolarHBondContact O-N 3.43Å; L309-K313 VanDerWaalsContact O-N 3.11Å; V310-K313 PolarHBondContact O-N 3.35Å; E311-K313 PolarHBondContact O-N 3.29Å; K313-K317 PolarHBondContact O-N 3.38Å; K313-K317 VanDerWaalsContact O-N 3.17Å |
| 314 | E | 63.5 | Low | 58.3 | Low | 127 Ų | 127 | 87.1 Ų | 87.1 | 59% | 0.593 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -72.6 | -41.4 | 177 | -165.8 | 149.9 | -154.5 | 0 | 0 | 111.2 | V310 E311 M312 Q316 K317 I318 | V310-E314 PolarHBondContact O-N 3.03Å; V310-E314 VanDerWaalsContact O-N 3.14Å; E311-E314 PolarHBondContact O-N 3.04Å; M312-E314 VanDerWaalsContact C-N 3.28Å; M312-E314 PolarHBondContact O-N 3.31Å; E314-Q316 PolarHBondContact O-N 2.94Å; E314-K317 WeakPolarHBondContact O-CB 3.16Å; E314-K317 PolarHBondContact O-N 2.92Å; E314-I318 WeakPolarHBondContact O-CG1 3.43Å; E314-I318 PolarHBondContact O-N 3.24Å; E314-I318 VanDerWaalsContact O-N 3.16Å |
| 315 | Q | 58.3 | Low | 58.1 | Low | 78 Ų | 78 | 89 Ų | 89 | 36% | 0.364 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -62.5 | -40.5 | 171.7 | -68.5 | -119.6 | -50.1 | 0 | 0 | 112.6 | E311 M312 K317 I318 Q319 | E311-Q315 WeakPolarHBondContact O-CG 3.47Å; E311-Q315 PolarHBondContact O-N 3.48Å; M312-Q315 PolarHBondContact O-N 2.92Å; Q315-K317 VanDerWaalsContact C-N 3.32Å; Q315-K317 PolarHBondContact O-N 3.02Å; Q315-I318 PolarHBondContact O-N 3.36Å; Q315-Q319 WeakPolarHBondContact O-CB 3.29Å; Q315-Q319 PolarHBondContact O-N 3.3Å |
| 316 | Q | 53.5 | Low | 57.6 | Low | 100 Ų | 100 | 89.6 Ų | 89.6 | 47% | 0.467 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -62.4 | -36.8 | 175.1 | -79.2 | -178.8 | -17.8 | 0 | 0 | 112.6 | M312 E314 Q319 Q320 | M312-Q316 WeakPolarHBondContact O-CB 3.19Å; M312-Q316 WeakPolarHBondContact O-CG 3.48Å; M312-Q316 PolarHBondContact O-N 3.39Å; E314-Q316 PolarHBondContact O-N 2.94Å; Q316-Q319 PolarHBondContact O-N 3.42Å; Q316-Q320 WeakPolarHBondContact O-CB 3.46Å; Q316-Q320 PolarHBondContact O-N 3.37Å |
| 317 | K | 57.5 | Low | 57.6 | Low | 157 Ų | 157 | 91.6 Ų | 91.6 | 68% | 0.683 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -64.1 | -45.9 | 174.4 | -84.8 | -177.5 | 175.5 | 179.8 | 0 | 112 | K313 E314 Q315 Q319 Q320 E321 | K313-K317 PolarHBondContact O-N 3.38Å; K313-K317 VanDerWaalsContact O-N 3.17Å; E314-K317 WeakPolarHBondContact O-CB 3.16Å; E314-K317 PolarHBondContact O-N 2.92Å; Q315-K317 VanDerWaalsContact C-N 3.32Å; Q315-K317 PolarHBondContact O-N 3.02Å; K317-Q319 VanDerWaalsContact C-N 3.29Å; K317-Q319 PolarHBondContact O-N 2.8Å; K317-Q320 PolarHBondContact O-N 3.28Å; K317-E321 PolarHBondContact O-N 2.99Å |
| 318 | I | 61.7 | Low | 57.4 | Low | 92 Ų | 92 | 90.4 Ų | 90.4 | 47% | 0.472 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -61.8 | -42 | 177.3 | -64.6 | 168.1 | 0 | 0 | 0 | 109.9 | E314 Q315 Q320 E321 L322 | E314-I318 WeakPolarHBondContact O-CG1 3.43Å; E314-I318 PolarHBondContact O-N 3.24Å; E314-I318 VanDerWaalsContact O-N 3.16Å; Q315-I318 PolarHBondContact O-N 3.36Å; I318-Q320 PolarHBondContact O-N 3.36Å; I318-E321 WeakPolarHBondContact O-CB 3.44Å; I318-E321 PolarHBondContact O-N 3.42Å; I318-L322 HydrophobicContact CG2-CD1 4.34Å; I318-L322 WeakPolarHBondContact O-CG 3.43Å; I318-L322 PolarHBondContact O-N 3.33Å |
| 319 | Q | 50.1 | Low | 57.5 | Low | 30 Ų | 30 | 91.2 Ų | 91.2 | 14% | 0.14 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -62.9 | -42.6 | 176.9 | -168.6 | 175.9 | 6 | 0 | 0 | 112.1 | N283 Q315 Q316 K317 E321 L322 I323 | N283-Q319 PolarHBondContact OD1-NE2 3.32Å; Q315-Q319 WeakPolarHBondContact O-CB 3.29Å; Q315-Q319 PolarHBondContact O-N 3.3Å; Q316-Q319 PolarHBondContact O-N 3.42Å; K317-Q319 VanDerWaalsContact C-N 3.29Å; K317-Q319 PolarHBondContact O-N 2.8Å; Q319-E321 VanDerWaalsContact C-N 3.29Å; Q319-E321 PolarHBondContact O-N 3.11Å; Q319-L322 PolarHBondContact O-N 3.45Å; Q319-I323 HydrophobicContact CG-CD1 4.38Å; Q319-I323 WeakPolarHBondContact O-CG1 3.17Å; Q319-I323 PolarHBondContact O-N 3.34Å |
| 320 | Q | 48.2 | Very low | 57.6 | Low | 135 Ų | 135 | 88.7 Ų | 88.7 | 63% | 0.631 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -65.9 | -34.6 | 177.5 | -157.2 | 156.4 | 8.1 | 0 | 0 | 111.6 | Q316 K317 I318 I323 V324 | Q316-Q320 WeakPolarHBondContact O-CB 3.46Å; Q316-Q320 PolarHBondContact O-N 3.37Å; K317-Q320 PolarHBondContact O-N 3.28Å; I318-Q320 PolarHBondContact O-N 3.36Å; Q320-I323 PolarHBondContact O-N 3.15Å; Q320-V324 VanDerWaalsContact O-CG2 3.31Å; Q320-V324 WeakPolarHBondContact O-CG2 3.4Å; Q320-V324 PolarHBondContact O-N 3.24Å; Q320-V324 VanDerWaalsContact O-N 3.09Å |
| 321 | E | 60.5 | Low | 57.4 | Low | 113 Ų | 113 | 87.2 Ų | 87.2 | 53% | 0.528 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -67.4 | -37.7 | 172.9 | -161.4 | 178.5 | 167.5 | 0 | 0 | 112.5 | K317 I318 Q319 V324 R325 | K317-E321 PolarHBondContact O-N 2.99Å; I318-E321 WeakPolarHBondContact O-CB 3.44Å; I318-E321 PolarHBondContact O-N 3.42Å; Q319-E321 VanDerWaalsContact C-N 3.29Å; Q319-E321 PolarHBondContact O-N 3.11Å; E321-V324 PolarHBondContact O-N 3.28Å; E321-R325 PolarHBondContact O-N 3.16Å |
| 322 | L | 54.6 | Low | 57.1 | Low | 54 Ų | 54 | 90.2 Ų | 90.2 | 28% | 0.283 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -67.2 | -39.2 | 175.2 | -69.8 | 173 | 0 | 0 | 0 | 112.5 | L275 I318 Q319 R325 Q326 | L275-L322 HydrophobicContact CD1-CD2 4.22Å; I318-L322 HydrophobicContact CG2-CD1 4.34Å; I318-L322 WeakPolarHBondContact O-CG 3.43Å; I318-L322 PolarHBondContact O-N 3.33Å; Q319-L322 PolarHBondContact O-N 3.45Å; L322-R325 PolarHBondContact O-N 3.46Å; L322-Q326 PolarHBondContact O-N 3.13Å |
| 323 | I | 54.7 | Low | 56.7 | Low | 68 Ų | 68 | 92.2 Ų | 92.2 | 35% | 0.349 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -63.4 | -45 | 175 | -67.5 | 164.7 | 0 | 0 | 0 | 110.4 | Q319 Q320 R325 Q326 E327 | Q319-I323 HydrophobicContact CG-CD1 4.38Å; Q319-I323 WeakPolarHBondContact O-CG1 3.17Å; Q319-I323 PolarHBondContact O-N 3.34Å; Q320-I323 PolarHBondContact O-N 3.15Å; I323-R325 VanDerWaalsContact C-N 3.28Å; I323-R325 PolarHBondContact O-N 3.44Å; I323-Q326 WeakPolarHBondContact O-CB 3.48Å; I323-Q326 PolarHBondContact O-N 3.37Å; I323-Q326 VanDerWaalsContact O-N 3.11Å; I323-E327 PolarHBondContact O-N 3.19Å |
| 324 | V | 64.4 | Low | 57 | Low | 67 Ų | 67 | 88.9 Ų | 88.9 | 41% | 0.406 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -61.1 | -37.6 | 175.8 | 170.8 | 0 | 0 | 0 | 0 | 111.4 | Q320 E321 E327 Q328 | Q320-V324 VanDerWaalsContact O-CG2 3.31Å; Q320-V324 WeakPolarHBondContact O-CG2 3.4Å; Q320-V324 PolarHBondContact O-N 3.24Å; Q320-V324 VanDerWaalsContact O-N 3.09Å; E321-V324 PolarHBondContact O-N 3.28Å; V324-E327 PolarHBondContact O-N 3.02Å; V324-Q328 WeakPolarHBondContact O-CG 3.41Å; V324-Q328 PolarHBondContact O-N 3.5Å; V324-Q328 VanDerWaalsContact O-N 3.07Å |
| 325 | R | 57.8 | Low | 57.1 | Low | 143 Ų | 143 | 89.6 Ų | 89.6 | 54% | 0.54 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -66.4 | -38.7 | 173.7 | -76.2 | -166.5 | -172.3 | -169.9 | 5.7 | 112.7 | E321 L322 I323 Q328 I329 | E321-R325 PolarHBondContact O-N 3.16Å; L322-R325 PolarHBondContact O-N 3.46Å; I323-R325 VanDerWaalsContact C-N 3.28Å; I323-R325 PolarHBondContact O-N 3.44Å; R325-Q328 PolarHBondContact O-N 2.78Å; R325-I329 VanDerWaalsContact O-CG1 3.32Å; R325-I329 WeakPolarHBondContact O-CG1 3.42Å; R325-I329 PolarHBondContact O-N 3.04Å |
| 326 | Q | 46.3 | Very low | 57.1 | Low | 24 Ų | 24 | 91.8 Ų | 91.8 | 11% | 0.112 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -61.3 | -45 | 173.9 | -79.6 | -176.3 | -19.4 | 0 | 0 | 111.4 | L275 L322 I323 Q328 I329 V330 | L275-Q326 HydrophobicContact CD2-CG 3.62Å; L275-Q326 HydrophobicContact CG-CG 4.46Å; L322-Q326 PolarHBondContact O-N 3.13Å; I323-Q326 WeakPolarHBondContact O-CB 3.48Å; I323-Q326 PolarHBondContact O-N 3.37Å; I323-Q326 VanDerWaalsContact O-N 3.11Å; Q326-Q328 VanDerWaalsContact C-N 3.29Å; Q326-Q328 PolarHBondContact O-N 3.31Å; Q326-I329 PolarHBondContact O-N 2.92Å; Q326-V330 WeakPolarHBondContact O-CG2 3.33Å; Q326-V330 PolarHBondContact O-N 3.42Å |
| 327 | E | 57.6 | Low | 57.2 | Low | 129 Ų | 129 | 90.1 Ų | 90.1 | 60% | 0.603 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -58.9 | -41.1 | 176 | -71.7 | -179.7 | 167 | 0 | 0 | 112 | I323 V324 V330 A331 | I323-E327 PolarHBondContact O-N 3.19Å; V324-E327 PolarHBondContact O-N 3.02Å; E327-V330 PolarHBondContact O-N 3.42Å; E327-A331 WeakPolarHBondContact O-CB 3.48Å; E327-A331 PolarHBondContact O-N 2.96Å |
| 328 | Q | 62.8 | Low | 57.2 | Low | 119 Ų | 119 | 88.8 Ų | 88.8 | 56% | 0.556 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -64.9 | -42 | 176.6 | -74.2 | 177.3 | -12.1 | 0 | 0 | 112.6 | V324 R325 Q326 A331 Q332 | V324-Q328 WeakPolarHBondContact O-CG 3.41Å; V324-Q328 PolarHBondContact O-N 3.5Å; V324-Q328 VanDerWaalsContact O-N 3.07Å; R325-Q328 PolarHBondContact O-N 2.78Å; Q326-Q328 VanDerWaalsContact C-N 3.29Å; Q326-Q328 PolarHBondContact O-N 3.31Å; Q328-A331 PolarHBondContact O-N 3.24Å; Q328-Q332 WeakPolarHBondContact O-CG 3.42Å; Q328-Q332 PolarHBondContact O-N 3.02Å |
| 329 | I | 59.8 | Low | 57.2 | Low | 58 Ų | 58 | 89.5 Ų | 89.5 | 30% | 0.297 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -65.3 | -44.7 | 177.8 | -69.3 | 166.2 | 0 | 0 | 0 | 110.3 | R325 Q326 A331 Q332 L333 | R325-I329 VanDerWaalsContact O-CG1 3.32Å; R325-I329 WeakPolarHBondContact O-CG1 3.42Å; R325-I329 PolarHBondContact O-N 3.04Å; Q326-I329 PolarHBondContact O-N 2.92Å; I329-A331 VanDerWaalsContact C-N 3.33Å; I329-A331 PolarHBondContact O-N 3.33Å; I329-Q332 PolarHBondContact O-N 3.45Å; I329-L333 HydrophobicContact CG2-CD1 3.84Å; I329-L333 PolarHBondContact O-N 2.94Å |
| 330 | V | 57.2 | Low | 57.2 | Low | 36 Ų | 36 | 93.3 Ų | 93.3 | 22% | 0.218 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -62 | -41.3 | 176.2 | 171.8 | 0 | 0 | 0 | 0 | 111.3 | Q326 E327 Q332 L333 N334 | Q326-V330 WeakPolarHBondContact O-CG2 3.33Å; Q326-V330 PolarHBondContact O-N 3.42Å; E327-V330 PolarHBondContact O-N 3.42Å; V330-Q332 VanDerWaalsContact C-N 3.34Å; V330-Q332 PolarHBondContact O-N 3.45Å; V330-L333 PolarHBondContact O-N 3.39Å; V330-N334 WeakPolarHBondContact O-CB 3.26Å; V330-N334 PolarHBondContact O-N 3.49Å |
| 331 | A | 61.8 | Low | 57.2 | Low | 57 Ų | 57 | 89.5 Ų | 89.5 | 47% | 0.471 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -63.9 | -38.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | E327 Q328 I329 K335 | E327-A331 WeakPolarHBondContact O-CB 3.48Å; E327-A331 PolarHBondContact O-N 2.96Å; Q328-A331 PolarHBondContact O-N 3.24Å; I329-A331 VanDerWaalsContact C-N 3.33Å; I329-A331 PolarHBondContact O-N 3.33Å; A331-K335 VanDerWaalsContact O-CB 3.31Å; A331-K335 WeakPolarHBondContact O-CB 3.29Å; A331-K335 PolarHBondContact O-N 3.39Å |
| 332 | Q | 57.2 | Low | 56.6 | Low | 143 Ų | 143 | 89.3 Ų | 89.3 | 67% | 0.668 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -65.9 | -42.6 | 174.2 | -74.8 | -169.1 | -7.1 | 0 | 0 | 112 | Q328 I329 V330 K335 K336 | Q328-Q332 WeakPolarHBondContact O-CG 3.42Å; Q328-Q332 PolarHBondContact O-N 3.02Å; I329-Q332 PolarHBondContact O-N 3.45Å; V330-Q332 VanDerWaalsContact C-N 3.34Å; V330-Q332 PolarHBondContact O-N 3.45Å; Q332-K335 PolarHBondContact O-N 2.95Å; Q332-K336 VanDerWaalsContact O-CB 3.25Å; Q332-K336 WeakPolarHBondContact O-CB 3.45Å; Q332-K336 PolarHBondContact O-N 2.84Å |
| 333 | L | 50.4 | Low | 56.4 | Low | 59 Ų | 59 | 89.5 Ų | 89.5 | 31% | 0.309 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -61.9 | -45.1 | 175.4 | -92.5 | 143.8 | 0 | 0 | 0 | 111.9 | I329 V330 K336 S337 | I329-L333 HydrophobicContact CG2-CD1 3.84Å; I329-L333 PolarHBondContact O-N 2.94Å; V330-L333 PolarHBondContact O-N 3.39Å; L333-K336 PolarHBondContact O-N 3.47Å; L333-S337 WeakPolarHBondContact O-CB 3.46Å; L333-S337 PolarHBondContact O-N 3.28Å |
| 334 | N | 58.9 | Low | 55.9 | Low | 78 Ų | 78 | 91.2 Ų | 91.2 | 42% | 0.417 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -62.8 | -46.8 | 176.7 | -78.5 | -16.9 | 0 | 0 | 0 | 111.3 | V330 K336 S337 E338 | V330-N334 WeakPolarHBondContact O-CB 3.26Å; V330-N334 PolarHBondContact O-N 3.49Å; N334-K336 VanDerWaalsContact C-N 3.33Å; N334-K336 PolarHBondContact O-N 2.91Å; N334-S337 PolarHBondContact O-N 3.16Å; N334-S337 PolarHBondContact O-OG 3.44Å; N334-E338 PolarHBondContact O-N 3.45Å |
| 335 | K | 65.3 | Low | 54.9 | Low | 141 Ų | 141 | 91.9 Ų | 91.9 | 61% | 0.613 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -63.3 | -38.7 | 177.9 | -166.1 | 174.2 | -175.3 | 177 | 0 | 112.2 | A331 Q332 E338 I339 | A331-K335 VanDerWaalsContact O-CB 3.31Å; A331-K335 WeakPolarHBondContact O-CB 3.29Å; A331-K335 PolarHBondContact O-N 3.39Å; Q332-K335 PolarHBondContact O-N 2.95Å; K335-E338 PolarHBondContact O-N 2.91Å; K335-I339 HydrophobicContact CG-CD1 4.21Å; K335-I339 WeakPolarHBondContact O-CD1 3.14Å; K335-I339 WeakPolarHBondContact O-CG1 3.33Å; K335-I339 PolarHBondContact O-N 2.97Å |
| 336 | K | 59.2 | Low | 53.9 | Low | 124 Ų | 124 | 92.8 Ų | 92.8 | 54% | 0.539 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -68.7 | -37.4 | 175.7 | -164.1 | 175.6 | -178.2 | -176.5 | 0 | 111.1 | Q332 L333 N334 I339 L340 | Q332-K336 VanDerWaalsContact O-CB 3.25Å; Q332-K336 WeakPolarHBondContact O-CB 3.45Å; Q332-K336 PolarHBondContact O-N 2.84Å; L333-K336 PolarHBondContact O-N 3.47Å; N334-K336 VanDerWaalsContact C-N 3.33Å; N334-K336 PolarHBondContact O-N 2.91Å; K336-I339 PolarHBondContact O-N 3.16Å; K336-L340 WeakPolarHBondContact O-CB 3.34Å; K336-L340 PolarHBondContact O-N 2.96Å |
| 337 | S | 54.7 | Low | 53.3 | Low | 66 Ų | 66 | 94.5 Ų | 94.5 | 46% | 0.462 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -65.6 | -38.2 | 173.8 | 81.4 | 0 | 0 | 0 | 0 | 112.4 | L333 N334 L340 A341 | L333-S337 WeakPolarHBondContact O-CB 3.46Å; L333-S337 PolarHBondContact O-N 3.28Å; N334-S337 PolarHBondContact O-N 3.16Å; N334-S337 PolarHBondContact O-OG 3.44Å; S337-L340 PolarHBondContact O-N 3.41Å; S337-A341 WeakPolarHBondContact O-CB 3.33Å; S337-A341 PolarHBondContact O-N 3.19Å |
| 338 | E | 57.9 | Low | 52.1 | Low | 129 Ų | 129 | 97.8 Ų | 97.8 | 60% | 0.603 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -68.8 | -41.4 | 174.8 | -78 | -176.5 | 152.3 | 0 | 0 | 112 | N334 K335 L340 A341 N342 | N334-E338 PolarHBondContact O-N 3.45Å; K335-E338 PolarHBondContact O-N 2.91Å; E338-L340 VanDerWaalsContact C-N 3.32Å; E338-A341 PolarHBondContact O-N 3.34Å; E338-N342 WeakPolarHBondContact O-CB 3.2Å; E338-N342 PolarHBondContact O-N 3.37Å |
| 339 | I | 60.7 | Low | 50.5 | Low | 107 Ų | 107 | 96.3 Ų | 96.3 | 55% | 0.549 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -63.5 | -41.6 | 175.2 | -68.8 | 163.4 | 0 | 0 | 0 | 110.4 | K335 K336 N342 A343 | K335-I339 HydrophobicContact CG-CD1 4.21Å; K335-I339 WeakPolarHBondContact O-CD1 3.14Å; K335-I339 WeakPolarHBondContact O-CG1 3.33Å; K335-I339 PolarHBondContact O-N 2.97Å; K336-I339 PolarHBondContact O-N 3.16Å; I339-N342 PolarHBondContact O-N 2.96Å; I339-A343 WeakPolarHBondContact O-CB 3.2Å; I339-A343 PolarHBondContact O-N 3.45Å |
| 340 | L | 51.5 | Low | 48.9 | Very low | 109 Ų | 109 | 98 Ų | 98 | 57% | 0.571 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -70.2 | -38 | 178.6 | -142.3 | 136.5 | 0 | 0 | 0 | 111.1 | K336 S337 E338 A343 T344 | K336-L340 WeakPolarHBondContact O-CB 3.34Å; K336-L340 PolarHBondContact O-N 2.96Å; S337-L340 PolarHBondContact O-N 3.41Å; E338-L340 VanDerWaalsContact C-N 3.32Å; L340-A343 PolarHBondContact O-N 3Å; L340-T344 PolarHBondContact O-N 3.27Å; L340-T344 PolarHBondContact O-OG1 3.08Å |
| 341 | A | 47.8 | Very low | 47.4 | Very low | 55 Ų | 55 | 101.8 Ų | 101.8 | 46% | 0.455 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -62.4 | -43.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | S337 E338 T344 A345 | S337-A341 WeakPolarHBondContact O-CB 3.33Å; S337-A341 PolarHBondContact O-N 3.19Å; E338-A341 PolarHBondContact O-N 3.34Å; A341-T344 WeakPolarHBondContact CA-OG1 3.3Å; A341-T344 PolarHBondContact O-N 3.33Å; A341-T344 PolarHBondContact O-OG1 3.49Å; A341-A345 PolarHBondContact O-N 3.5Å; A341-A345 VanDerWaalsContact O-N 3.1Å |
| 342 | N | 48.5 | Very low | 45.7 | Very low | 109 Ų | 109 | 107.9 Ų | 107.9 | 58% | 0.583 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -68.7 | -35.1 | 175.3 | -75.2 | -8.9 | 0 | 0 | 0 | 112.2 | E338 I339 A345 E346 | E338-N342 WeakPolarHBondContact O-CB 3.2Å; E338-N342 PolarHBondContact O-N 3.37Å; I339-N342 PolarHBondContact O-N 2.96Å; N342-A345 WeakPolarHBondContact O-CB 3.44Å; N342-A345 PolarHBondContact O-N 2.84Å; N342-A345 VanDerWaalsContact O-N 3.12Å; N342-E346 PolarHBondContact O-N 3.44Å; N342-E346 VanDerWaalsContact O-N 3.09Å |
| 343 | A | 50.6 | Low | 44.2 | Very low | 58 Ų | 58 | 105.7 Ų | 105.7 | 48% | 0.479 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -66.4 | -35.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | I339 L340 A345 E346 G347 | I339-A343 WeakPolarHBondContact O-CB 3.2Å; I339-A343 PolarHBondContact O-N 3.45Å; L340-A343 PolarHBondContact O-N 3Å; A343-A345 VanDerWaalsContact C-N 3.31Å; A343-E346 PolarHBondContact O-N 2.87Å; A343-G347 PolarHBondContact O-N 2.99Å; A343-G347 VanDerWaalsContact O-N 3.08Å |
| 344 | T | 43.9 | Very low | 42.9 | Very low | 105 Ų | 105 | 107.4 Ų | 107.4 | 64% | 0.644 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -70.5 | -23.5 | 169.6 | 24.3 | 0 | 0 | 0 | 0 | 113.6 | L340 A341 | L340-T344 PolarHBondContact O-N 3.27Å; L340-T344 PolarHBondContact O-OG1 3.08Å; A341-T344 WeakPolarHBondContact CA-OG1 3.3Å; A341-T344 PolarHBondContact O-N 3.33Å; A341-T344 PolarHBondContact O-OG1 3.49Å |
| 345 | A | 42.2 | Very low | 41.3 | Very low | 80 Ų | 80 | 113.3 Ų | 113.3 | 66% | 0.661 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -79.2 | -26.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | A341 N342 A343 | A341-A345 PolarHBondContact O-N 3.5Å; A341-A345 VanDerWaalsContact O-N 3.1Å; N342-A345 WeakPolarHBondContact O-CB 3.44Å; N342-A345 PolarHBondContact O-N 2.84Å; N342-A345 VanDerWaalsContact O-N 3.12Å; A343-A345 VanDerWaalsContact C-N 3.31Å |
| 346 | E | 37.4 | Very low | 39.6 | Very low | 162 Ų | 162 | 114.2 Ų | 114.2 | 76% | 0.757 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -94.9 | -6.2 | 175.1 | -67.3 | -174.4 | 159.3 | 0 | 0 | 113.3 | N342 A343 E348 A349 | N342-E346 PolarHBondContact O-N 3.44Å; N342-E346 VanDerWaalsContact O-N 3.09Å; A343-E346 PolarHBondContact O-N 2.87Å; E346-E348 PolarHBondContact O-N 2.86Å; E346-A349 PolarHBondContact O-N 2.72Å |
| 347 | G | 34.2 | Very low | 38.1 | Very low | 60 Ų | 60 | 114.1 Ų | 114.1 | 62% | 0.619 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.8 | -2.5 | -175.6 | 0 | 0 | 0 | 0 | 0 | 117.2 | A343 | A343-G347 PolarHBondContact O-N 2.99Å; A343-G347 VanDerWaalsContact O-N 3.08Å |
| 348 | E | 31.3 | Very low | 36.7 | Very low | 199 Ų | 199 | 118.2 Ų | 118.2 | 93% | 0.93 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.1 | 3.2 | 171 | -89.5 | -172.4 | 155.5 | 0 | 0 | 113.8 | E346 | E346-E348 PolarHBondContact O-N 2.86Š|
| 349 | A | 29.9 | Very low | 35.2 | Very low | 87 Ų | 87 | 120.4 Ų | 120.4 | 72% | 0.719 | 71% | 0.713 | S | S | * | * | S | Bend | trans | -141.8 | 64.9 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | E346 | E346-A349 PolarHBondContact O-N 2.72Š|
| 350 | A | 26.5 | Very low | 33.5 | Very low | 95 Ų | 95 | 123.9 Ų | 123.9 | 79% | 0.785 | 73% | 0.731 | S | S | * | * | trans | 163.6 | 109.2 | 137.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 351 | S | 26.2 | Very low | 32.4 | Very low | 114 Ų | 114 | 122.6 Ų | 122.6 | 80% | 0.797 | 74% | 0.736 | S | S | * | * | trans | -69.9 | 145.2 | 152.6 | 173.7 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 352 | E | 26.4 | Very low | 31.5 | Very low | 186 Ų | 186 | 125.8 Ų | 125.8 | 87% | 0.869 | 75% | 0.753 | S | S | * | * | trans | 89.7 | 92.8 | 154.7 | -148.6 | 165.2 | -161.1 | 0 | 0 | 118.1 | ||||
| 353 | A | 23.8 | Very low | 30.5 | Very low | 96 Ų | 96 | 126.2 Ų | 126.2 | 79% | 0.793 | 76% | 0.761 | S | S | * | * | -179.7 | 106 | 129.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 354 | A | 24.8 | Very low | 29.7 | Very low | 96 Ų | 96 | 132 Ų | 132 | 79% | 0.793 | 78% | 0.778 | S | S | * | * | trans | 59 | 131.8 | 133.2 | 0 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 355 | K | 24 | Very low | 29.3 | Very low | 202 Ų | 202 | 132.8 Ų | 132.8 | 88% | 0.878 | 78% | 0.778 | S | S | * | * | trans | 89.7 | 108.6 | 141.2 | -98.7 | 174 | 176.5 | 178.5 | 0 | 120.1 | ||||
| 356 | I | 30.2 | Very low | 29 | Very low | 160 Ų | 160 | 134.7 Ų | 134.7 | 82% | 0.821 | 78% | 0.782 | S | S | * | * | trans | -61.7 | 144.1 | 151.5 | -58.5 | 164.1 | 0 | 0 | 0 | 109.3 | ||||
| 357 | P | 27.5 | Very low | 28.9 | Very low | 121 Ų | 121 | 134.3 Ų | 134.3 | 79% | 0.786 | 78% | 0.78 | S | S | * | * | -133.8 | 132.1 | 128 | 31.8 | -16.8 | 0 | 0 | 0 | 114.8 | |||||
| 358 | E | 25.9 | Very low | 28.9 | Very low | 153 Ų | 153 | 135.5 Ų | 135.5 | 72% | 0.715 | 78% | 0.775 | S | S | * | * | trans | 0.7 | 138.1 | 146.9 | -148.4 | 178.7 | 155.8 | 0 | 0 | 122.5 | ||||
| 359 | K | 26.6 | Very low | 29.1 | Very low | 175 Ų | 175 | 133.1 Ų | 133.1 | 76% | 0.761 | 77% | 0.766 | S | S | * | * | trans | 63.4 | 120.4 | 150 | -92.8 | 172.8 | -179.6 | 158.6 | 0 | 121.2 | ||||
| 360 | L | 24.5 | Very low | 29.5 | Very low | 180 Ų | 180 | 134.3 Ų | 134.3 | 94% | 0.942 | 76% | 0.757 | S | S | * | * | trans | -142.3 | 131.4 | 136.1 | -142.2 | 75.6 | 0 | 0 | 0 | 109.8 | ||||
| 361 | A | 27.4 | Very low | 30 | Very low | 82 Ų | 82 | 137.3 Ų | 137.3 | 68% | 0.678 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 156.9 | -172.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 362 | P | 28.7 | Very low | 30.5 | Very low | 122 Ų | 122 | 138.8 Ų | 138.8 | 79% | 0.792 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 136.5 | 171.2 | 28.1 | -31.4 | 0 | 0 | 0 | 110.1 | E364 | P362-E364 PolarHBondContact O-N 3.39Š|
| 363 | P | 29.4 | Very low | 31.1 | Very low | 118 Ų | 118 | 132 Ų | 132 | 77% | 0.766 | 73% | 0.727 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 123.8 | 172.7 | 25.9 | -29.3 | 0 | 0 | 0 | 110.6 | N365 | P363-N365 PolarHBondContact O-N 3.2Š|
| 364 | E | 33.8 | Very low | 31.8 | Very low | 178 Ų | 178 | 133.9 Ų | 133.9 | 83% | 0.832 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -37.7 | 124.6 | 153.5 | -86.9 | 170.4 | 125.8 | 0 | 0 | 110 | P362 | P362-E364 PolarHBondContact O-N 3.39Š|
| 365 | N | 34.5 | Very low | 32.4 | Very low | 122 Ų | 122 | 132.2 Ų | 132.2 | 65% | 0.652 | 70% | 0.703 | S | S | * | * | trans | 162.2 | 2.5 | 152.6 | -80.7 | -22.4 | 0 | 0 | 0 | 113.3 | P363 | P363-N365 PolarHBondContact O-N 3.2Š| ||
| 366 | V | 36 | Very low | 33.1 | Very low | 121 Ų | 121 | 125.1 Ų | 125.1 | 73% | 0.733 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -77.1 | -29.2 | 176.5 | -175.3 | 0 | 0 | 0 | 0 | 112.3 | ||
| 367 | E | 35.2 | Very low | 33.6 | Very low | 154 Ų | 154 | 120.1 Ų | 120.1 | 72% | 0.72 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -80.1 | -19.7 | -178.4 | -72 | -171.2 | 160.1 | 0 | 0 | 114.5 | ||
| 368 | T | 34.9 | Very low | 34.3 | Very low | 84 Ų | 84 | 121.5 Ų | 121.5 | 52% | 0.515 | 66% | 0.661 | S | S | . | * | H | α-helix | trans | -81.8 | -33.7 | -176 | -10.3 | 0 | 0 | 0 | 0 | 112.1 | E372 | T368-E372 PolarHBondContact O-N 3.15Å |
| 369 | M | 34.2 | Very low | 34.9 | Very low | 150 Ų | 150 | 117.9 Ų | 117.9 | 74% | 0.739 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -78.7 | -25.9 | 177 | -70.7 | -168.9 | 174.1 | 0 | 0 | 113.3 | K371 E372 G373 | M369-K371 VanDerWaalsContact C-N 3.28Å; M369-K371 PolarHBondContact O-N 3.49Å; M369-E372 PolarHBondContact O-N 2.94Å; M369-G373 PolarHBondContact O-N 3.35Å; M369-G373 VanDerWaalsContact O-N 3.09Å |
| 370 | E | 38.4 | Very low | 35.7 | Very low | 112 Ų | 112 | 116.3 Ų | 116.3 | 52% | 0.523 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -70.3 | -26.9 | 175.5 | -133.2 | -160.3 | 125.8 | 0 | 0 | 112.4 | K374 | E370-K374 PolarHBondContact O-N 3.38Å; E370-K374 IonicContact OE1-NZ 3.5Å; E370-K374 PolarHBondContact OE1-NZ 2.95Å |
| 371 | K | 37.7 | Very low | 36.5 | Very low | 157 Ų | 157 | 115.6 Ų | 115.6 | 68% | 0.683 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -79.6 | -35.3 | 175.7 | -75.9 | -180 | 179.8 | 170 | 0 | 112.9 | M369 A375 | M369-K371 VanDerWaalsContact C-N 3.28Å; M369-K371 PolarHBondContact O-N 3.49Å; K371-A375 PolarHBondContact O-N 3.48Å |
| 372 | E | 36.3 | Very low | 37.1 | Very low | 145 Ų | 145 | 119.6 Ų | 119.6 | 68% | 0.678 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -72.7 | -36.8 | 175.7 | -72.1 | -174.5 | 155.2 | 0 | 0 | 112.1 | T368 M369 A375 A376 | T368-E372 PolarHBondContact O-N 3.15Å; M369-E372 PolarHBondContact O-N 2.94Å; E372-A375 PolarHBondContact O-N 2.91Å; E372-A376 PolarHBondContact O-N 2.89Å |
| 373 | G | 38.7 | Very low | 37.8 | Very low | 45 Ų | 45 | 117 Ų | 117 | 46% | 0.464 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -66.9 | -36.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | M369 A377 | M369-G373 PolarHBondContact O-N 3.35Å; M369-G373 VanDerWaalsContact O-N 3.09Å; G373-A377 PolarHBondContact O-N 3.14Å |
| 374 | K | 39 | Very low | 38.5 | Very low | 135 Ų | 135 | 116.6 Ų | 116.6 | 59% | 0.587 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -72.1 | -33 | 175.8 | -82 | 170 | 175.6 | 152.8 | 0 | 112.7 | E370 E378 | E370-K374 PolarHBondContact O-N 3.38Å; E370-K374 IonicContact OE1-NZ 3.5Å; E370-K374 PolarHBondContact OE1-NZ 2.95Å; K374-E378 PolarHBondContact O-N 3.32Å |
| 375 | A | 37.6 | Very low | 38.8 | Very low | 60 Ų | 60 | 114.5 Ų | 114.5 | 50% | 0.496 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -71.2 | -34.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113 | K371 E372 S379 | K371-A375 PolarHBondContact O-N 3.48Å; E372-A375 PolarHBondContact O-N 2.91Å; A375-S379 PolarHBondContact O-N 3.15Å |
| 376 | A | 38.8 | Very low | 39.2 | Very low | 54 Ų | 54 | 114.3 Ų | 114.3 | 45% | 0.446 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -71 | -37.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | E372 E378 S379 E380 | E372-A376 PolarHBondContact O-N 2.89Å; A376-E378 VanDerWaalsContact C-N 3.31Å; A376-E378 PolarHBondContact O-N 2.68Å; A376-S379 PolarHBondContact O-N 3.32Å; A376-S379 PolarHBondContact O-OG 3.07Å; A376-E380 PolarHBondContact O-N 2.83Å |
| 377 | A | 40.7 | Very low | 39.6 | Very low | 55 Ų | 55 | 117 Ų | 117 | 46% | 0.455 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -70.1 | -24.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | G373 | G373-A377 PolarHBondContact O-N 3.14Å |
| 378 | E | 42 | Very low | 39.8 | Very low | 149 Ų | 149 | 119.1 Ų | 119.1 | 70% | 0.696 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -81.7 | -28 | 175.3 | -106.8 | -176.1 | 164.9 | 0 | 0 | 113.5 | K374 A376 K382 | K374-E378 PolarHBondContact O-N 3.32Å; A376-E378 VanDerWaalsContact C-N 3.31Å; A376-E378 PolarHBondContact O-N 2.68Å; E378-K382 PolarHBondContact O-N 2.84Å |
| 379 | S | 39.1 | Very low | 40 | Very low | 77 Ų | 77 | 120.9 Ų | 120.9 | 54% | 0.538 | 66% | 0.656 | S | S | . | * | H | α-helix | trans | -73.7 | -33.5 | 174.4 | 68.1 | 0 | 0 | 0 | 0 | 111.8 | A375 A376 K382 A383 | A375-S379 PolarHBondContact O-N 3.15Å; A376-S379 PolarHBondContact O-N 3.32Å; A376-S379 PolarHBondContact O-OG 3.07Å; S379-K382 PolarHBondContact O-N 2.76Å; S379-A383 PolarHBondContact O-N 3.33Å; S379-A383 VanDerWaalsContact O-N 3.17Å |
| 380 | E | 43 | Very low | 40.3 | Very low | 142 Ų | 142 | 119.4 Ų | 119.4 | 66% | 0.664 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -69.5 | -37 | 177.6 | -140.2 | 174.7 | 154.5 | 0 | 0 | 112.5 | A376 K382 A383 V384 | A376-E380 PolarHBondContact O-N 2.83Å; E380-K382 PolarHBondContact O-N 3.3Å; E380-A383 PolarHBondContact O-N 3.19Å; E380-V384 WeakPolarHBondContact O-CG2 3.45Å; E380-V384 PolarHBondContact O-N 3.14Å |
| 381 | K | 41.4 | Very low | 40.4 | Very low | 165 Ų | 165 | 119.8 Ų | 119.8 | 72% | 0.717 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -71 | -24.7 | 174.2 | -82.5 | -177.7 | 177.5 | 177.8 | 0 | 114.3 | ||
| 382 | K | 40.1 | Very low | 40.6 | Very low | 166 Ų | 166 | 117.6 Ų | 117.6 | 72% | 0.722 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -80.9 | -31.6 | 174 | -91.4 | -178.4 | 176.6 | 174.6 | 0 | 112.7 | E378 S379 E380 T386 | E378-K382 PolarHBondContact O-N 2.84Å; S379-K382 PolarHBondContact O-N 2.76Å; E380-K382 PolarHBondContact O-N 3.3Å; K382-T386 PolarHBondContact O-OG1 2.81Å |
| 383 | A | 42.6 | Very low | 40.9 | Very low | 68 Ų | 68 | 115.9 Ų | 115.9 | 56% | 0.562 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -68.2 | -38 | 177 | 0 | 0 | 0 | 0 | 0 | 112.3 | S379 E380 N385 | S379-A383 PolarHBondContact O-N 3.33Å; S379-A383 VanDerWaalsContact O-N 3.17Å; E380-A383 PolarHBondContact O-N 3.19Å; A383-N385 PolarHBondContact O-N 3.14Å |
| 384 | V | 43.8 | Very low | 41 | Very low | 109 Ų | 109 | 120.6 Ų | 120.6 | 66% | 0.661 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -72.6 | -24.9 | -179.3 | 174.8 | 0 | 0 | 0 | 0 | 113.6 | E380 | E380-V384 WeakPolarHBondContact O-CG2 3.45Å; E380-V384 PolarHBondContact O-N 3.14Å |
| 385 | N | 40.5 | Very low | 41.1 | Very low | 134 Ų | 134 | 119.6 Ų | 119.6 | 72% | 0.717 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.8 | 6.1 | -179.7 | -88.6 | -1 | 0 | 0 | 0 | 114.7 | A383 | A383-N385 PolarHBondContact O-N 3.14Š|
| 386 | T | 42.7 | Very low | 41.4 | Very low | 119 Ų | 119 | 124.2 Ų | 124.2 | 73% | 0.73 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.2 | -0.1 | 178.7 | -31.3 | 0 | 0 | 0 | 0 | 113.1 | K382 | K382-T386 PolarHBondContact O-OG1 2.81Š|
| 387 | E | 43.9 | Very low | 41.6 | Very low | 178 Ų | 178 | 130 Ų | 130 | 83% | 0.832 | 71% | 0.709 | S | S | * | * | trans | -119.1 | 70.1 | 170 | -70 | -172.8 | 151.5 | 0 | 0 | 109.9 | ||||
| 388 | T | 39.8 | Very low | 41.7 | Very low | 198 Ų | 198 | 136.8 Ų | 136.8 | 100% | 1.215 | 73% | 0.732 | S | S | * | * | trans | -137.6 | 0 | 153.5 | 8.6 | 0 | 0 | 0 | 0 | 110.1 |
Retrieved 388 of 388 residues in 69.8 ms
(Link to these results)