| 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 | 83.1 | Confident | 91.1 | Very high | 106 Ų | 106 | 38.5 Ų | 38.5 | 52% | 0.522 | 20% | 0.195 | S | C | . | . | 0 | -64.2 | 0 | -60 | -46.3 | -83.1 | 0 | 0 | 113.4 | M3 I4 S5 F156 | M1-M3 VanDerWaalsContact C-N 3.31Å; M1-M3 PolarHBondContact O-N 2.99Å; M1-M3 VanDerWaalsContact O-N 3.13Å; M1-I4 PolarHBondContact O-N 2.91Å; M1-I4 HydrophobicContact SD-CD1 4.49Å; M1-S5 PolarHBondContact O-N 3.4Å; M1-S5 PolarHBondContact O-OG 2.71Å; M1-F156 HydrophobicContact CB-CD1 3.98Å; M1-F156 HydrophobicContact CB-CD2 4.02Å; M1-F156 HydrophobicContact CB-CE1 4.06Å; M1-F156 HydrophobicContact CB-CE2 4.1Å; M1-F156 HydrophobicContact CB-CG 3.96Å; M1-F156 HydrophobicContact CB-CZ 4.12Å; M1-F156 HydrophobicContact CG-CE1 4.28Å; M1-F156 HydrophobicContact CG-CZ 4.21Å | |||
| 2 | Q | 88.3 | Confident | 91.4 | Very high | 51 Ų | 51 | 35.3 Ų | 35.3 | 24% | 0.238 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -49.4 | -44 | -177.4 | -168.8 | -177.7 | 27 | 0 | 0 | 114.9 | G6 F156 P158 K160 | Q2-G6 PolarHBondContact O-N 2.69Å; Q2-F156 HydrophobicContact CB-CB 4.32Å; Q2-P158 VanDerWaalsContact CG-O 3.3Å; Q2-P158 WeakPolarHBondContact CG-O 3.47Å; Q2-P158 PolarHBondContact NE2-O 3.44Å; Q2-K160 HydrophobicContact CG-CB 4.4Å; Q2-K160 HydrophobicContact CG-CD 4.39Å; Q2-K160 HydrophobicContact CG-CG 4.22Å |
| 3 | M | 90.8 | Very high | 91.6 | Very high | 87 Ų | 87 | 38.6 Ų | 38.6 | 43% | 0.429 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -71.9 | -35.2 | 178.2 | -171.7 | -177 | -77.9 | 0 | 0 | 113.3 | M1 S7 K160 N162 L165 | M1-M3 VanDerWaalsContact C-N 3.31Å; M1-M3 PolarHBondContact O-N 2.99Å; M1-M3 VanDerWaalsContact O-N 3.13Å; M3-S7 VanDerWaalsContact O-CB 3.25Å; M3-S7 WeakPolarHBondContact O-CB 3.45Å; M3-S7 PolarHBondContact O-N 2.79Å; M3-S7 PolarHBondContact O-OG 3.49Å; M3-K160 WeakPolarHBondContact CA-O 3.29Å; M3-N162 HydrophobicContact CG-CB 3.91Å; M3-N162 HydrophobicContact SD-CB 3.65Å; M3-L165 HydrophobicContact CG-CD1 4.14Å; M3-L165 HydrophobicContact SD-CD1 4.33Å |
| 4 | I | 90.7 | Very high | 91.7 | Very high | 60 Ų | 60 | 39.1 Ų | 39.1 | 31% | 0.308 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -69.3 | -52.4 | 179.3 | -63.8 | 173.6 | 0 | 0 | 0 | 109.1 | M1 G6 S7 C8 L165 F169 | M1-I4 PolarHBondContact O-N 2.91Å; M1-I4 HydrophobicContact SD-CD1 4.49Å; I4-G6 PolarHBondContact O-N 2.97Å; I4-S7 PolarHBondContact O-N 3.35Å; I4-C8 VanDerWaalsContact O-CB 3.3Å; I4-C8 WeakPolarHBondContact O-CB 3.19Å; I4-C8 PolarHBondContact O-N 3.13Å; I4-L165 HydrophobicContact CG1-CD1 4.39Å; I4-F169 HydrophobicContact CG2-CE2 3.99Å; I4-F169 HydrophobicContact CG2-CZ 3.71Å |
| 5 | S | 90.3 | Very high | 91.8 | Very high | 10 Ų | 10 | 36.7 Ų | 36.7 | 7% | 0.07 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -62.8 | -40.6 | 179.2 | -51.1 | 0 | 0 | 0 | 0 | 112.1 | M1 L9 | M1-S5 PolarHBondContact O-N 3.4Å; M1-S5 PolarHBondContact O-OG 2.71Å; S5-L9 WeakPolarHBondContact O-CB 3.12Å; S5-L9 PolarHBondContact O-N 2.88Å |
| 6 | G | 92.2 | Very high | 91.9 | Very high | 2 Ų | 2 | 35.2 Ų | 35.2 | 2% | 0.021 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -70.2 | -36 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q2 I4 L9 I10 K160 | Q2-G6 PolarHBondContact O-N 2.69Å; I4-G6 PolarHBondContact O-N 2.97Å; G6-L9 PolarHBondContact O-N 3.13Å; G6-I10 PolarHBondContact O-N 2.92Å; G6-K160 CarbonylContact C-O 3.44Å; G6-K160 VanDerWaalsContact CA-O 3.23Å; G6-K160 WeakPolarHBondContact CA-O 3.21Å |
| 7 | S | 93.3 | Very high | 92 | Very high | 0 Ų | 0 | 39.2 Ų | 39.2 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -68.3 | -41.9 | 173.4 | -55.7 | 0 | 0 | 0 | 0 | 111.7 | M3 I4 I10 A11 K160 F161 N162 | M3-S7 VanDerWaalsContact O-CB 3.25Å; M3-S7 WeakPolarHBondContact O-CB 3.45Å; M3-S7 PolarHBondContact O-N 2.79Å; M3-S7 PolarHBondContact O-OG 3.49Å; I4-S7 PolarHBondContact O-N 3.35Å; S7-I10 PolarHBondContact O-N 3.03Å; S7-A11 PolarHBondContact O-N 2.59Å; S7-A11 VanDerWaalsContact O-N 3.09Å; S7-K160 PolarHBondContact N-O 3.47Å; S7-F161 WeakPolarHBondContact OG-CA 3.48Å; S7-N162 PolarHBondContact OG-N 3.28Å |
| 8 | C | 92.4 | Very high | 92 | Very high | 1 Ų | 1 | 38.2 Ų | 38.2 | 1% | 0.007 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -59.9 | -45.6 | 173.6 | -177.4 | 0 | 0 | 0 | 0 | 110.9 | I4 I10 A11 V12 F169 A216 | I4-C8 VanDerWaalsContact O-CB 3.3Å; I4-C8 WeakPolarHBondContact O-CB 3.19Å; I4-C8 PolarHBondContact O-N 3.13Å; C8-I10 VanDerWaalsContact C-N 3.3Å; C8-I10 PolarHBondContact O-N 3.24Å; C8-A11 PolarHBondContact O-N 2.74Å; C8-A11 VanDerWaalsContact O-N 3.11Å; C8-V12 VanDerWaalsContact O-CG1 3.3Å; C8-V12 WeakPolarHBondContact O-CG1 3.28Å; C8-V12 WeakPolarHBondContact O-CG2 2.98Å; C8-V12 PolarHBondContact O-N 3.26Å; C8-F169 HydrophobicContact CB-CD1 4.43Å; C8-F169 HydrophobicContact CB-CD2 3.96Å; C8-F169 HydrophobicContact CB-CE1 4.44Å; C8-F169 HydrophobicContact CB-CE2 3.97Å; C8-F169 HydrophobicContact CB-CG 4.21Å; C8-F169 HydrophobicContact CB-CZ 4.22Å; C8-A216 HydrophobicContact CB-CB 4.45Å |
| 9 | L | 93.6 | Very high | 91.9 | Very high | 33 Ų | 33 | 36.2 Ų | 36.2 | 17% | 0.173 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -54.1 | -43.5 | 178 | -177.8 | 65.3 | 0 | 0 | 0 | 112.6 | S5 G6 V12 L13 P159 I213 A216 L217 | S5-L9 WeakPolarHBondContact O-CB 3.12Å; S5-L9 PolarHBondContact O-N 2.88Å; G6-L9 PolarHBondContact O-N 3.13Å; L9-V12 WeakPolarHBondContact O-CG2 3.45Å; L9-L13 WeakPolarHBondContact O-CG 3.01Å; L9-P159 HydrophobicContact CD2-CB 4.28Å; L9-P159 HydrophobicContact CD2-CG 4.41Å; L9-I213 HydrophobicContact CD1-CG2 3.97Å; L9-A216 HydrophobicContact CB-CB 3.89Å; L9-A216 HydrophobicContact CD1-CB 4.06Å; L9-L217 HydrophobicContact CD1-CD2 4.08Å; L9-L217 HydrophobicContact CD1-CG 4.03Å; L9-L217 HydrophobicContact CD2-CD2 4.02Å |
| 10 | I | 94.1 | Very high | 91.9 | Very high | 71 Ų | 71 | 39.5 Ų | 39.5 | 36% | 0.364 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -69.4 | -45.5 | 177.9 | -65 | 174.8 | 0 | 0 | 0 | 110.7 | G6 S7 C8 V12 L13 F161 V166 | G6-I10 PolarHBondContact O-N 2.92Å; S7-I10 PolarHBondContact O-N 3.03Å; C8-I10 VanDerWaalsContact C-N 3.3Å; C8-I10 PolarHBondContact O-N 3.24Å; I10-V12 PolarHBondContact O-N 3.4Å; I10-L13 WeakPolarHBondContact O-CB 3.3Å; I10-L13 PolarHBondContact O-N 3.35Å; I10-F161 HydrophobicContact CD1-CB 3.56Å; I10-F161 HydrophobicContact CD1-CD1 3.74Å; I10-F161 HydrophobicContact CD1-CD2 4.28Å; I10-F161 HydrophobicContact CD1-CG 3.6Å; I10-V166 HydrophobicContact CB-CG1 4.45Å; I10-V166 HydrophobicContact CB-CG2 4.27Å; I10-V166 HydrophobicContact CD1-CG2 4.46Å; I10-V166 HydrophobicContact CG2-CG1 3.93Å; I10-V166 HydrophobicContact CG2-CG2 4.41Å |
| 11 | A | 93.8 | Very high | 91.9 | Very high | 2 Ų | 2 | 41.7 Ų | 41.7 | 2% | 0.017 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -60.4 | -44.4 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | S7 C8 L13 I14 F169 T170 | S7-A11 PolarHBondContact O-N 2.59Å; S7-A11 VanDerWaalsContact O-N 3.09Å; C8-A11 PolarHBondContact O-N 2.74Å; C8-A11 VanDerWaalsContact O-N 3.11Å; A11-L13 PolarHBondContact O-N 3.44Å; A11-I14 WeakPolarHBondContact O-CB 3.48Å; A11-I14 WeakPolarHBondContact O-CG2 3.5Å; A11-I14 PolarHBondContact O-N 2.89Å; A11-F169 HydrophobicContact CB-CB 3.43Å; A11-F169 VanDerWaalsContact CB-CB 3.43Å; A11-T170 WeakPolarHBondContact CB-OG1 3.44Å |
| 12 | V | 94 | Very high | 92.1 | Very high | 1 Ų | 1 | 36.9 Ų | 36.9 | 1% | 0.006 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -72.1 | -16 | -173.9 | -59.9 | 0 | 0 | 0 | 0 | 113.5 | C8 L9 I10 I14 M15 P16 C212 I213 | C8-V12 VanDerWaalsContact O-CG1 3.3Å; C8-V12 WeakPolarHBondContact O-CG1 3.28Å; C8-V12 WeakPolarHBondContact O-CG2 2.98Å; C8-V12 PolarHBondContact O-N 3.26Å; L9-V12 WeakPolarHBondContact O-CG2 3.45Å; I10-V12 PolarHBondContact O-N 3.4Å; V12-I14 PolarHBondContact O-N 3.12Å; V12-I14 VanDerWaalsContact O-N 3.13Å; V12-M15 PolarHBondContact O-N 2.59Å; V12-M15 VanDerWaalsContact O-N 3.14Å; V12-P16 WeakPolarHBondContact O-CD 3.49Å; V12-C212 HydrophobicContact CB-CB 3.64Å; V12-C212 HydrophobicContact CG1-CB 3.63Å; V12-C212 HydrophobicContact CG2-CB 4.05Å; V12-I213 HydrophobicContact CG2-CG1 3.76Å |
| 13 | L | 93.9 | Very high | 92.1 | Very high | 78 Ų | 78 | 38 Ų | 38 | 41% | 0.408 | 20% | 0.199 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -58.9 | -22.5 | 171.6 | -68.1 | 174.6 | 0 | 0 | 0 | 112.1 | L9 I10 A11 M15 P16 I17 I213 | L9-L13 WeakPolarHBondContact O-CG 3.01Å; I10-L13 WeakPolarHBondContact O-CB 3.3Å; I10-L13 PolarHBondContact O-N 3.35Å; A11-L13 PolarHBondContact O-N 3.44Å; L13-M15 VanDerWaalsContact C-N 3.29Å; L13-M15 PolarHBondContact O-N 3.13Å; L13-P16 WeakPolarHBondContact O-CD 3.24Å; L13-P16 WeakPolarHBondContact O-CG 3.35Å; L13-I17 HydrophobicContact CB-CD1 4.34Å; L13-I17 WeakPolarHBondContact O-CB 3.47Å; L13-I17 VanDerWaalsContact O-CD1 3.26Å; L13-I17 WeakPolarHBondContact O-CD1 3.47Å; L13-I17 WeakPolarHBondContact O-CG1 3.4Å; L13-I17 PolarHBondContact O-N 3.07Å; L13-I213 HydrophobicContact CD2-CD1 3.83Å; L13-I213 HydrophobicContact CD2-CG1 4.25Å |
| 14 | I | 93.5 | Very high | 91.9 | Very high | 45 Ų | 45 | 34 Ų | 34 | 23% | 0.231 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -63 | -36.5 | 177.6 | -155.9 | 156.8 | 0 | 0 | 0 | 112 | A11 V12 I17 L18 T170 C173 F174 | A11-I14 WeakPolarHBondContact O-CB 3.48Å; A11-I14 WeakPolarHBondContact O-CG2 3.5Å; A11-I14 PolarHBondContact O-N 2.89Å; V12-I14 PolarHBondContact O-N 3.12Å; V12-I14 VanDerWaalsContact O-N 3.13Å; I14-I17 PolarHBondContact O-N 2.92Å; I14-L18 HydrophobicContact CG1-CD1 3.91Å; I14-L18 HydrophobicContact CG1-CG 4.01Å; I14-L18 WeakPolarHBondContact O-CB 3.43Å; I14-L18 WeakPolarHBondContact O-CG 3.18Å; I14-L18 PolarHBondContact O-N 3.02Å; I14-T170 HydrophobicContact CD1-CG2 3.88Å; I14-T170 HydrophobicContact CG2-CG2 4.48Å; I14-C173 HydrophobicContact CG2-CB 4.33Å; I14-F174 HydrophobicContact CD1-CE2 3.77Å; I14-F174 HydrophobicContact CD1-CZ 3.58Å; I14-F174 HydrophobicContact CG1-CZ 4.3Å |
| 15 | M | 93.3 | Very high | 91.4 | Very high | 3 Ų | 3 | 31.3 Ų | 31.3 | 2% | 0.015 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -60.8 | -55.2 | -178.5 | -68.8 | -174.5 | 173.3 | 0 | 0 | 113.1 | V12 L13 I17 L18 G19 C173 M177 | V12-M15 PolarHBondContact O-N 2.59Å; V12-M15 VanDerWaalsContact O-N 3.14Å; L13-M15 VanDerWaalsContact C-N 3.29Å; L13-M15 PolarHBondContact O-N 3.13Å; M15-I17 VanDerWaalsContact C-N 3.33Å; M15-I17 PolarHBondContact O-N 3.44Å; M15-L18 PolarHBondContact O-N 3.36Å; M15-G19 PolarHBondContact O-N 3.49Å; M15-C173 HydrophobicContact CE-CB 3.67Å; M15-C173 HydrophobicContact CG-CB 4.5Å; M15-M177 HydrophobicContact CE-CG 4.04Å; M15-M177 HydrophobicContact CG-CG 4.3Å; M15-M177 HydrophobicContact CG-SD 4.03Å |
| 16 | P | 93.5 | Very high | 91.1 | Very high | 13 Ų | 13 | 37.7 Ų | 37.7 | 8% | 0.084 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -66.4 | -34.5 | 177.6 | 26.8 | -33.7 | 0 | 0 | 0 | 112 | V12 L13 G19 F20 I213 | V12-P16 WeakPolarHBondContact O-CD 3.49Å; L13-P16 WeakPolarHBondContact O-CD 3.24Å; L13-P16 WeakPolarHBondContact O-CG 3.35Å; P16-G19 PolarHBondContact O-N 3.46Å; P16-F20 HydrophobicContact CB-CD2 4.37Å; P16-F20 HydrophobicContact CB-CE2 4.37Å; P16-F20 WeakPolarHBondContact O-CB 3.43Å; P16-F20 WeakPolarHBondContact O-CD2 3.43Å; P16-F20 PolarHBondContact O-N 3.06Å; P16-I213 HydrophobicContact CG-CD1 4.15Å |
| 17 | I | 93.7 | Very high | 90.8 | Very high | 104 Ų | 104 | 40.6 Ų | 40.6 | 53% | 0.533 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -60.1 | -48 | 175 | -68.9 | 168.2 | 0 | 0 | 0 | 110.4 | L13 I14 M15 G19 T21 | L13-I17 HydrophobicContact CB-CD1 4.34Å; L13-I17 WeakPolarHBondContact O-CB 3.47Å; L13-I17 VanDerWaalsContact O-CD1 3.26Å; L13-I17 WeakPolarHBondContact O-CD1 3.47Å; L13-I17 WeakPolarHBondContact O-CG1 3.4Å; L13-I17 PolarHBondContact O-N 3.07Å; I14-I17 PolarHBondContact O-N 2.92Å; M15-I17 VanDerWaalsContact C-N 3.33Å; M15-I17 PolarHBondContact O-N 3.44Å; I17-G19 VanDerWaalsContact C-N 3.33Å; I17-G19 PolarHBondContact O-N 2.84Å; I17-T21 WeakPolarHBondContact O-CB 3.37Å; I17-T21 VanDerWaalsContact O-CG2 3.24Å; I17-T21 WeakPolarHBondContact O-CG2 3.26Å; I17-T21 PolarHBondContact O-N 3.02Å; I17-T21 PolarHBondContact O-OG1 3.26Å |
| 18 | L | 92.1 | Very high | 90.3 | Very high | 21 Ų | 21 | 40.9 Ų | 40.9 | 11% | 0.11 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -66.2 | -36.1 | 178 | -68.5 | -178.4 | 0 | 0 | 0 | 112.3 | I14 M15 T21 G22 L23 V24 F174 M177 | I14-L18 HydrophobicContact CG1-CD1 3.91Å; I14-L18 HydrophobicContact CG1-CG 4.01Å; I14-L18 WeakPolarHBondContact O-CB 3.43Å; I14-L18 WeakPolarHBondContact O-CG 3.18Å; I14-L18 PolarHBondContact O-N 3.02Å; M15-L18 PolarHBondContact O-N 3.36Å; L18-T21 WeakPolarHBondContact CA-OG1 3.42Å; L18-T21 PolarHBondContact O-OG1 2.95Å; L18-G22 PolarHBondContact O-N 3.37Å; L18-L23 HydrophobicContact CD2-CB 4.1Å; L18-L23 HydrophobicContact CD2-CD2 3.53Å; L18-L23 HydrophobicContact CD2-CG 4.43Å; L18-L23 PolarHBondContact O-N 2.74Å; L18-L23 VanDerWaalsContact O-N 3.15Å; L18-V24 HydrophobicContact CB-CG2 3.57Å; L18-F174 HydrophobicContact CD1-CE1 3.58Å; L18-F174 HydrophobicContact CD1-CZ 4.06Å; L18-M177 HydrophobicContact CB-CE 4.45Å; L18-M177 HydrophobicContact CD1-CE 3.95Å; L18-M177 HydrophobicContact CD1-SD 4.26Å |
| 19 | G | 90.4 | Very high | 89.7 | Confident | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -64.9 | -50.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | M15 P16 I17 T21 G22 N202 V410 | M15-G19 PolarHBondContact O-N 3.49Å; P16-G19 PolarHBondContact O-N 3.46Å; I17-G19 VanDerWaalsContact C-N 3.33Å; I17-G19 PolarHBondContact O-N 2.84Å; G19-T21 VanDerWaalsContact C-N 3.33Å; G19-T21 PolarHBondContact O-N 3.22Å; G19-G22 PolarHBondContact O-N 3.22Å; G19-N202 WeakPolarHBondContact O-CB 3.42Å; G19-V410 WeakPolarHBondContact O-CG2 3.19Å |
| 20 | F | 91.2 | Very high | 89.3 | Confident | 102 Ų | 102 | 50.5 Ų | 50.5 | 45% | 0.447 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -66.2 | -31.4 | 178.6 | -78.3 | -62.6 | 0 | 0 | 0 | 113.5 | P16 G22 V206 P409 V410 | P16-F20 HydrophobicContact CB-CD2 4.37Å; P16-F20 HydrophobicContact CB-CE2 4.37Å; P16-F20 WeakPolarHBondContact O-CB 3.43Å; P16-F20 WeakPolarHBondContact O-CD2 3.43Å; P16-F20 PolarHBondContact O-N 3.06Å; F20-G22 PolarHBondContact O-N 2.89Å; F20-V206 HydrophobicContact CD1-CG2 4.44Å; F20-V206 HydrophobicContact CD2-CG1 4.47Å; F20-V206 HydrophobicContact CD2-CG2 4.02Å; F20-V206 HydrophobicContact CE1-CG1 4.44Å; F20-V206 HydrophobicContact CE1-CG2 4.44Å; F20-V206 HydrophobicContact CE2-CG1 3.67Å; F20-V206 HydrophobicContact CE2-CG2 4.02Å; F20-V206 HydrophobicContact CG-CG2 4.22Å; F20-V206 HydrophobicContact CZ-CG1 3.65Å; F20-V206 HydrophobicContact CZ-CG2 4.23Å; F20-P409 VanDerWaalsContact O-CD 3.28Å; F20-P409 WeakPolarHBondContact O-CD 3.37Å; F20-P409 WeakPolarHBondContact O-CG 3.42Å; F20-V410 HydrophobicContact CD1-CG2 3.79Å; F20-V410 HydrophobicContact CE1-CG2 4.19Å; F20-V410 HydrophobicContact CG-CG2 4.44Å |
| 21 | T | 91.7 | Very high | 89 | Confident | 85 Ų | 85 | 47.4 Ų | 47.4 | 52% | 0.521 | 23% | 0.232 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -75.7 | -12.3 | 173.8 | 53.5 | 0 | 0 | 0 | 0 | 113.1 | I17 L18 G19 L23 | I17-T21 WeakPolarHBondContact O-CB 3.37Å; I17-T21 VanDerWaalsContact O-CG2 3.24Å; I17-T21 WeakPolarHBondContact O-CG2 3.26Å; I17-T21 PolarHBondContact O-N 3.02Å; I17-T21 PolarHBondContact O-OG1 3.26Å; L18-T21 WeakPolarHBondContact CA-OG1 3.42Å; L18-T21 PolarHBondContact O-OG1 2.95Å; G19-T21 VanDerWaalsContact C-N 3.33Å; G19-T21 PolarHBondContact O-N 3.22Å; T21-L23 PolarHBondContact O-N 2.73Å |
| 22 | G | 87.9 | Confident | 88.8 | Confident | 5 Ų | 5 | 47.3 Ų | 47.3 | 5% | 0.052 | 23% | 0.231 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 71.7 | 11.5 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | L18 G19 F20 V24 K26 N202 | L18-G22 PolarHBondContact O-N 3.37Å; G19-G22 PolarHBondContact O-N 3.22Å; F20-G22 PolarHBondContact O-N 2.89Å; G22-V24 VanDerWaalsContact C-N 3.27Å; G22-V24 PolarHBondContact O-N 3.15Å; G22-K26 PolarHBondContact O-N 3.31Å; G22-N202 WeakPolarHBondContact CA-ND2 3.46Å |
| 23 | L | 88.1 | Confident | 88.6 | Confident | 75 Ų | 75 | 48.1 Ų | 48.1 | 39% | 0.393 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -64.6 | -36.5 | -179.7 | -157.4 | 92.6 | 0 | 0 | 0 | 110.5 | L18 T21 G25 K26 I27 | L18-L23 HydrophobicContact CD2-CB 4.1Å; L18-L23 HydrophobicContact CD2-CD2 3.53Å; L18-L23 HydrophobicContact CD2-CG 4.43Å; L18-L23 PolarHBondContact O-N 2.74Å; L18-L23 VanDerWaalsContact O-N 3.15Å; T21-L23 PolarHBondContact O-N 2.73Å; L23-G25 PolarHBondContact O-N 3.46Å; L23-K26 WeakPolarHBondContact O-CB 3.23Å; L23-K26 PolarHBondContact O-N 3.47Å; L23-K26 VanDerWaalsContact O-N 3.12Å; L23-I27 HydrophobicContact CD2-CD1 3.43Å; L23-I27 VanDerWaalsContact CD2-CD1 3.43Å; L23-I27 HydrophobicContact CD2-CG1 4.41Å; L23-I27 HydrophobicContact CG-CD1 3.82Å; L23-I27 HydrophobicContact CG-CG1 4.31Å; L23-I27 WeakPolarHBondContact O-CG1 3.21Å; L23-I27 PolarHBondContact O-N 3.13Å |
| 24 | V | 85.6 | Confident | 88.5 | Confident | 4 Ų | 4 | 44.4 Ų | 44.4 | 2% | 0.024 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -64 | -46.7 | -176.1 | -168.5 | 0 | 0 | 0 | 0 | 111.8 | L18 G22 K26 I27 S28 M177 T201 F205 | L18-V24 HydrophobicContact CB-CG2 3.57Å; G22-V24 VanDerWaalsContact C-N 3.27Å; G22-V24 PolarHBondContact O-N 3.15Å; V24-K26 PolarHBondContact O-N 3.31Å; V24-I27 PolarHBondContact O-N 3.22Å; V24-S28 WeakPolarHBondContact O-CB 3.36Å; V24-S28 PolarHBondContact O-N 2.9Å; V24-S28 PolarHBondContact O-OG 2.89Å; V24-M177 HydrophobicContact CB-CE 4.29Å; V24-M177 HydrophobicContact CG1-CE 3.86Å; V24-M177 HydrophobicContact CG2-CE 3.43Å; V24-M177 VanDerWaalsContact CG2-CE 3.43Å; V24-T201 HydrophobicContact CG1-CG2 4.36Å; V24-F205 HydrophobicContact CB-CD2 4Å; V24-F205 HydrophobicContact CG1-CD2 3.22Å; V24-F205 HydrophobicContact CG1-CE2 3.34Å; V24-F205 HydrophobicContact CG1-CG 4.08Å; V24-F205 HydrophobicContact CG1-CZ 4.3Å; V24-F205 HydrophobicContact CG2-CD2 4.3Å; V24-F205 HydrophobicContact CG2-CG 4.49Å |
| 25 | G | 81.3 | Confident | 88.5 | Confident | 2 Ų | 2 | 42.3 Ų | 42.3 | 2% | 0.021 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -64.5 | -21.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | L23 S28 N202 | L23-G25 PolarHBondContact O-N 3.46Å; G25-S28 PolarHBondContact O-OG 3.49Å; G25-N202 WeakPolarHBondContact CA-OD1 3.37Å; G25-N202 PolarHBondContact N-OD1 3.45Å |
| 26 | K | 84.3 | Confident | 88.4 | Confident | 145 Ų | 145 | 42.3 Ų | 42.3 | 63% | 0.63 | 21% | 0.206 | S | C | * | . | H | α-helix | trans | -79.5 | -46.8 | 170.7 | -69.8 | 179.2 | -179.3 | 175.2 | 0 | 111.3 | G22 L23 V24 S28 K29 Y30 | G22-K26 PolarHBondContact O-N 3.31Å; L23-K26 WeakPolarHBondContact O-CB 3.23Å; L23-K26 PolarHBondContact O-N 3.47Å; L23-K26 VanDerWaalsContact O-N 3.12Å; V24-K26 PolarHBondContact O-N 3.31Å; K26-S28 VanDerWaalsContact C-N 3.35Å; K26-K29 WeakPolarHBondContact O-CB 3.41Å; K26-K29 PolarHBondContact O-N 2.89Å; K26-Y30 WeakPolarHBondContact O-CD2 3.3Å |
| 27 | I | 84.7 | Confident | 88.4 | Confident | 62 Ų | 62 | 41.8 Ų | 41.8 | 32% | 0.318 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -66.3 | -37.2 | -179.5 | -66.9 | 173.8 | 0 | 0 | 0 | 111.1 | L23 V24 K29 Y30 I31 | L23-I27 HydrophobicContact CD2-CD1 3.43Å; L23-I27 VanDerWaalsContact CD2-CD1 3.43Å; L23-I27 HydrophobicContact CD2-CG1 4.41Å; L23-I27 HydrophobicContact CG-CD1 3.82Å; L23-I27 HydrophobicContact CG-CG1 4.31Å; L23-I27 WeakPolarHBondContact O-CG1 3.21Å; L23-I27 PolarHBondContact O-N 3.13Å; V24-I27 PolarHBondContact O-N 3.22Å; I27-K29 PolarHBondContact O-N 3.15Å; I27-Y30 WeakPolarHBondContact O-CB 3.44Å; I27-Y30 PolarHBondContact O-N 3.03Å; I27-I31 HydrophobicContact CG2-CD1 3.62Å; I27-I31 HydrophobicContact CG2-CG1 4.17Å; I27-I31 PolarHBondContact O-N 3.23Å |
| 28 | S | 82.4 | Confident | 88.4 | Confident | 7 Ų | 7 | 36.8 Ų | 36.8 | 5% | 0.049 | 18% | 0.177 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -60.7 | -19.1 | -179.6 | 71.5 | 0 | 0 | 0 | 0 | 113.7 | V24 G25 K26 Y30 R195 | V24-S28 WeakPolarHBondContact O-CB 3.36Å; V24-S28 PolarHBondContact O-N 2.9Å; V24-S28 PolarHBondContact O-OG 2.89Å; G25-S28 PolarHBondContact O-OG 3.49Å; K26-S28 VanDerWaalsContact C-N 3.35Å; S28-Y30 VanDerWaalsContact C-N 3.26Å; S28-Y30 PolarHBondContact O-N 3.38Å; S28-R195 PolarHBondContact O-NH2 3.43Å |
| 29 | K | 81.6 | Confident | 88.5 | Confident | 107 Ų | 107 | 35.9 Ų | 35.9 | 47% | 0.465 | 17% | 0.172 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -73.8 | -15.1 | 172.9 | -62.6 | -173.2 | 179.4 | -169.1 | 0 | 113.9 | K26 I27 R363 F368 | K26-K29 WeakPolarHBondContact O-CB 3.41Å; K26-K29 PolarHBondContact O-N 2.89Å; I27-K29 PolarHBondContact O-N 3.15Å; K29-R363 PolarHBondContact O-NH2 3.2Å; K29-F368 WeakPolarHBondContact O-CE1 3.25Å |
| 30 | Y | 85.2 | Confident | 88.5 | Confident | 128 Ų | 128 | 35.9 Ų | 35.9 | 50% | 0.502 | 17% | 0.172 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -107.1 | -10.3 | 178.8 | -61.7 | -81.7 | 0 | 0 | 0 | 112.7 | K26 I27 S28 N356 | K26-Y30 WeakPolarHBondContact O-CD2 3.3Å; I27-Y30 WeakPolarHBondContact O-CB 3.44Å; I27-Y30 PolarHBondContact O-N 3.03Å; S28-Y30 VanDerWaalsContact C-N 3.26Å; S28-Y30 PolarHBondContact O-N 3.38Å; Y30-N356 PolarHBondContact O-ND2 3.2Å |
| 31 | I | 87.6 | Confident | 88.6 | Confident | 7 Ų | 7 | 31.3 Ų | 31.3 | 4% | 0.036 | 15% | 0.152 | C | C | . | . | trans | -93.7 | 109.3 | 175.8 | -63.6 | 167.1 | 0 | 0 | 0 | 107.9 | I27 I36 I178 I181 F352 F368 | I27-I31 HydrophobicContact CG2-CD1 3.62Å; I27-I31 HydrophobicContact CG2-CG1 4.17Å; I27-I31 PolarHBondContact O-N 3.23Å; I31-I36 HydrophobicContact CG2-CD1 4.01Å; I31-I36 HydrophobicContact CG2-CG1 3.74Å; I31-I178 HydrophobicContact CD1-CG1 3.84Å; I31-I178 HydrophobicContact CG2-CG2 3.69Å; I31-I181 HydrophobicContact CD1-CD1 3.62Å; I31-F352 HydrophobicContact CG1-CD2 4.16Å; I31-F352 HydrophobicContact CG1-CE2 4.01Å; I31-F368 WeakPolarHBondContact O-CE1 3.37Å | ||
| 32 | G | 88.5 | Confident | 88.8 | Confident | 0 Ų | 0 | 27.3 Ų | 27.3 | 0% | 0 | 13% | 0.128 | C | C | . | . | trans | -111 | 175.1 | 176 | 0 | 0 | 0 | 0 | 0 | 112.4 | V34 T35 I36 | G32-V34 PolarHBondContact O-N 2.89Å; G32-T35 WeakPolarHBondContact O-CB 3.5Å; G32-T35 PolarHBondContact O-N 2.99Å; G32-I36 WeakPolarHBondContact O-CG1 3.34Å; G32-I36 PolarHBondContact O-N 2.65Å | ||
| 33 | P | 89.8 | Confident | 88.9 | Confident | 18 Ų | 18 | 29.3 Ų | 29.3 | 12% | 0.117 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -53.8 | -33.8 | 174.2 | -28.6 | 36.7 | 0 | 0 | 0 | 113.9 | T35 I36 V37 T294 V295 G367 | P33-T35 PolarHBondContact O-N 2.98Å; P33-I36 PolarHBondContact O-N 3.45Å; P33-V37 VanDerWaalsContact O-CG2 3.31Å; P33-V37 WeakPolarHBondContact O-CG2 3.39Å; P33-V37 PolarHBondContact O-N 3.31Å; P33-T294 VanDerWaalsContact CG-OG1 3.3Å; P33-T294 WeakPolarHBondContact CG-OG1 3.3Å; P33-V295 HydrophobicContact CB-CG2 3.62Å; P33-G367 WeakPolarHBondContact CG-O 3.37Å |
| 34 | V | 92.9 | Very high | 89.2 | Confident | 0 Ų | 0 | 26.1 Ų | 26.1 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -57.8 | -30.6 | 174.1 | 176.2 | 0 | 0 | 0 | 0 | 112.6 | G32 P38 V295 I305 I306 D355 R366 | G32-V34 PolarHBondContact O-N 2.89Å; V34-P38 WeakPolarHBondContact O-CD 3.49Å; V34-P38 WeakPolarHBondContact O-CG 3.16Å; V34-V295 HydrophobicContact CG2-CG1 3.67Å; V34-V295 HydrophobicContact CG2-CG2 3.99Å; V34-I305 HydrophobicContact CG1-CB 4.31Å; V34-I305 HydrophobicContact CG1-CG2 3.82Å; V34-I306 HydrophobicContact CG1-CG1 4.21Å; V34-D355 HydrophobicContact CG1-CB 4.05Å; V34-R366 HydrophobicContact CG2-CB 4.5Å |
| 35 | T | 92.6 | Very high | 89.6 | Confident | 0 Ų | 0 | 29.2 Ų | 29.2 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -88.6 | -40.2 | 175.6 | -52.2 | 0 | 0 | 0 | 0 | 112.3 | G32 P33 P38 I39 A351 F352 | G32-T35 WeakPolarHBondContact O-CB 3.5Å; G32-T35 PolarHBondContact O-N 2.99Å; P33-T35 PolarHBondContact O-N 2.98Å; T35-P38 WeakPolarHBondContact O-CD 3.35Å; T35-I39 HydrophobicContact CG2-CD1 3.97Å; T35-I39 WeakPolarHBondContact O-CD1 3.33Å; T35-I39 WeakPolarHBondContact O-CG1 3.1Å; T35-A351 HydrophobicContact CG2-CB 4.21Å; T35-F352 HydrophobicContact CG2-CB 3.8Å; T35-F352 HydrophobicContact CG2-CD2 4.34Å |
| 36 | I | 91.5 | Very high | 90 | Very high | 4 Ų | 4 | 29.9 Ų | 29.9 | 2% | 0.021 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -67.5 | -42.2 | -174.9 | -65.2 | 163.1 | 0 | 0 | 0 | 111.5 | I31 G32 P33 I39 M40 I178 | I31-I36 HydrophobicContact CG2-CD1 4.01Å; I31-I36 HydrophobicContact CG2-CG1 3.74Å; G32-I36 WeakPolarHBondContact O-CG1 3.34Å; G32-I36 PolarHBondContact O-N 2.65Å; P33-I36 PolarHBondContact O-N 3.45Å; I36-I39 WeakPolarHBondContact O-CB 3.41Å; I36-I39 PolarHBondContact O-N 2.87Å; I36-M40 HydrophobicContact CG2-CG 4.05Å; I36-M40 HydrophobicContact CG2-SD 3.67Å; I36-M40 WeakPolarHBondContact O-CG 3.45Å; I36-M40 PolarHBondContact O-N 2.63Å; I36-I178 HydrophobicContact CG1-CG2 3.92Å |
| 37 | V | 93.1 | Very high | 90.4 | Very high | 1 Ų | 1 | 24.8 Ų | 24.8 | 1% | 0.006 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -62.4 | -50.2 | -175 | 173.6 | 0 | 0 | 0 | 0 | 112.8 | P33 I39 M40 S41 S288 N291 L292 | P33-V37 VanDerWaalsContact O-CG2 3.31Å; P33-V37 WeakPolarHBondContact O-CG2 3.39Å; P33-V37 PolarHBondContact O-N 3.31Å; V37-I39 VanDerWaalsContact C-N 3.26Å; V37-I39 PolarHBondContact O-N 2.97Å; V37-M40 PolarHBondContact O-N 3.47Å; V37-S41 WeakPolarHBondContact O-CB 3.47Å; V37-S41 PolarHBondContact O-N 3.01Å; V37-S41 PolarHBondContact O-OG 3.39Å; V37-S288 VanDerWaalsContact CG2-O 3.24Å; V37-S288 WeakPolarHBondContact CG2-O 3.46Å; V37-S288 PolarHBondContact O-OG 3.02Å; V37-N291 HydrophobicContact CG2-CB 3.68Å; V37-L292 HydrophobicContact CB-CD2 4.01Å; V37-L292 HydrophobicContact CB-CG 4.42Å; V37-L292 HydrophobicContact CG1-CD1 4.15Å; V37-L292 HydrophobicContact CG1-CD2 3.78Å; V37-L292 HydrophobicContact CG1-CG 3.86Å; V37-L292 HydrophobicContact CG2-CD2 3.88Å; V37-L292 HydrophobicContact CG2-CG 4.06Å |
| 38 | P | 94.8 | Very high | 90.8 | Very high | 0 Ų | 0 | 25.6 Ų | 25.6 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -55.2 | -40.5 | 174.2 | -28.1 | 35.5 | 0 | 0 | 0 | 113.6 | V34 T35 L42 I306 I310 A351 | V34-P38 WeakPolarHBondContact O-CD 3.49Å; V34-P38 WeakPolarHBondContact O-CG 3.16Å; T35-P38 WeakPolarHBondContact O-CD 3.35Å; P38-L42 VanDerWaalsContact O-CB 3.28Å; P38-L42 WeakPolarHBondContact O-CB 3.33Å; P38-L42 WeakPolarHBondContact O-CD1 3.39Å; P38-L42 WeakPolarHBondContact O-CG 3.36Å; P38-L42 PolarHBondContact O-N 2.91Å; P38-I306 HydrophobicContact CG-CB 4.38Å; P38-I306 HydrophobicContact CG-CG1 4.27Å; P38-I306 HydrophobicContact CG-CG2 4.22Å; P38-I310 HydrophobicContact CB-CG1 3.95Å; P38-A351 HydrophobicContact CB-CB 4.21Å; P38-A351 HydrophobicContact CG-CB 4.07Å |
| 39 | I | 92.9 | Very high | 91.3 | Very high | 1 Ų | 1 | 28.4 Ų | 28.4 | 1% | 0.005 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -62.9 | -53.6 | -180 | -71.1 | 170.7 | 0 | 0 | 0 | 110.4 | T35 I36 V37 S41 L42 L43 I178 M344 | T35-I39 HydrophobicContact CG2-CD1 3.97Å; T35-I39 WeakPolarHBondContact O-CD1 3.33Å; T35-I39 WeakPolarHBondContact O-CG1 3.1Å; I36-I39 WeakPolarHBondContact O-CB 3.41Å; I36-I39 PolarHBondContact O-N 2.87Å; V37-I39 VanDerWaalsContact C-N 3.26Å; V37-I39 PolarHBondContact O-N 2.97Å; I39-S41 VanDerWaalsContact C-N 3.34Å; I39-S41 PolarHBondContact O-N 3.22Å; I39-L42 PolarHBondContact O-N 2.92Å; I39-L43 PolarHBondContact O-N 3.25Å; I39-I178 HydrophobicContact CD1-CB 3.97Å; I39-I178 HydrophobicContact CD1-CD1 3.65Å; I39-I178 HydrophobicContact CD1-CG1 4.38Å; I39-I178 HydrophobicContact CD1-CG2 3.39Å; I39-M344 HydrophobicContact CB-CG 4.31Å; I39-M344 HydrophobicContact CG2-CG 3.46Å; I39-M344 VanDerWaalsContact CG2-CG 3.46Å; I39-M344 HydrophobicContact CG2-SD 3.72Å |
| 40 | M | 91.3 | Very high | 91.7 | Very high | 0 Ų | 0 | 28.4 Ų | 28.4 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -64.4 | -38.3 | -179.7 | -67 | -177.2 | 80.2 | 0 | 0 | 111.8 | I36 V37 L43 T44 E179 I284 S288 | I36-M40 HydrophobicContact CG2-CG 4.05Å; I36-M40 HydrophobicContact CG2-SD 3.67Å; I36-M40 WeakPolarHBondContact O-CG 3.45Å; I36-M40 PolarHBondContact O-N 2.63Å; V37-M40 PolarHBondContact O-N 3.47Å; M40-L43 WeakPolarHBondContact O-CB 3.44Å; M40-L43 PolarHBondContact O-N 3.04Å; M40-T44 WeakPolarHBondContact O-CG2 3.35Å; M40-T44 PolarHBondContact O-N 3.2Å; M40-T44 VanDerWaalsContact O-N 3.1Å; M40-T44 PolarHBondContact O-OG1 3.41Å; M40-E179 HydrophobicContact CE-CG 4.32Å; M40-E179 HydrophobicContact CG-CG 4.24Å; M40-I284 HydrophobicContact CE-CG2 4.19Å; M40-S288 WeakPolarHBondContact CB-OG 3.37Å |
| 41 | S | 93.9 | Very high | 92.2 | Very high | 6 Ų | 6 | 23.1 Ų | 23.1 | 4% | 0.042 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -68.4 | -33.5 | 175.3 | -68.9 | 0 | 0 | 0 | 0 | 112.7 | V37 I39 T44 I45 N285 S288 | V37-S41 WeakPolarHBondContact O-CB 3.47Å; V37-S41 PolarHBondContact O-N 3.01Å; V37-S41 PolarHBondContact O-OG 3.39Å; I39-S41 VanDerWaalsContact C-N 3.34Å; I39-S41 PolarHBondContact O-N 3.22Å; S41-T44 PolarHBondContact O-OG1 3.23Å; S41-I45 WeakPolarHBondContact O-CB 3.27Å; S41-I45 WeakPolarHBondContact O-CD1 3.39Å; S41-I45 WeakPolarHBondContact O-CG1 3.49Å; S41-I45 PolarHBondContact O-N 2.91Å; S41-N285 PolarHBondContact OG-OD1 3.24Å; S41-S288 PolarHBondContact OG-OG 3.49Å |
| 42 | L | 94.5 | Very high | 92.6 | Very high | 1 Ų | 1 | 28.3 Ų | 28.3 | 1% | 0.005 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -73.4 | -31.2 | 174.4 | -74.9 | 165.8 | 0 | 0 | 0 | 112.7 | P38 I39 G46 I310 L314 R343 G347 | P38-L42 VanDerWaalsContact O-CB 3.28Å; P38-L42 WeakPolarHBondContact O-CB 3.33Å; P38-L42 WeakPolarHBondContact O-CD1 3.39Å; P38-L42 WeakPolarHBondContact O-CG 3.36Å; P38-L42 PolarHBondContact O-N 2.91Å; I39-L42 PolarHBondContact O-N 2.92Å; L42-G46 WeakPolarHBondContact O-CA 3.3Å; L42-G46 PolarHBondContact O-N 3.27Å; L42-I310 HydrophobicContact CD2-CG2 4.47Å; L42-L314 HydrophobicContact CD2-CD1 4.48Å; L42-L314 HydrophobicContact CD2-CD2 3.58Å; L42-L314 HydrophobicContact CD2-CG 3.55Å; L42-R343 HydrophobicContact CB-CB 4.48Å; L42-R343 HydrophobicContact CD2-CB 4.37Å; L42-G347 VanDerWaalsContact CD1-CA 3.48Å |
| 43 | L | 91.4 | Very high | 92.9 | Very high | 48 Ų | 48 | 31 Ų | 31 | 25% | 0.251 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -59.3 | -53.1 | 169.5 | 175.3 | 64.9 | 0 | 0 | 0 | 110 | I39 M40 I45 G46 T47 M344 | I39-L43 PolarHBondContact O-N 3.25Å; M40-L43 WeakPolarHBondContact O-CB 3.44Å; M40-L43 PolarHBondContact O-N 3.04Å; L43-I45 PolarHBondContact O-N 3.08Å; L43-G46 PolarHBondContact O-N 3.16Å; L43-G46 VanDerWaalsContact O-N 3.14Å; L43-T47 WeakPolarHBondContact O-CG2 3.46Å; L43-T47 PolarHBondContact O-N 3.22Å; L43-T47 VanDerWaalsContact O-N 3.1Å; L43-T47 PolarHBondContact O-OG1 3.25Å; L43-M344 HydrophobicContact CB-SD 3.93Å; L43-M344 HydrophobicContact CD1-CE 4.35Å; L43-M344 HydrophobicContact CD1-SD 4.2Å; L43-M344 HydrophobicContact CG-SD 4.46Å |
| 44 | T | 92.7 | Very high | 93.1 | Very high | 7 Ų | 7 | 33.2 Ų | 33.2 | 4% | 0.043 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -64.9 | -43.3 | -177.5 | 59.4 | 0 | 0 | 0 | 0 | 112.9 | M40 S41 G46 T47 V281 I284 N285 | M40-T44 WeakPolarHBondContact O-CG2 3.35Å; M40-T44 PolarHBondContact O-N 3.2Å; M40-T44 VanDerWaalsContact O-N 3.1Å; M40-T44 PolarHBondContact O-OG1 3.41Å; S41-T44 PolarHBondContact O-OG1 3.23Å; T44-G46 VanDerWaalsContact C-N 3.28Å; T44-G46 PolarHBondContact O-N 2.87Å; T44-T47 PolarHBondContact O-N 3.21Å; T44-T47 PolarHBondContact O-OG1 3.29Å; T44-V281 HydrophobicContact CG2-CG1 3.86Å; T44-I284 HydrophobicContact CG2-CB 4.02Å; T44-I284 HydrophobicContact CG2-CG2 3.71Å; T44-N285 HydrophobicContact CG2-CB 3.89Å; T44-N285 PolarHBondContact OG1-OD1 3.39Å |
| 45 | I | 93.6 | Very high | 93.2 | Very high | 69 Ų | 69 | 35.6 Ų | 35.6 | 35% | 0.354 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -65 | -36.9 | 174.6 | -63.2 | 165.5 | 0 | 0 | 0 | 110.6 | S41 L43 T47 V48 L314 | S41-I45 WeakPolarHBondContact O-CB 3.27Å; S41-I45 WeakPolarHBondContact O-CD1 3.39Å; S41-I45 WeakPolarHBondContact O-CG1 3.49Å; S41-I45 PolarHBondContact O-N 2.91Å; L43-I45 PolarHBondContact O-N 3.08Å; I45-T47 VanDerWaalsContact C-N 3.26Å; I45-T47 PolarHBondContact O-N 2.76Å; I45-V48 WeakPolarHBondContact O-CB 3.31Å; I45-V48 WeakPolarHBondContact O-CG2 3.38Å; I45-V48 PolarHBondContact O-N 3.04Å; I45-L314 HydrophobicContact CB-CD2 4.2Å; I45-L314 HydrophobicContact CD1-CD1 4.16Å; I45-L314 HydrophobicContact CG2-CD1 4.16Å; I45-L314 HydrophobicContact CG2-CD2 3.53Å; I45-L314 HydrophobicContact CG2-CG 4.49Å |
| 46 | G | 91.2 | Very high | 93.3 | Very high | 17 Ų | 17 | 39 Ų | 39 | 18% | 0.175 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -63.8 | -29.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | L42 L43 T44 P49 R343 | L42-G46 WeakPolarHBondContact O-CA 3.3Å; L42-G46 PolarHBondContact O-N 3.27Å; L43-G46 PolarHBondContact O-N 3.16Å; L43-G46 VanDerWaalsContact O-N 3.14Å; T44-G46 VanDerWaalsContact C-N 3.28Å; T44-G46 PolarHBondContact O-N 2.87Å; G46-P49 WeakPolarHBondContact O-CD 3.4Å; G46-R343 PolarHBondContact O-NH1 2.93Å |
| 47 | T | 91.3 | Very high | 93.5 | Very high | 37 Ų | 37 | 41.7 Ų | 41.7 | 23% | 0.227 | 24% | 0.241 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -84.1 | -7.1 | 178.3 | 52.8 | 0 | 0 | 0 | 0 | 114.6 | L43 T44 I45 P49 D50 I51 | L43-T47 WeakPolarHBondContact O-CG2 3.46Å; L43-T47 PolarHBondContact O-N 3.22Å; L43-T47 VanDerWaalsContact O-N 3.1Å; L43-T47 PolarHBondContact O-OG1 3.25Å; T44-T47 PolarHBondContact O-N 3.21Å; T44-T47 PolarHBondContact O-OG1 3.29Å; I45-T47 VanDerWaalsContact C-N 3.26Å; I45-T47 PolarHBondContact O-N 2.76Å; T47-P49 VanDerWaalsContact C-CD 3.5Å; T47-D50 PolarHBondContact O-N 3.03Å; T47-I51 WeakPolarHBondContact O-CG1 3.46Å; T47-I51 PolarHBondContact O-N 2.66Å; T47-I51 VanDerWaalsContact O-N 3.11Å |
| 48 | V | 93.8 | Very high | 93.6 | Very high | 80 Ų | 80 | 42.9 Ų | 42.9 | 49% | 0.485 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -56.9 | -42.9 | -178 | 173.6 | 0 | 0 | 0 | 0 | 113.2 | I45 D50 I51 E52 | I45-V48 WeakPolarHBondContact O-CB 3.31Å; I45-V48 WeakPolarHBondContact O-CG2 3.38Å; I45-V48 PolarHBondContact O-N 3.04Å; V48-D50 VanDerWaalsContact C-N 3.32Å; V48-D50 PolarHBondContact O-N 3.32Å; V48-I51 PolarHBondContact O-N 2.94Å; V48-E52 WeakPolarHBondContact O-CB 3.28Å; V48-E52 PolarHBondContact O-N 3.49Å |
| 49 | P | 92.9 | Very high | 93.6 | Very high | 66 Ų | 66 | 49.6 Ų | 49.6 | 43% | 0.429 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -62.3 | -37.7 | 178.2 | -23 | 35.3 | 0 | 0 | 0 | 113.2 | G46 T47 E52 S53 | G46-P49 WeakPolarHBondContact O-CD 3.4Å; T47-P49 VanDerWaalsContact C-CD 3.5Å; P49-E52 PolarHBondContact O-N 3.25Å; P49-S53 WeakPolarHBondContact O-CB 3.36Å; P49-S53 PolarHBondContact O-N 2.71Å |
| 50 | D | 91.1 | Very high | 93.7 | Very high | 106 Ų | 106 | 49.6 Ų | 49.6 | 57% | 0.567 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -67.3 | -43 | 178.4 | -60.5 | -48.9 | 0 | 0 | 0 | 110.7 | T47 V48 S53 K54 | T47-D50 PolarHBondContact O-N 3.03Å; V48-D50 VanDerWaalsContact C-N 3.32Å; V48-D50 PolarHBondContact O-N 3.32Å; D50-S53 PolarHBondContact O-N 3.41Å; D50-S53 PolarHBondContact O-OG 3.22Å; D50-K54 PolarHBondContact O-N 3.22Å |
| 51 | I | 94.6 | Very high | 94 | Very high | 17 Ų | 17 | 49.6 Ų | 49.6 | 9% | 0.087 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -60.7 | -47.9 | 174.2 | -66.7 | 164.2 | 0 | 0 | 0 | 110.5 | T47 V48 S53 K54 M55 L277 A278 V281 | T47-I51 WeakPolarHBondContact O-CG1 3.46Å; T47-I51 PolarHBondContact O-N 2.66Å; T47-I51 VanDerWaalsContact O-N 3.11Å; V48-I51 PolarHBondContact O-N 2.94Å; I51-S53 VanDerWaalsContact C-N 3.34Å; I51-S53 PolarHBondContact O-N 3.22Å; I51-K54 PolarHBondContact O-N 3.1Å; I51-M55 HydrophobicContact CG2-CG 3.91Å; I51-M55 HydrophobicContact CG2-SD 3.52Å; I51-M55 VanDerWaalsContact CG2-SD 3.52Å; I51-M55 WeakPolarHBondContact O-CB 3.16Å; I51-M55 WeakPolarHBondContact O-CG 3.4Å; I51-M55 PolarHBondContact O-N 2.88Å; I51-L277 HydrophobicContact CG1-CB 4.09Å; I51-A278 HydrophobicContact CG2-CB 3.65Å; I51-V281 HydrophobicContact CD1-CB 3.73Å; I51-V281 HydrophobicContact CD1-CG1 3.99Å; I51-V281 HydrophobicContact CD1-CG2 3.59Å |
| 52 | E | 95.2 | Very high | 94.1 | Very high | 117 Ų | 117 | 53.9 Ų | 53.9 | 55% | 0.547 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -58.8 | -46.1 | -179.8 | -175 | -84.4 | 161.1 | 0 | 0 | 111.1 | V48 P49 K54 M55 A56 | V48-E52 WeakPolarHBondContact O-CB 3.28Å; V48-E52 PolarHBondContact O-N 3.49Å; P49-E52 PolarHBondContact O-N 3.25Å; E52-K54 PolarHBondContact O-N 3.43Å; E52-M55 PolarHBondContact O-N 3.29Å; E52-A56 WeakPolarHBondContact O-CB 3.33Å; E52-A56 PolarHBondContact O-N 2.9Å |
| 53 | S | 95.6 | Very high | 94.2 | Very high | 57 Ų | 57 | 55.5 Ų | 55.5 | 40% | 0.399 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -58.1 | -34.4 | 179.6 | 76.3 | 0 | 0 | 0 | 0 | 113.2 | P49 D50 I51 L57 | P49-S53 WeakPolarHBondContact O-CB 3.36Å; P49-S53 PolarHBondContact O-N 2.71Å; D50-S53 PolarHBondContact O-N 3.41Å; D50-S53 PolarHBondContact O-OG 3.22Å; I51-S53 VanDerWaalsContact C-N 3.34Å; I51-S53 PolarHBondContact O-N 3.22Å; S53-L57 WeakPolarHBondContact O-CG 3.43Å |
| 54 | K | 93.9 | Very high | 94.4 | Very high | 64 Ų | 64 | 53.2 Ų | 53.2 | 28% | 0.278 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -84.4 | -39.2 | 177.9 | -65.7 | -69.8 | 174.7 | -175.6 | 0 | 112.1 | D50 I51 E52 A56 L57 E270 | D50-K54 PolarHBondContact O-N 3.22Å; I51-K54 PolarHBondContact O-N 3.1Å; E52-K54 PolarHBondContact O-N 3.43Å; K54-A56 VanDerWaalsContact C-N 3.35Å; K54-L57 HydrophobicContact CD-CD1 4.25Å; K54-L57 WeakPolarHBondContact O-CB 3.25Å; K54-L57 WeakPolarHBondContact O-CG 3.45Å; K54-L57 PolarHBondContact O-N 3.25Å; K54-E270 HydrophobicContact CD-CB 4.24Å; K54-E270 IonicContact NZ-OE1 2.97Å; K54-E270 PolarHBondContact NZ-OE1 3.4Å; K54-E270 IonicContact NZ-OE2 3.66Å; K54-E270 PolarHBondContact NZ-OE2 3.2Å |
| 55 | M | 94.8 | Very high | 94.6 | Very high | 49 Ų | 49 | 55.2 Ų | 55.2 | 24% | 0.241 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -67.7 | -36.2 | 178.8 | -74.3 | -171.8 | 75.4 | 0 | 0 | 112.4 | I51 E52 L57 S61 A278 | I51-M55 HydrophobicContact CG2-CG 3.91Å; I51-M55 HydrophobicContact CG2-SD 3.52Å; I51-M55 VanDerWaalsContact CG2-SD 3.52Å; I51-M55 WeakPolarHBondContact O-CB 3.16Å; I51-M55 WeakPolarHBondContact O-CG 3.4Å; I51-M55 PolarHBondContact O-N 2.88Å; E52-M55 PolarHBondContact O-N 3.29Å; M55-L57 PolarHBondContact O-N 2.99Å; M55-S61 WeakPolarHBondContact CA-OG 3.3Å; M55-S61 PolarHBondContact O-OG 3.33Å; M55-A278 HydrophobicContact CE-CB 4.43Å; M55-A278 HydrophobicContact SD-CB 3.61Å |
| 56 | A | 95.8 | Very high | 94.8 | Very high | 71 Ų | 71 | 56.8 Ų | 56.8 | 59% | 0.587 | 31% | 0.307 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.9 | -17.3 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | E52 K54 H58 | E52-A56 WeakPolarHBondContact O-CB 3.33Å; E52-A56 PolarHBondContact O-N 2.9Å; K54-A56 VanDerWaalsContact C-N 3.35Å; A56-H58 VanDerWaalsContact C-N 3.3Å; A56-H58 PolarHBondContact O-N 3.25Å |
| 57 | L | 94.2 | Very high | 95 | Very high | 62 Ų | 62 | 57 Ų | 57 | 33% | 0.325 | 31% | 0.305 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.6 | -39.2 | 179.6 | -67.1 | 175.4 | 0 | 0 | 0 | 112.5 | S53 K54 M55 E130 E270 P271 | S53-L57 WeakPolarHBondContact O-CG 3.43Å; K54-L57 HydrophobicContact CD-CD1 4.25Å; K54-L57 WeakPolarHBondContact O-CB 3.25Å; K54-L57 WeakPolarHBondContact O-CG 3.45Å; K54-L57 PolarHBondContact O-N 3.25Å; M55-L57 PolarHBondContact O-N 2.99Å; L57-E130 HydrophobicContact CB-CB 4.25Å; L57-E130 HydrophobicContact CB-CG 4.28Å; L57-E130 HydrophobicContact CD2-CG 4.37Å; L57-E270 HydrophobicContact CD1-CB 3.65Å; L57-E270 WeakPolarHBondContact CD1-OE2 3.41Å; L57-P271 HydrophobicContact CB-CG 3.9Å |
| 58 | H | 95.7 | Very high | 95.2 | Very high | 25 Ų | 25 | 55.2 Ų | 55.2 | 12% | 0.116 | 30% | 0.295 | C | S | . | . | trans | -161.5 | 149.5 | -176.9 | -166 | -99.5 | 0 | 0 | 0 | 112.7 | A56 I60 S61 E125 A131 P271 | A56-H58 VanDerWaalsContact C-N 3.3Å; A56-H58 PolarHBondContact O-N 3.25Å; H58-I60 HydrophobicContact CB-CG2 4.12Å; H58-I60 VanDerWaalsContact ND1-CB 3.31Å; H58-I60 WeakPolarHBondContact ND1-CB 3.24Å; H58-I60 VanDerWaalsContact ND1-CG2 3.28Å; H58-I60 WeakPolarHBondContact ND1-CG2 3.4Å; H58-I60 PolarHBondContact ND1-N 3.13Å; H58-I60 VanDerWaalsContact ND1-N 3.14Å; H58-I60 PolarHBondContact O-N 3.49Å; H58-I60 VanDerWaalsContact O-N 3.11Å; H58-S61 WeakPolarHBondContact O-CB 3.41Å; H58-S61 PolarHBondContact O-N 2.87Å; H58-S61 VanDerWaalsContact O-N 3.16Å; H58-S61 PolarHBondContact O-OG 3.3Å; H58-E125 IonicContact CD2-OE1 2.67Å; H58-E125 IonicContact CE1-OE2 2.73Å; H58-E125 IonicContact NE2-OE1 3.7Å; H58-E125 IonicContact NE2-OE2 3.17Å; H58-E125 PolarHBondContact NE2-OE2 2.85Å; H58-E125 VanDerWaalsContact NE2-OE2 3.13Å; H58-A131 HydrophobicContact CB-CB 4.41Å; H58-A131 WeakPolarHBondContact ND1-CB 3.19Å; H58-P271 HydrophobicContact CB-CB 3.85Å; H58-P271 HydrophobicContact CB-CG 3.56Å | ||
| 59 | W | 95.1 | Very high | 95.2 | Very high | 142 Ų | 142 | 53.9 Ų | 53.9 | 54% | 0.538 | 28% | 0.284 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.2 | -18.3 | -179.5 | 66.3 | -89.7 | 0 | 0 | 0 | 113.8 | S61 I62 V63 M119 | W59-S61 PolarHBondContact O-N 3.33Å; W59-I62 VanDerWaalsContact O-CB 3.32Å; W59-I62 WeakPolarHBondContact O-CB 3.27Å; W59-I62 PolarHBondContact O-N 2.94Å; W59-V63 HydrophobicContact CE3-CG2 3.63Å; W59-V63 HydrophobicContact CH2-CG2 4.43Å; W59-V63 HydrophobicContact CZ3-CG2 3.34Å; W59-V63 PolarHBondContact O-N 3.2Å; W59-M119 HydrophobicContact CH2-SD 4.4Å; W59-M119 HydrophobicContact CZ2-CE 3.84Å; W59-M119 HydrophobicContact CZ2-SD 4.02Å |
| 60 | I | 95.7 | Very high | 95.2 | Very high | 0 Ų | 0 | 54.1 Ų | 54.1 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -60.3 | -25.5 | 175.4 | -160.8 | 74 | 0 | 0 | 0 | 112.2 | H58 I62 V63 E64 V112 I115 A131 P271 | H58-I60 HydrophobicContact CB-CG2 4.12Å; H58-I60 VanDerWaalsContact ND1-CB 3.31Å; H58-I60 WeakPolarHBondContact ND1-CB 3.24Å; H58-I60 VanDerWaalsContact ND1-CG2 3.28Å; H58-I60 WeakPolarHBondContact ND1-CG2 3.4Å; H58-I60 PolarHBondContact ND1-N 3.13Å; H58-I60 VanDerWaalsContact ND1-N 3.14Å; H58-I60 PolarHBondContact O-N 3.49Å; H58-I60 VanDerWaalsContact O-N 3.11Å; I60-I62 PolarHBondContact O-N 3.35Å; I60-V63 HydrophobicContact CD1-CB 4.12Å; I60-V63 HydrophobicContact CD1-CG1 4.48Å; I60-V63 HydrophobicContact CD1-CG2 4.15Å; I60-V63 WeakPolarHBondContact O-CB 3.48Å; I60-V63 PolarHBondContact O-N 2.9Å; I60-V63 VanDerWaalsContact O-N 3.08Å; I60-E64 PolarHBondContact O-N 3.11Å; I60-V112 HydrophobicContact CD1-CG1 3.76Å; I60-V112 HydrophobicContact CG1-CG1 3.44Å; I60-V112 VanDerWaalsContact CG1-CG1 3.44Å; I60-I115 HydrophobicContact CD1-CG2 4.04Å; I60-A131 HydrophobicContact CG2-CB 4.05Å; I60-P271 HydrophobicContact CG2-CB 3.38Å; I60-P271 HydrophobicContact CG2-CG 4.19Å |
| 61 | S | 96.2 | Very high | 95.3 | Very high | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -58 | -36.3 | 172.1 | -43 | 0 | 0 | 0 | 0 | 112 | M55 H58 W59 F65 P271 | M55-S61 WeakPolarHBondContact CA-OG 3.3Å; M55-S61 PolarHBondContact O-OG 3.33Å; H58-S61 WeakPolarHBondContact O-CB 3.41Å; H58-S61 PolarHBondContact O-N 2.87Å; H58-S61 VanDerWaalsContact O-N 3.16Å; H58-S61 PolarHBondContact O-OG 3.3Å; W59-S61 PolarHBondContact O-N 3.33Å; S61-F65 WeakPolarHBondContact O-CB 3.41Å; S61-F65 PolarHBondContact O-N 3.26Å; S61-P271 WeakPolarHBondContact CA-O 3.41Å; S61-P271 VanDerWaalsContact CB-O 3.28Å; S61-P271 WeakPolarHBondContact CB-O 3.44Å; S61-P271 WeakPolarHBondContact OG-CA 3.42Å; S61-P271 VanDerWaalsContact OG-CB 3.26Å; S61-P271 WeakPolarHBondContact OG-CB 3.38Å; S61-P271 PolarHBondContact OG-O 3.02Å |
| 62 | I | 96 | Very high | 95 | Very high | 96 Ų | 96 | 50.5 Ų | 50.5 | 49% | 0.492 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -70.4 | -39.2 | 177.2 | -58.4 | 173.9 | 0 | 0 | 0 | 109.9 | W59 I60 F65 L66 | W59-I62 VanDerWaalsContact O-CB 3.32Å; W59-I62 WeakPolarHBondContact O-CB 3.27Å; W59-I62 PolarHBondContact O-N 2.94Å; I60-I62 PolarHBondContact O-N 3.35Å; I62-F65 PolarHBondContact O-N 2.92Å; I62-L66 HydrophobicContact CG2-CD1 3.92Å; I62-L66 HydrophobicContact CG2-CG 4.24Å; I62-L66 WeakPolarHBondContact O-CB 3.36Å; I62-L66 VanDerWaalsContact O-CG 3.26Å; I62-L66 WeakPolarHBondContact O-CG 3.42Å; I62-L66 PolarHBondContact O-N 2.66Å |
| 63 | V | 96.9 | Very high | 94.7 | Very high | 35 Ų | 35 | 49.5 Ų | 49.5 | 21% | 0.212 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -61.2 | -49.3 | 175.4 | -178.2 | 0 | 0 | 0 | 0 | 110.2 | W59 I60 F65 L66 T67 V112 I115 | W59-V63 HydrophobicContact CE3-CG2 3.63Å; W59-V63 HydrophobicContact CH2-CG2 4.43Å; W59-V63 HydrophobicContact CZ3-CG2 3.34Å; W59-V63 PolarHBondContact O-N 3.2Å; I60-V63 HydrophobicContact CD1-CB 4.12Å; I60-V63 HydrophobicContact CD1-CG1 4.48Å; I60-V63 HydrophobicContact CD1-CG2 4.15Å; I60-V63 WeakPolarHBondContact O-CB 3.48Å; I60-V63 PolarHBondContact O-N 2.9Å; I60-V63 VanDerWaalsContact O-N 3.08Å; V63-F65 PolarHBondContact O-N 2.88Å; V63-L66 PolarHBondContact O-N 2.91Å; V63-T67 WeakPolarHBondContact O-CB 3.5Å; V63-T67 PolarHBondContact O-N 3.44Å; V63-T67 PolarHBondContact O-OG1 3.09Å; V63-V112 HydrophobicContact CG1-CG2 4.15Å; V63-I115 HydrophobicContact CG1-CD1 4.4Å |
| 64 | E | 96.9 | Very high | 94.5 | Very high | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -56.2 | -49.9 | 176.1 | 180 | 62.1 | -167.2 | 0 | 0 | 111.4 | I60 L66 T67 L68 G108 I109 V112 I272 | I60-E64 PolarHBondContact O-N 3.11Å; E64-L66 PolarHBondContact O-N 2.88Å; E64-T67 PolarHBondContact O-N 3.4Å; E64-L68 HydrophobicContact CG-CD1 4.22Å; E64-L68 WeakPolarHBondContact O-CG 3.38Å; E64-L68 PolarHBondContact O-N 3.44Å; E64-G108 VanDerWaalsContact OE2-C 3.3Å; E64-I109 PolarHBondContact OE1-N 3.37Å; E64-V112 HydrophobicContact CB-CG1 4.27Å; E64-V112 HydrophobicContact CB-CG2 4.38Å; E64-V112 WeakPolarHBondContact OE2-CB 3.33Å; E64-V112 WeakPolarHBondContact OE2-CG2 3.42Å; E64-I272 HydrophobicContact CG-CG2 4.09Å |
| 65 | F | 96.5 | Very high | 94.3 | Very high | 50 Ų | 50 | 51.1 Ų | 51.1 | 22% | 0.219 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -59.4 | -44.7 | 179.3 | -174.8 | -111.5 | 0 | 0 | 0 | 112.5 | S61 I62 V63 L68 I69 A278 M279 | S61-F65 WeakPolarHBondContact O-CB 3.41Å; S61-F65 PolarHBondContact O-N 3.26Å; I62-F65 PolarHBondContact O-N 2.92Å; V63-F65 PolarHBondContact O-N 2.88Å; F65-L68 PolarHBondContact O-N 3.04Å; F65-I69 HydrophobicContact CD1-CD1 3.72Å; F65-I69 HydrophobicContact CE1-CD1 3.35Å; F65-I69 HydrophobicContact CE1-CG1 4.4Å; F65-I69 HydrophobicContact CE2-CD1 4.45Å; F65-I69 HydrophobicContact CG-CD1 4.42Å; F65-I69 HydrophobicContact CZ-CD1 3.76Å; F65-I69 HydrophobicContact CZ-CG1 4.45Å; F65-I69 WeakPolarHBondContact O-CG1 3.36Å; F65-I69 PolarHBondContact O-N 3.28Å; F65-A278 HydrophobicContact CD2-CB 3.74Å; F65-A278 HydrophobicContact CE2-CB 3.86Å; F65-M279 HydrophobicContact CD2-CB 4.22Å; F65-M279 HydrophobicContact CE2-CB 4.3Å; F65-M279 HydrophobicContact CE2-SD 4.37Å |
| 66 | L | 96.6 | Very high | 93.9 | Very high | 101 Ų | 101 | 52.5 Ų | 52.5 | 53% | 0.529 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -67.7 | -36.9 | 177.4 | -70.9 | 176.1 | 0 | 0 | 0 | 112.6 | I62 V63 E64 L68 I69 L70 | I62-L66 HydrophobicContact CG2-CD1 3.92Å; I62-L66 HydrophobicContact CG2-CG 4.24Å; I62-L66 WeakPolarHBondContact O-CB 3.36Å; I62-L66 VanDerWaalsContact O-CG 3.26Å; I62-L66 WeakPolarHBondContact O-CG 3.42Å; I62-L66 PolarHBondContact O-N 2.66Å; V63-L66 PolarHBondContact O-N 2.91Å; E64-L66 PolarHBondContact O-N 2.88Å; L66-L68 VanDerWaalsContact C-N 3.35Å; L66-I69 HydrophobicContact CD2-CD1 4.47Å; L66-I69 PolarHBondContact O-N 3.41Å; L66-L70 WeakPolarHBondContact O-CB 3.39Å; L66-L70 PolarHBondContact O-N 3.34Å |
| 67 | T | 96.1 | Very high | 93.3 | Very high | 22 Ų | 22 | 58.8 Ų | 58.8 | 14% | 0.135 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -63 | -43 | 174 | -65.7 | 0 | 0 | 0 | 0 | 110.8 | V63 E64 L70 F71 | V63-T67 WeakPolarHBondContact O-CB 3.5Å; V63-T67 PolarHBondContact O-N 3.44Å; V63-T67 PolarHBondContact O-OG1 3.09Å; E64-T67 PolarHBondContact O-N 3.4Å; T67-L70 WeakPolarHBondContact O-CB 3.35Å; T67-L70 PolarHBondContact O-N 3.12Å; T67-F71 HydrophobicContact CG2-CD2 4.12Å; T67-F71 HydrophobicContact CG2-CE1 4.36Å; T67-F71 HydrophobicContact CG2-CE2 3.58Å; T67-F71 HydrophobicContact CG2-CZ 3.72Å; T67-F71 WeakPolarHBondContact O-CG 3.42Å; T67-F71 PolarHBondContact O-N 3.26Å |
| 68 | L | 94.8 | Very high | 93 | Very high | 0 Ų | 0 | 62.5 Ų | 62.5 | 0% | 0 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -66.8 | -39.1 | 175.6 | -66.6 | 175.9 | 0 | 0 | 0 | 112.1 | E64 F65 L66 L70 F71 V72 P104 Y105 L276 M279 | E64-L68 HydrophobicContact CG-CD1 4.22Å; E64-L68 WeakPolarHBondContact O-CG 3.38Å; E64-L68 PolarHBondContact O-N 3.44Å; F65-L68 PolarHBondContact O-N 3.04Å; L66-L68 VanDerWaalsContact C-N 3.35Å; L68-L70 VanDerWaalsContact C-N 3.33Å; L68-L70 PolarHBondContact O-N 3.25Å; L68-F71 PolarHBondContact O-N 3.03Å; L68-V72 WeakPolarHBondContact O-CB 3.43Å; L68-V72 WeakPolarHBondContact O-CG2 3.43Å; L68-V72 PolarHBondContact O-N 3.36Å; L68-P104 WeakPolarHBondContact CD2-O 3.21Å; L68-Y105 HydrophobicContact CD1-CD1 3.93Å; L68-Y105 HydrophobicContact CD1-CE1 4.06Å; L68-Y105 HydrophobicContact CD2-CD1 3.91Å; L68-Y105 HydrophobicContact CD2-CE1 4.49Å; L68-L276 HydrophobicContact CD1-CD1 4.42Å; L68-M279 HydrophobicContact CB-CB 4.16Å; L68-M279 HydrophobicContact CB-CG 3.85Å; L68-M279 HydrophobicContact CB-SD 4.34Å; L68-M279 HydrophobicContact CD1-CB 3.7Å; L68-M279 HydrophobicContact CD1-CG 4.13Å |
| 69 | I | 94.1 | Very high | 92.6 | Very high | 51 Ų | 51 | 65.4 Ų | 65.4 | 26% | 0.262 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -59.5 | -45.7 | 172 | -73 | 169.6 | 0 | 0 | 0 | 110.8 | F65 L66 F71 V73 I74 M279 | F65-I69 HydrophobicContact CD1-CD1 3.72Å; F65-I69 HydrophobicContact CE1-CD1 3.35Å; F65-I69 HydrophobicContact CE1-CG1 4.4Å; F65-I69 HydrophobicContact CE2-CD1 4.45Å; F65-I69 HydrophobicContact CG-CD1 4.42Å; F65-I69 HydrophobicContact CZ-CD1 3.76Å; F65-I69 HydrophobicContact CZ-CG1 4.45Å; F65-I69 WeakPolarHBondContact O-CG1 3.36Å; F65-I69 PolarHBondContact O-N 3.28Å; L66-I69 HydrophobicContact CD2-CD1 4.47Å; L66-I69 PolarHBondContact O-N 3.41Å; I69-F71 VanDerWaalsContact C-N 3.27Å; I69-F71 PolarHBondContact O-N 3.5Å; I69-V73 HydrophobicContact CG2-CB 4.43Å; I69-V73 HydrophobicContact CG2-CG2 4.34Å; I69-V73 WeakPolarHBondContact O-CA 3.41Å; I69-V73 VanDerWaalsContact O-CB 3.28Å; I69-V73 WeakPolarHBondContact O-CB 3.29Å; I69-V73 PolarHBondContact O-N 3.37Å; I69-I74 PolarHBondContact O-N 2.85Å; I69-M279 HydrophobicContact CG1-SD 4.16Å |
| 70 | L | 94.5 | Very high | 92.1 | Very high | 71 Ų | 71 | 60.3 Ų | 60.3 | 37% | 0.372 | 29% | 0.294 | S | S | . | . | I | π-helix | trans | -57 | -43 | 176.7 | 177.7 | 68.7 | 0 | 0 | 0 | 111 | L66 T67 L68 I74 L75 | L66-L70 WeakPolarHBondContact O-CB 3.39Å; L66-L70 PolarHBondContact O-N 3.34Å; T67-L70 WeakPolarHBondContact O-CB 3.35Å; T67-L70 PolarHBondContact O-N 3.12Å; L68-L70 VanDerWaalsContact C-N 3.33Å; L68-L70 PolarHBondContact O-N 3.25Å; L70-I74 HydrophobicContact CD1-CB 4.03Å; L70-I74 HydrophobicContact CD1-CD1 3.9Å; L70-I74 HydrophobicContact CD1-CG2 4.05Å; L70-I74 WeakPolarHBondContact O-CB 3.15Å; L70-I74 PolarHBondContact O-N 3.35Å; L70-L75 HydrophobicContact CD1-CD1 4.43Å; L70-L75 HydrophobicContact CD1-CG 4.3Å; L70-L75 HydrophobicContact CG-CD1 4.11Å; L70-L75 HydrophobicContact CG-CG 4.32Å; L70-L75 WeakPolarHBondContact O-CB 3.49Å; L70-L75 WeakPolarHBondContact O-CG 3.47Å; L70-L75 PolarHBondContact O-N 2.93Å |
| 71 | F | 92.4 | Very high | 91.6 | Very high | 12 Ų | 12 | 64 Ų | 64 | 5% | 0.053 | 32% | 0.317 | C | S | . | . | I | π-helix | trans | -74.8 | -47.4 | -178.3 | -66 | -11.2 | 0 | 0 | 0 | 113.5 | T67 L68 I69 L75 E76 F100 P104 L107 I111 | T67-F71 HydrophobicContact CG2-CD2 4.12Å; T67-F71 HydrophobicContact CG2-CE1 4.36Å; T67-F71 HydrophobicContact CG2-CE2 3.58Å; T67-F71 HydrophobicContact CG2-CZ 3.72Å; T67-F71 WeakPolarHBondContact O-CG 3.42Å; T67-F71 PolarHBondContact O-N 3.26Å; L68-F71 PolarHBondContact O-N 3.03Å; I69-F71 VanDerWaalsContact C-N 3.27Å; I69-F71 PolarHBondContact O-N 3.5Å; F71-L75 HydrophobicContact CD1-CD1 4.06Å; F71-L75 HydrophobicContact CE1-CD1 4.31Å; F71-L75 CarbonylContact O-C 3.57Å; F71-E76 PolarHBondContact O-N 3.5Å; F71-F100 HydrophobicContact CB-CB 4.23Å; F71-F100 HydrophobicContact CB-CD1 4.33Å; F71-F100 AromaticContact CD1-CD1 3.42Å; F71-F100 HydrophobicContact CD1-CD1 3.42Å; F71-F100 VanDerWaalsContact CD1-CD1 3.42Å; F71-F100 AromaticContact CD1-CE1 3.82Å; F71-F100 HydrophobicContact CD1-CE1 3.82Å; F71-F100 HydrophobicContact CD1-CG 4.25Å; F71-F100 HydrophobicContact CD2-CD1 4.22Å; F71-F100 AromaticContact CE1-CD1 3.64Å; F71-F100 HydrophobicContact CE1-CD1 3.64Å; F71-F100 AromaticContact CE1-CE1 3.53Å; F71-F100 HydrophobicContact CE1-CE1 3.53Å; F71-F100 HydrophobicContact CE2-CD1 4.4Å; F71-F100 AromaticContact CG-CD1 3.74Å; F71-F100 HydrophobicContact CG-CD1 3.74Å; F71-F100 HydrophobicContact CG-CE1 4.47Å; F71-F100 HydrophobicContact CZ-CD1 4.13Å; F71-F100 AromaticContact CZ-CE1 3.95Å; F71-F100 HydrophobicContact CZ-CE1 3.95Å; F71-P104 HydrophobicContact CB-CB 4.16Å; F71-L107 HydrophobicContact CD2-CB 4.17Å; F71-L107 HydrophobicContact CE2-CB 3.75Å; F71-I111 HydrophobicContact CE2-CD1 3.94Å; F71-I111 HydrophobicContact CZ-CD1 3.54Å |
| 72 | V | 88.1 | Confident | 90.9 | Very high | 35 Ų | 35 | 66.1 Ų | 66.1 | 21% | 0.212 | 33% | 0.328 | C | S | . | . | I | π-helix | trans | -79.3 | -35.4 | -172.9 | 177.4 | 0 | 0 | 0 | 0 | 112.1 | L68 E76 P104 M279 | L68-V72 WeakPolarHBondContact O-CB 3.43Å; L68-V72 WeakPolarHBondContact O-CG2 3.43Å; L68-V72 PolarHBondContact O-N 3.36Å; V72-E76 WeakPolarHBondContact O-CB 3.21Å; V72-P104 HydrophobicContact CG2-CB 3.51Å; V72-P104 HydrophobicContact CG2-CG 3.89Å; V72-M279 HydrophobicContact CB-CE 3.76Å; V72-M279 HydrophobicContact CG1-CE 3.66Å; V72-M279 HydrophobicContact CG2-CE 4.05Å |
| 73 | V | 88.9 | Confident | 90.2 | Very high | 96 Ų | 96 | 64.7 Ų | 64.7 | 58% | 0.582 | 33% | 0.325 | S | S | * | . | I | π-helix | trans | -101.2 | -48.9 | -174.4 | -176.1 | 0 | 0 | 0 | 0 | 111.7 | I69 | I69-V73 HydrophobicContact CG2-CB 4.43Å; I69-V73 HydrophobicContact CG2-CG2 4.34Å; I69-V73 WeakPolarHBondContact O-CA 3.41Å; I69-V73 VanDerWaalsContact O-CB 3.28Å; I69-V73 WeakPolarHBondContact O-CB 3.29Å; I69-V73 PolarHBondContact O-N 3.37Å |
| 74 | I | 91 | Very high | 89.4 | Confident | 115 Ų | 115 | 66.1 Ų | 66.1 | 59% | 0.59 | 33% | 0.331 | S | S | * | . | I | π-helix | trans | -86.7 | -45.8 | -170.3 | -59.9 | 173.8 | 0 | 0 | 0 | 111 | I69 L70 | I69-I74 PolarHBondContact O-N 2.85Å; L70-I74 HydrophobicContact CD1-CB 4.03Å; L70-I74 HydrophobicContact CD1-CD1 3.9Å; L70-I74 HydrophobicContact CD1-CG2 4.05Å; L70-I74 WeakPolarHBondContact O-CB 3.15Å; L70-I74 PolarHBondContact O-N 3.35Å |
| 75 | L | 90.9 | Very high | 88.4 | Confident | 41 Ų | 41 | 70.7 Ų | 70.7 | 22% | 0.215 | 35% | 0.351 | C | S | . | . | S | Bend | trans | -96.2 | 10.2 | -176.1 | -60.2 | -177 | 0 | 0 | 0 | 113.8 | L70 F71 R77 Y78 F100 | L70-L75 HydrophobicContact CD1-CD1 4.43Å; L70-L75 HydrophobicContact CD1-CG 4.3Å; L70-L75 HydrophobicContact CG-CD1 4.11Å; L70-L75 HydrophobicContact CG-CG 4.32Å; L70-L75 WeakPolarHBondContact O-CB 3.49Å; L70-L75 WeakPolarHBondContact O-CG 3.47Å; L70-L75 PolarHBondContact O-N 2.93Å; F71-L75 HydrophobicContact CD1-CD1 4.06Å; F71-L75 HydrophobicContact CE1-CD1 4.31Å; F71-L75 CarbonylContact O-C 3.57Å; L75-R77 PolarHBondContact O-N 2.86Å; L75-R77 VanDerWaalsContact O-N 3.12Å; L75-Y78 HydrophobicContact CD2-CG 4.47Å; L75-Y78 WeakPolarHBondContact O-CB 3.48Å; L75-Y78 PolarHBondContact O-N 3.49Å; L75-F100 HydrophobicContact CB-CB 4.01Å; L75-F100 HydrophobicContact CB-CD2 3.87Å; L75-F100 HydrophobicContact CB-CG 3.95Å; L75-F100 HydrophobicContact CD1-CD1 4.32Å; L75-F100 HydrophobicContact CD1-CD2 4.08Å; L75-F100 HydrophobicContact CD1-CE1 4.24Å; L75-F100 HydrophobicContact CD1-CE2 3.99Å; L75-F100 HydrophobicContact CD1-CG 4.24Å; L75-F100 HydrophobicContact CD1-CZ 4.08Å |
| 76 | E | 84.8 | Confident | 87.4 | Confident | 78 Ų | 78 | 69.9 Ų | 69.9 | 36% | 0.364 | 35% | 0.351 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -51.7 | -41 | -178.3 | -163.9 | -156.6 | 159.4 | 0 | 0 | 112.6 | F71 V72 | F71-E76 PolarHBondContact O-N 3.5Å; V72-E76 WeakPolarHBondContact O-CB 3.21Å |
| 77 | R | 84.6 | Confident | 86.4 | Confident | 203 Ų | 203 | 72.2 Ų | 72.2 | 77% | 0.766 | 36% | 0.364 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.4 | -3.1 | -177.1 | -60.3 | -174.1 | -178.8 | -158.8 | 0.6 | 113.5 | L75 E79 | L75-R77 PolarHBondContact O-N 2.86Å; L75-R77 VanDerWaalsContact O-N 3.12Å; R77-E79 PolarHBondContact O-N 3.05Å |
| 78 | Y | 87.1 | Confident | 85.6 | Confident | 139 Ų | 139 | 76.7 Ų | 76.7 | 55% | 0.545 | 40% | 0.396 | S | S | . | . | P | Polyproline II helix | trans | -76.6 | 119.6 | -176.4 | -167.6 | -96.1 | 0 | 0 | 0 | 110.4 | L75 V80 F100 | L75-Y78 HydrophobicContact CD2-CG 4.47Å; L75-Y78 WeakPolarHBondContact O-CB 3.48Å; L75-Y78 PolarHBondContact O-N 3.49Å; Y78-V80 HydrophobicContact CD1-CG2 3.85Å; Y78-V80 HydrophobicContact CE1-CG2 3.97Å; Y78-F100 HydrophobicContact CD1-CD2 4.37Å; Y78-F100 HydrophobicContact CD1-CE2 4.02Å |
| 79 | E | 86.5 | Confident | 84.8 | Confident | 86 Ų | 86 | 81.6 Ų | 81.6 | 40% | 0.402 | 42% | 0.419 | S | S | . | . | P | Polyproline II helix | trans | -96.1 | 117.7 | 179.5 | -66.5 | -178.2 | 173.2 | 0 | 0 | 110.4 | R77 R96 K98 | R77-E79 PolarHBondContact O-N 3.05Å; E79-R96 HydrophobicContact CB-CB 4.08Å; E79-K98 HydrophobicContact CG-CG 3.87Å |
| 80 | V | 85.8 | Confident | 84 | Confident | 36 Ų | 36 | 87.3 Ų | 87.3 | 22% | 0.218 | 44% | 0.442 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.9 | 130.2 | 177 | -176 | 0 | 0 | 0 | 0 | 108.6 | Y78 I82 Q97 I99 F100 | Y78-V80 HydrophobicContact CD1-CG2 3.85Å; Y78-V80 HydrophobicContact CE1-CG2 3.97Å; V80-I82 PolarHBondContact O-N 2.89Å; V80-Q97 PolarHBondContact N-O 2.7Å; V80-Q97 PolarHBondContact O-N 2.92Å; V80-I99 HydrophobicContact CB-CD1 3.75Å; V80-I99 HydrophobicContact CB-CG1 4.17Å; V80-I99 HydrophobicContact CG1-CD1 3.96Å; V80-I99 HydrophobicContact CG2-CD1 4.19Å; V80-I99 HydrophobicContact CG2-CG1 4.44Å; V80-F100 HydrophobicContact CG2-CD2 4.2Å; V80-F100 HydrophobicContact CG2-CE2 3.65Å; V80-F100 HydrophobicContact CG2-CZ 4.45Å |
| 81 | P | 84.1 | Confident | 83.3 | Confident | 76 Ų | 76 | 90.9 Ų | 90.9 | 49% | 0.494 | 45% | 0.454 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.6 | 111.2 | 172.9 | 29 | -31.8 | 0 | 0 | 0 | 109.9 | F94 | P81-F94 HydrophobicContact CB-CD1 4.35Å |
| 82 | I | 82.3 | Confident | 82.6 | Confident | 45 Ų | 45 | 96.9 Ų | 96.9 | 23% | 0.231 | 48% | 0.481 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.9 | 134.1 | 178 | -49.4 | 173.9 | 0 | 0 | 0 | 109.4 | V80 I84 F94 T95 Q97 I99 | V80-I82 PolarHBondContact O-N 2.89Å; I82-I84 PolarHBondContact O-N 3.49Å; I82-F94 WeakPolarHBondContact O-CA 3.31Å; I82-T95 PolarHBondContact N-O 3.41Å; I82-T95 PolarHBondContact O-N 3.04Å; I82-Q97 HydrophobicContact CD1-CB 3.99Å; I82-Q97 HydrophobicContact CD1-CG 4.46Å; I82-I99 HydrophobicContact CD1-CD1 3.24Å; I82-I99 HydrophobicContact CD1-CG1 3.49Å; I82-I99 VanDerWaalsContact CD1-CG1 3.49Å; I82-I99 HydrophobicContact CG1-CD1 3.61Å; I82-I99 HydrophobicContact CG1-CG1 4.23Å |
| 83 | P | 81.4 | Confident | 82.2 | Confident | 67 Ų | 67 | 99.7 Ų | 99.7 | 44% | 0.435 | 49% | 0.49 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.2 | 109.4 | 169.8 | 29.5 | -32.6 | 0 | 0 | 0 | 109.9 | F92 F94 | P83-F92 HydrophobicContact CB-CD1 4.14Å; P83-F94 HydrophobicContact CB-CD1 4.27Å; P83-F94 HydrophobicContact CB-CE1 3.9Å; P83-F94 HydrophobicContact CB-CZ 4.12Å; P83-F94 HydrophobicContact CG-CE1 4.21Å |
| 84 | I | 79.1 | Confident | 81.9 | Confident | 64 Ų | 64 | 102.3 Ų | 102.3 | 33% | 0.328 | 49% | 0.494 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.4 | 129.8 | 172.8 | -56.9 | -179.8 | 0 | 0 | 0 | 108.3 | I82 S86 K93 T95 | I82-I84 PolarHBondContact O-N 3.49Å; I84-S86 PolarHBondContact O-N 3Å; I84-K93 PolarHBondContact N-O 3.33Å; I84-K93 PolarHBondContact O-N 3.21Å; I84-T95 HydrophobicContact CD1-CG2 4.2Å |
| 85 | F | 77.1 | Confident | 81.4 | Confident | 97 Ų | 97 | 99.6 Ų | 99.6 | 43% | 0.425 | 48% | 0.483 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.5 | 111.4 | 173.7 | -170 | -101.2 | 0 | 0 | 0 | 109.7 | L87 F92 | F85-L87 HydrophobicContact CD1-CD1 4.2Å; F85-L87 PolarHBondContact O-N 2.69Å; F85-F92 HydrophobicContact CB-CD1 4.15Å; F85-F92 HydrophobicContact CB-CE1 3.88Å; F85-F92 HydrophobicContact CB-CZ 4.38Å; F85-F92 HydrophobicContact CD2-CD1 4.16Å; F85-F92 AromaticContact CD2-CD2 3.98Å; F85-F92 HydrophobicContact CD2-CD2 3.98Å; F85-F92 AromaticContact CD2-CE1 3.94Å; F85-F92 HydrophobicContact CD2-CE1 3.94Å; F85-F92 AromaticContact CD2-CE2 3.72Å; F85-F92 HydrophobicContact CD2-CE2 3.72Å; F85-F92 HydrophobicContact CD2-CG 4.19Å; F85-F92 AromaticContact CD2-CZ 3.71Å; F85-F92 HydrophobicContact CD2-CZ 3.71Å; F85-F92 HydrophobicContact CE2-CD2 4.48Å; F85-F92 HydrophobicContact CE2-CE2 4.19Å; F85-F92 HydrophobicContact CG-CE1 4.38Å; F85-F92 HydrophobicContact CG-CZ 4.43Å |
| 86 | S | 75.5 | Confident | 81 | Confident | 32 Ų | 32 | 106.5 Ų | 106.5 | 22% | 0.224 | 51% | 0.506 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80 | 112.6 | 174.9 | 177.8 | 0 | 0 | 0 | 0 | 109.7 | I84 S88 E89 K90 K91 | I84-S86 PolarHBondContact O-N 3Å; S86-S88 PolarHBondContact O-N 3.48Å; S86-E89 PolarHBondContact O-N 2.66Å; S86-E89 PolarHBondContact OG-N 3.48Å; S86-K90 WeakPolarHBondContact O-CA 3.34Å; S86-K90 PolarHBondContact O-N 2.84Å; S86-K91 PolarHBondContact N-O 3.36Å |
| 87 | L | 75.3 | Confident | 80.8 | Confident | 151 Ų | 151 | 106 Ų | 106 | 79% | 0.791 | 50% | 0.504 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.8 | -32.6 | 175.3 | -108 | 83.5 | 0 | 0 | 0 | 112.5 | F85 | F85-L87 HydrophobicContact CD1-CD1 4.2Å; F85-L87 PolarHBondContact O-N 2.69Å |
| 88 | S | 78.5 | Confident | 80.7 | Confident | 116 Ų | 116 | 100 Ų | 100 | 81% | 0.811 | 48% | 0.483 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.8 | -41.6 | -178.7 | -174.3 | 0 | 0 | 0 | 0 | 112 | S86 | S86-S88 PolarHBondContact O-N 3.48Š|
| 89 | E | 78.6 | Confident | 80.6 | Confident | 102 Ų | 102 | 95.1 Ų | 95.1 | 48% | 0.477 | 47% | 0.466 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103.2 | -2.5 | -175.2 | -67.5 | -175.9 | -148.3 | 0 | 0 | 114 | S86 K91 K93 | S86-E89 PolarHBondContact O-N 2.66Å; S86-E89 PolarHBondContact OG-N 3.48Å; E89-K91 PolarHBondContact O-N 3.07Å; E89-K91 VanDerWaalsContact O-N 3.09Å; E89-K93 IonicContact OE1-NZ 2.98Å; E89-K93 PolarHBondContact OE1-NZ 3.41Å; E89-K93 WeakPolarHBondContact OE2-CE 3.4Å; E89-K93 IonicContact OE2-NZ 2.66Å; E89-K93 PolarHBondContact OE2-NZ 3.32Å |
| 90 | K | 77.7 | Confident | 80.6 | Confident | 171 Ų | 171 | 93 Ų | 93 | 74% | 0.743 | 46% | 0.455 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48 | 33.9 | -175.5 | -63.8 | -177.6 | 177.5 | 178.7 | 0 | 113.4 | S86 | S86-K90 WeakPolarHBondContact O-CA 3.34Å; S86-K90 PolarHBondContact O-N 2.84Å |
| 91 | K | 80.4 | Confident | 80.4 | Confident | 146 Ų | 146 | 91.9 Ų | 91.9 | 64% | 0.635 | 45% | 0.45 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -131.8 | 149.2 | -179.9 | -73.4 | -179.6 | -177.2 | -179.7 | 0 | 110.7 | S86 E89 K93 | S86-K91 PolarHBondContact N-O 3.36Å; E89-K91 PolarHBondContact O-N 3.07Å; E89-K91 VanDerWaalsContact O-N 3.09Å; K91-K93 PolarHBondContact O-N 3.31Å |
| 92 | F | 77.5 | Confident | 80.3 | Confident | 139 Ų | 139 | 91 Ų | 91 | 61% | 0.61 | 44% | 0.439 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -74.8 | 120 | 168.9 | -74.8 | -82.1 | 0 | 0 | 0 | 109.4 | P83 F85 | P83-F92 HydrophobicContact CB-CD1 4.14Å; F85-F92 HydrophobicContact CB-CD1 4.15Å; F85-F92 HydrophobicContact CB-CE1 3.88Å; F85-F92 HydrophobicContact CB-CZ 4.38Å; F85-F92 HydrophobicContact CD2-CD1 4.16Å; F85-F92 AromaticContact CD2-CD2 3.98Å; F85-F92 HydrophobicContact CD2-CD2 3.98Å; F85-F92 AromaticContact CD2-CE1 3.94Å; F85-F92 HydrophobicContact CD2-CE1 3.94Å; F85-F92 AromaticContact CD2-CE2 3.72Å; F85-F92 HydrophobicContact CD2-CE2 3.72Å; F85-F92 HydrophobicContact CD2-CG 4.19Å; F85-F92 AromaticContact CD2-CZ 3.71Å; F85-F92 HydrophobicContact CD2-CZ 3.71Å; F85-F92 HydrophobicContact CE2-CD2 4.48Å; F85-F92 HydrophobicContact CE2-CE2 4.19Å; F85-F92 HydrophobicContact CG-CE1 4.38Å; F85-F92 HydrophobicContact CG-CZ 4.43Å |
| 93 | K | 78.9 | Confident | 80.6 | Confident | 94 Ų | 94 | 94 Ų | 94 | 41% | 0.409 | 45% | 0.45 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.3 | 129.7 | 170.9 | -74 | -170.8 | 177.7 | -179.8 | 0 | 109.1 | I84 E89 K91 T95 | I84-K93 PolarHBondContact N-O 3.33Å; I84-K93 PolarHBondContact O-N 3.21Å; E89-K93 IonicContact OE1-NZ 2.98Å; E89-K93 PolarHBondContact OE1-NZ 3.41Å; E89-K93 WeakPolarHBondContact OE2-CE 3.4Å; E89-K93 IonicContact OE2-NZ 2.66Å; E89-K93 PolarHBondContact OE2-NZ 3.32Å; K91-K93 PolarHBondContact O-N 3.31Å; K93-T95 PolarHBondContact O-N 3.34Å |
| 94 | F | 81.8 | Confident | 80.9 | Confident | 150 Ų | 150 | 91.2 Ų | 91.2 | 66% | 0.658 | 43% | 0.432 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -75.2 | 114 | 171.1 | -74.7 | -88.5 | 0 | 0 | 0 | 109 | P81 I82 P83 | P81-F94 HydrophobicContact CB-CD1 4.35Å; I82-F94 WeakPolarHBondContact O-CA 3.31Å; P83-F94 HydrophobicContact CB-CD1 4.27Å; P83-F94 HydrophobicContact CB-CE1 3.9Å; P83-F94 HydrophobicContact CB-CZ 4.12Å; P83-F94 HydrophobicContact CG-CE1 4.21Å |
| 95 | T | 80.4 | Confident | 81.5 | Confident | 59 Ų | 59 | 90.4 Ų | 90.4 | 36% | 0.362 | 43% | 0.426 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.9 | 136.8 | 175.5 | -57.4 | 0 | 0 | 0 | 0 | 108.6 | I82 I84 K93 Q97 | I82-T95 PolarHBondContact N-O 3.41Å; I82-T95 PolarHBondContact O-N 3.04Å; I84-T95 HydrophobicContact CD1-CG2 4.2Å; K93-T95 PolarHBondContact O-N 3.34Å; T95-Q97 HydrophobicContact CG2-CG 4.28Å |
| 96 | R | 82.9 | Confident | 82.2 | Confident | 185 Ų | 185 | 91 Ų | 91 | 70% | 0.698 | 43% | 0.433 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -80.7 | 123.1 | 176.6 | -72.1 | -172.1 | -178.1 | -174.5 | 0.1 | 109.6 | E79 | E79-R96 HydrophobicContact CB-CB 4.08Å |
| 97 | Q | 80.6 | Confident | 83 | Confident | 67 Ų | 67 | 91.8 Ų | 91.8 | 31% | 0.313 | 43% | 0.434 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.2 | 147.6 | 179 | -66.2 | -166.1 | -14.1 | 0 | 0 | 111.7 | V80 I82 T95 I99 | V80-Q97 PolarHBondContact N-O 2.7Å; V80-Q97 PolarHBondContact O-N 2.92Å; I82-Q97 HydrophobicContact CD1-CB 3.99Å; I82-Q97 HydrophobicContact CD1-CG 4.46Å; T95-Q97 HydrophobicContact CG2-CG 4.28Å; Q97-I99 VanDerWaalsContact C-N 3.34Å; Q97-I99 PolarHBondContact O-N 3Å; Q97-I99 VanDerWaalsContact O-N 3.15Å |
| 98 | K | 83.8 | Confident | 83.9 | Confident | 77 Ų | 77 | 84.6 Ų | 84.6 | 34% | 0.335 | 40% | 0.397 | S | S | . | . | trans | -87.8 | 65.8 | -179.8 | -62.8 | 179.8 | -178.9 | 177.6 | 0 | 111.3 | E79 F100 S101 Q102 | E79-K98 HydrophobicContact CG-CG 3.87Å; K98-F100 VanDerWaalsContact C-N 3.29Å; K98-F100 PolarHBondContact O-N 2.94Å; K98-S101 PolarHBondContact O-N 3.18Å; K98-Q102 WeakPolarHBondContact O-CG 3.26Å; K98-Q102 PolarHBondContact O-N 2.82Å; K98-Q102 VanDerWaalsContact O-N 3.07Å | ||
| 99 | I | 85.2 | Confident | 84.7 | Confident | 37 Ų | 37 | 80.9 Ų | 80.9 | 19% | 0.19 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -58 | -42.8 | -172.6 | -46.3 | 177.1 | 0 | 0 | 0 | 111.7 | V80 I82 Q97 S101 Q102 F103 L107 | V80-I99 HydrophobicContact CB-CD1 3.75Å; V80-I99 HydrophobicContact CB-CG1 4.17Å; V80-I99 HydrophobicContact CG1-CD1 3.96Å; V80-I99 HydrophobicContact CG2-CD1 4.19Å; V80-I99 HydrophobicContact CG2-CG1 4.44Å; I82-I99 HydrophobicContact CD1-CD1 3.24Å; I82-I99 HydrophobicContact CD1-CG1 3.49Å; I82-I99 VanDerWaalsContact CD1-CG1 3.49Å; I82-I99 HydrophobicContact CG1-CD1 3.61Å; I82-I99 HydrophobicContact CG1-CG1 4.23Å; Q97-I99 VanDerWaalsContact C-N 3.34Å; Q97-I99 PolarHBondContact O-N 3Å; Q97-I99 VanDerWaalsContact O-N 3.15Å; I99-S101 PolarHBondContact O-N 2.59Å; I99-Q102 PolarHBondContact O-N 2.79Å; I99-F103 HydrophobicContact CG2-CD2 4.18Å; I99-F103 PolarHBondContact O-N 3.46Å; I99-L107 HydrophobicContact CB-CD1 4.5Å; I99-L107 HydrophobicContact CG2-CD1 3.69Å |
| 100 | F | 85.3 | Confident | 85.5 | Confident | 41 Ų | 41 | 79.1 Ų | 79.1 | 18% | 0.18 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -63.8 | -28.4 | -177.5 | -63 | -66.2 | 0 | 0 | 0 | 113.3 | F71 L75 Y78 V80 K98 P104 L107 | F71-F100 HydrophobicContact CB-CB 4.23Å; F71-F100 HydrophobicContact CB-CD1 4.33Å; F71-F100 AromaticContact CD1-CD1 3.42Å; F71-F100 HydrophobicContact CD1-CD1 3.42Å; F71-F100 VanDerWaalsContact CD1-CD1 3.42Å; F71-F100 AromaticContact CD1-CE1 3.82Å; F71-F100 HydrophobicContact CD1-CE1 3.82Å; F71-F100 HydrophobicContact CD1-CG 4.25Å; F71-F100 HydrophobicContact CD2-CD1 4.22Å; F71-F100 AromaticContact CE1-CD1 3.64Å; F71-F100 HydrophobicContact CE1-CD1 3.64Å; F71-F100 AromaticContact CE1-CE1 3.53Å; F71-F100 HydrophobicContact CE1-CE1 3.53Å; F71-F100 HydrophobicContact CE2-CD1 4.4Å; F71-F100 AromaticContact CG-CD1 3.74Å; F71-F100 HydrophobicContact CG-CD1 3.74Å; F71-F100 HydrophobicContact CG-CE1 4.47Å; F71-F100 HydrophobicContact CZ-CD1 4.13Å; F71-F100 AromaticContact CZ-CE1 3.95Å; F71-F100 HydrophobicContact CZ-CE1 3.95Å; L75-F100 HydrophobicContact CB-CB 4.01Å; L75-F100 HydrophobicContact CB-CD2 3.87Å; L75-F100 HydrophobicContact CB-CG 3.95Å; L75-F100 HydrophobicContact CD1-CD1 4.32Å; L75-F100 HydrophobicContact CD1-CD2 4.08Å; L75-F100 HydrophobicContact CD1-CE1 4.24Å; L75-F100 HydrophobicContact CD1-CE2 3.99Å; L75-F100 HydrophobicContact CD1-CG 4.24Å; L75-F100 HydrophobicContact CD1-CZ 4.08Å; Y78-F100 HydrophobicContact CD1-CD2 4.37Å; Y78-F100 HydrophobicContact CD1-CE2 4.02Å; V80-F100 HydrophobicContact CG2-CD2 4.2Å; V80-F100 HydrophobicContact CG2-CE2 3.65Å; V80-F100 HydrophobicContact CG2-CZ 4.45Å; K98-F100 VanDerWaalsContact C-N 3.29Å; K98-F100 PolarHBondContact O-N 2.94Å; F100-P104 WeakPolarHBondContact O-CA 3.15Å; F100-P104 WeakPolarHBondContact O-CB 3.47Å; F100-P104 WeakPolarHBondContact O-CD 3.13Å; F100-L107 HydrophobicContact CD1-CD1 3.95Å; F100-L107 HydrophobicContact CE1-CD1 4.21Å |
| 101 | S | 80.9 | Confident | 86.3 | Confident | 14 Ų | 14 | 74.5 Ų | 74.5 | 10% | 0.098 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -87.8 | -29.7 | 175.8 | -176.9 | 0 | 0 | 0 | 0 | 112.6 | K98 I99 P104 V236 | K98-S101 PolarHBondContact O-N 3.18Å; I99-S101 PolarHBondContact O-N 2.59Å; S101-P104 WeakPolarHBondContact O-CD 3.34Å; S101-V236 WeakPolarHBondContact OG-CG1 3.45Å |
| 102 | Q | 83.3 | Confident | 87.1 | Confident | 56 Ų | 56 | 67.5 Ų | 67.5 | 26% | 0.262 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -81.2 | -37.1 | -179.6 | -68.9 | -179.2 | -9.1 | 0 | 0 | 113.5 | K98 I99 T237 | K98-Q102 WeakPolarHBondContact O-CG 3.26Å; K98-Q102 PolarHBondContact O-N 2.82Å; K98-Q102 VanDerWaalsContact O-N 3.07Å; I99-Q102 PolarHBondContact O-N 2.79Å; Q102-T237 HydrophobicContact CG-CG2 4Å |
| 103 | F | 87.4 | Confident | 87.9 | Confident | 108 Ų | 108 | 63.7 Ų | 63.7 | 47% | 0.474 | 30% | 0.3 | S | S | . | . | S | Bend | trans | -130.4 | 43 | -176.7 | -53.5 | -75.3 | 0 | 0 | 0 | 113.6 | I99 Y105 L106 L107 | I99-F103 HydrophobicContact CG2-CD2 4.18Å; I99-F103 PolarHBondContact O-N 3.46Å; F103-Y105 PolarHBondContact O-N 3.34Å; F103-L106 HydrophobicContact CB-CB 4.44Å; F103-L106 PolarHBondContact O-N 3.32Å; F103-L107 WeakPolarHBondContact O-CB 3.43Å; F103-L107 WeakPolarHBondContact O-CG 3.38Å; F103-L107 PolarHBondContact O-N 2.84Å; F103-L107 VanDerWaalsContact O-N 3.09Å |
| 104 | P | 89.4 | Confident | 88.7 | Confident | 9 Ų | 9 | 64.6 Ų | 64.6 | 6% | 0.058 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -57.5 | -48.1 | -175 | 19 | -28.9 | 0 | 0 | 0 | 111.9 | L68 F71 V72 F100 S101 L107 G108 | L68-P104 WeakPolarHBondContact CD2-O 3.21Å; F71-P104 HydrophobicContact CB-CB 4.16Å; V72-P104 HydrophobicContact CG2-CB 3.51Å; V72-P104 HydrophobicContact CG2-CG 3.89Å; F100-P104 WeakPolarHBondContact O-CA 3.15Å; F100-P104 WeakPolarHBondContact O-CB 3.47Å; F100-P104 WeakPolarHBondContact O-CD 3.13Å; S101-P104 WeakPolarHBondContact O-CD 3.34Å; P104-L107 PolarHBondContact O-N 3.47Å; P104-G108 PolarHBondContact O-N 3.01Å |
| 105 | Y | 90.9 | Very high | 89.3 | Confident | 47 Ų | 47 | 60.3 Ų | 60.3 | 18% | 0.184 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -65.6 | -44.8 | -176.7 | -65.1 | -67.5 | 0 | 0 | 0 | 112.9 | L68 F103 L107 G108 I109 L276 M279 G280 | L68-Y105 HydrophobicContact CD1-CD1 3.93Å; L68-Y105 HydrophobicContact CD1-CE1 4.06Å; L68-Y105 HydrophobicContact CD2-CD1 3.91Å; L68-Y105 HydrophobicContact CD2-CE1 4.49Å; F103-Y105 PolarHBondContact O-N 3.34Å; Y105-L107 PolarHBondContact O-N 3.49Å; Y105-G108 PolarHBondContact O-N 3.13Å; Y105-I109 WeakPolarHBondContact O-CB 3.43Å; Y105-I109 WeakPolarHBondContact O-CD1 2.96Å; Y105-I109 VanDerWaalsContact O-CG1 3.29Å; Y105-I109 WeakPolarHBondContact O-CG1 3.41Å; Y105-I109 PolarHBondContact O-N 3.49Å; Y105-L276 HydrophobicContact CD1-CD1 3.44Å; Y105-L276 VanDerWaalsContact CD1-CD1 3.44Å; Y105-L276 HydrophobicContact CD1-CG 4.07Å; Y105-L276 HydrophobicContact CE1-CD1 4.31Å; Y105-L276 HydrophobicContact CG-CD1 4.1Å; Y105-M279 HydrophobicContact CE1-CB 4.18Å; Y105-M279 HydrophobicContact CE1-CG 4.08Å; Y105-G280 WeakPolarHBondContact OH-CA 3.31Å |
| 106 | L | 91.9 | Very high | 90 | Very high | 111 Ų | 111 | 57.5 Ų | 57.5 | 58% | 0.581 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -64.3 | -42.6 | 179 | -174.3 | 70.5 | 0 | 0 | 0 | 111.3 | F103 S110 | F103-L106 HydrophobicContact CB-CB 4.44Å; F103-L106 PolarHBondContact O-N 3.32Å; L106-S110 VanDerWaalsContact O-CB 3.31Å; L106-S110 WeakPolarHBondContact O-CB 3.13Å; L106-S110 PolarHBondContact O-N 2.97Å; L106-S110 PolarHBondContact O-OG 3.28Å |
| 107 | L | 92.8 | Very high | 90.4 | Very high | 48 Ų | 48 | 52.4 Ų | 52.4 | 25% | 0.251 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -67.3 | -41.8 | 176.7 | -71.7 | 178.1 | 0 | 0 | 0 | 112.1 | F71 I99 F100 F103 P104 Y105 S110 I111 | F71-L107 HydrophobicContact CD2-CB 4.17Å; F71-L107 HydrophobicContact CE2-CB 3.75Å; I99-L107 HydrophobicContact CB-CD1 4.5Å; I99-L107 HydrophobicContact CG2-CD1 3.69Å; F100-L107 HydrophobicContact CD1-CD1 3.95Å; F100-L107 HydrophobicContact CE1-CD1 4.21Å; F103-L107 WeakPolarHBondContact O-CB 3.43Å; F103-L107 WeakPolarHBondContact O-CG 3.38Å; F103-L107 PolarHBondContact O-N 2.84Å; F103-L107 VanDerWaalsContact O-N 3.09Å; P104-L107 PolarHBondContact O-N 3.47Å; Y105-L107 PolarHBondContact O-N 3.49Å; L107-S110 PolarHBondContact O-N 2.95Å; L107-I111 WeakPolarHBondContact O-CB 3.47Å; L107-I111 WeakPolarHBondContact O-CD1 3.25Å; L107-I111 VanDerWaalsContact O-CG1 3.31Å; L107-I111 WeakPolarHBondContact O-CG1 3.48Å; L107-I111 PolarHBondContact O-N 3.28Å |
| 108 | G | 94.6 | Very high | 91.1 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -56.8 | -59.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111 | E64 P104 Y105 S110 I111 V112 | E64-G108 VanDerWaalsContact OE2-C 3.3Å; P104-G108 PolarHBondContact O-N 3.01Å; Y105-G108 PolarHBondContact O-N 3.13Å; G108-S110 VanDerWaalsContact C-N 3.26Å; G108-S110 PolarHBondContact O-N 3.31Å; G108-I111 PolarHBondContact O-N 2.92Å; G108-I111 VanDerWaalsContact O-N 3.11Å; G108-V112 PolarHBondContact O-N 3.5Å |
| 109 | I | 94.6 | Very high | 91.5 | Very high | 38 Ų | 38 | 50.3 Ų | 50.3 | 20% | 0.195 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -51.5 | -47.7 | 176 | -66.4 | 161.9 | 0 | 0 | 0 | 110.4 | E64 Y105 I111 W113 I268 I272 L276 | E64-I109 PolarHBondContact OE1-N 3.37Å; Y105-I109 WeakPolarHBondContact O-CB 3.43Å; Y105-I109 WeakPolarHBondContact O-CD1 2.96Å; Y105-I109 VanDerWaalsContact O-CG1 3.29Å; Y105-I109 WeakPolarHBondContact O-CG1 3.41Å; Y105-I109 PolarHBondContact O-N 3.49Å; I109-I111 PolarHBondContact O-N 3.39Å; I109-W113 WeakPolarHBondContact O-CA 3.37Å; I109-W113 WeakPolarHBondContact O-CB 3.3Å; I109-W113 PolarHBondContact O-N 3.3Å; I109-I268 HydrophobicContact CG2-CD1 3.94Å; I109-I268 HydrophobicContact CG2-CG1 4.39Å; I109-I268 HydrophobicContact CG2-CG2 4.46Å; I109-I272 HydrophobicContact CG1-CG2 4.19Å; I109-L276 HydrophobicContact CD1-CD1 3.69Å; I109-L276 HydrophobicContact CG1-CD1 3.87Å |
| 110 | S | 94.6 | Very high | 91.9 | Very high | 64 Ų | 64 | 48.8 Ų | 48.8 | 45% | 0.448 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -62.6 | -42 | -176.1 | -61 | 0 | 0 | 0 | 0 | 112.5 | L106 L107 G108 F114 | L106-S110 VanDerWaalsContact O-CB 3.31Å; L106-S110 WeakPolarHBondContact O-CB 3.13Å; L106-S110 PolarHBondContact O-N 2.97Å; L106-S110 PolarHBondContact O-OG 3.28Å; L107-S110 PolarHBondContact O-N 2.95Å; G108-S110 VanDerWaalsContact C-N 3.26Å; G108-S110 PolarHBondContact O-N 3.31Å; S110-F114 WeakPolarHBondContact O-CB 3.43Å; S110-F114 PolarHBondContact O-N 2.87Å; S110-F114 VanDerWaalsContact O-N 3.11Å |
| 111 | I | 95.4 | Very high | 92.2 | Very high | 74 Ų | 74 | 52 Ų | 52 | 38% | 0.379 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -71.3 | -46.9 | -178.8 | -71.4 | 165.2 | 0 | 0 | 0 | 110.5 | F71 L107 G108 I109 F114 I115 | F71-I111 HydrophobicContact CE2-CD1 3.94Å; F71-I111 HydrophobicContact CZ-CD1 3.54Å; L107-I111 WeakPolarHBondContact O-CB 3.47Å; L107-I111 WeakPolarHBondContact O-CD1 3.25Å; L107-I111 VanDerWaalsContact O-CG1 3.31Å; L107-I111 WeakPolarHBondContact O-CG1 3.48Å; L107-I111 PolarHBondContact O-N 3.28Å; G108-I111 PolarHBondContact O-N 2.92Å; G108-I111 VanDerWaalsContact O-N 3.11Å; I109-I111 PolarHBondContact O-N 3.39Å; I111-F114 WeakPolarHBondContact O-CB 3.49Å; I111-F114 PolarHBondContact O-N 3.09Å; I111-I115 HydrophobicContact CG2-CD1 4.37Å; I111-I115 WeakPolarHBondContact O-CG1 3.47Å; I111-I115 PolarHBondContact O-N 3.4Å |
| 112 | V | 96.3 | Very high | 92.8 | Very high | 0 Ų | 0 | 55.5 Ų | 55.5 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -75.2 | -34.8 | -176.2 | -178 | 0 | 0 | 0 | 0 | 111.6 | I60 V63 E64 G108 F114 I115 C116 I272 | I60-V112 HydrophobicContact CD1-CG1 3.76Å; I60-V112 HydrophobicContact CG1-CG1 3.44Å; I60-V112 VanDerWaalsContact CG1-CG1 3.44Å; V63-V112 HydrophobicContact CG1-CG2 4.15Å; E64-V112 HydrophobicContact CB-CG1 4.27Å; E64-V112 HydrophobicContact CB-CG2 4.38Å; E64-V112 WeakPolarHBondContact OE2-CB 3.33Å; E64-V112 WeakPolarHBondContact OE2-CG2 3.42Å; G108-V112 PolarHBondContact O-N 3.5Å; V112-F114 VanDerWaalsContact C-N 3.27Å; V112-F114 PolarHBondContact O-N 2.92Å; V112-I115 WeakPolarHBondContact O-CB 3.28Å; V112-I115 PolarHBondContact O-N 3.45Å; V112-I115 VanDerWaalsContact O-N 3.13Å; V112-C116 PolarHBondContact O-N 3.18Å; V112-I272 HydrophobicContact CB-CD1 4.5Å; V112-I272 HydrophobicContact CG1-CD1 4.06Å; V112-I272 HydrophobicContact CG1-CG1 3.87Å |
| 113 | W | 95.2 | Very high | 93.1 | Very high | 58 Ų | 58 | 57.5 Ų | 57.5 | 22% | 0.22 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -59.3 | -40.2 | 168.3 | -176.6 | 92.6 | 0 | 0 | 0 | 111.5 | I109 I115 C116 F117 T133 I272 | I109-W113 WeakPolarHBondContact O-CA 3.37Å; I109-W113 WeakPolarHBondContact O-CB 3.3Å; I109-W113 PolarHBondContact O-N 3.3Å; W113-I115 VanDerWaalsContact C-N 3.32Å; W113-I115 PolarHBondContact O-N 3.45Å; W113-C116 WeakPolarHBondContact O-CB 3.36Å; W113-C116 PolarHBondContact O-N 3.25Å; W113-F117 HydrophobicContact CE3-CB 4.42Å; W113-F117 HydrophobicContact CH2-CB 4.4Å; W113-F117 HydrophobicContact CH2-CD2 4.15Å; W113-F117 HydrophobicContact CH2-CG 4.34Å; W113-F117 HydrophobicContact CZ3-CB 4.18Å; W113-F117 HydrophobicContact CZ3-CG 4.34Å; W113-F117 WeakPolarHBondContact O-CB 3.4Å; W113-F117 PolarHBondContact O-N 3.4Å; W113-T133 HydrophobicContact CZ2-CG2 4.34Å; W113-I272 HydrophobicContact CB-CD1 4.29Å |
| 114 | F | 95 | Very high | 93.3 | Very high | 114 Ų | 114 | 55.6 Ų | 55.6 | 50% | 0.5 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -64.9 | -35.7 | 175.3 | -175.6 | -108.6 | 0 | 0 | 0 | 112.4 | S110 I111 V112 F117 I118 | S110-F114 WeakPolarHBondContact O-CB 3.43Å; S110-F114 PolarHBondContact O-N 2.87Å; S110-F114 VanDerWaalsContact O-N 3.11Å; I111-F114 WeakPolarHBondContact O-CB 3.49Å; I111-F114 PolarHBondContact O-N 3.09Å; V112-F114 VanDerWaalsContact C-N 3.27Å; V112-F114 PolarHBondContact O-N 2.92Å; F114-F117 HydrophobicContact CD2-CD1 4.36Å; F114-F117 HydrophobicContact CE2-CD1 4.38Å; F114-F117 WeakPolarHBondContact O-CB 3.41Å; F114-F117 PolarHBondContact O-N 3.25Å; F114-I118 HydrophobicContact CD1-CD1 3.93Å; F114-I118 HydrophobicContact CE1-CD1 3.5Å; F114-I118 VanDerWaalsContact CE1-CD1 3.5Å; F114-I118 HydrophobicContact CE1-CG1 4.32Å; F114-I118 HydrophobicContact CZ-CD1 3.93Å; F114-I118 HydrophobicContact CZ-CG1 4.37Å; F114-I118 WeakPolarHBondContact O-CG1 3.41Å; F114-I118 PolarHBondContact O-N 3.25Å |
| 115 | I | 95.2 | Very high | 93.3 | Very high | 59 Ų | 59 | 56.1 Ų | 56.1 | 30% | 0.303 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -63 | -48.2 | 171.3 | -65.2 | 168.1 | 0 | 0 | 0 | 110.4 | I60 V63 I111 V112 W113 F117 I118 M119 | I60-I115 HydrophobicContact CD1-CG2 4.04Å; V63-I115 HydrophobicContact CG1-CD1 4.4Å; I111-I115 HydrophobicContact CG2-CD1 4.37Å; I111-I115 WeakPolarHBondContact O-CG1 3.47Å; I111-I115 PolarHBondContact O-N 3.4Å; V112-I115 WeakPolarHBondContact O-CB 3.28Å; V112-I115 PolarHBondContact O-N 3.45Å; V112-I115 VanDerWaalsContact O-N 3.13Å; W113-I115 VanDerWaalsContact C-N 3.32Å; W113-I115 PolarHBondContact O-N 3.45Å; I115-F117 VanDerWaalsContact C-N 3.26Å; I115-F117 PolarHBondContact O-N 3.14Å; I115-I118 PolarHBondContact O-N 3.17Å; I115-M119 HydrophobicContact CG2-SD 4.17Å; I115-M119 WeakPolarHBondContact O-CG 3.33Å; I115-M119 PolarHBondContact O-N 3.26Å |
| 116 | C | 93.9 | Very high | 93.1 | Very high | 0 Ų | 0 | 57.9 Ų | 57.9 | 0% | 0 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -56.3 | -41 | 174.3 | -76.9 | 0 | 0 | 0 | 0 | 112 | V112 W113 M119 T120 A131 T133 P269 | V112-C116 PolarHBondContact O-N 3.18Å; W113-C116 WeakPolarHBondContact O-CB 3.36Å; W113-C116 PolarHBondContact O-N 3.25Å; C116-M119 PolarHBondContact O-N 3.13Å; C116-T120 WeakPolarHBondContact O-CB 3.32Å; C116-T120 PolarHBondContact O-N 3.46Å; C116-T120 PolarHBondContact O-OG1 2.81Å; C116-A131 WeakPolarHBondContact CB-O 3.26Å; C116-A131 PolarHBondContact SG-O 3.37Å; C116-A131 VanDerWaalsContact SG-O 3.41Å; C116-T133 HydrophobicContact CB-CG2 3.72Å; C116-P269 HydrophobicContact CB-CG 4.46Å |
| 117 | F | 93 | Very high | 92.7 | Very high | 78 Ų | 78 | 63.2 Ų | 63.2 | 34% | 0.342 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -62.9 | -44.5 | 177.1 | 178.7 | -107.9 | 0 | 0 | 0 | 112 | W113 F114 I115 T120 I121 T133 | W113-F117 HydrophobicContact CE3-CB 4.42Å; W113-F117 HydrophobicContact CH2-CB 4.4Å; W113-F117 HydrophobicContact CH2-CD2 4.15Å; W113-F117 HydrophobicContact CH2-CG 4.34Å; W113-F117 HydrophobicContact CZ3-CB 4.18Å; W113-F117 HydrophobicContact CZ3-CG 4.34Å; W113-F117 WeakPolarHBondContact O-CB 3.4Å; W113-F117 PolarHBondContact O-N 3.4Å; F114-F117 HydrophobicContact CD2-CD1 4.36Å; F114-F117 HydrophobicContact CE2-CD1 4.38Å; F114-F117 WeakPolarHBondContact O-CB 3.41Å; F114-F117 PolarHBondContact O-N 3.25Å; I115-F117 VanDerWaalsContact C-N 3.26Å; I115-F117 PolarHBondContact O-N 3.14Å; F117-T120 WeakPolarHBondContact O-CB 3.47Å; F117-T120 PolarHBondContact O-N 3.11Å; F117-I121 HydrophobicContact CD1-CD1 3.78Å; F117-I121 HydrophobicContact CD2-CD1 4.26Å; F117-I121 HydrophobicContact CE1-CD1 3.28Å; F117-I121 HydrophobicContact CE2-CD1 3.82Å; F117-I121 HydrophobicContact CE2-CG1 4.39Å; F117-I121 HydrophobicContact CG-CD1 4.26Å; F117-I121 HydrophobicContact CZ-CD1 3.33Å; F117-I121 HydrophobicContact CZ-CG1 4.34Å; F117-I121 WeakPolarHBondContact O-CG1 3.33Å; F117-I121 PolarHBondContact O-N 3.42Å; F117-T133 HydrophobicContact CB-CG2 4.31Å |
| 118 | I | 94.4 | Very high | 92.3 | Very high | 79 Ų | 79 | 64 Ų | 64 | 41% | 0.405 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -61.3 | -46.4 | 173.6 | -68.8 | 170.3 | 0 | 0 | 0 | 110.7 | F114 I115 T120 I121 T122 | F114-I118 HydrophobicContact CD1-CD1 3.93Å; F114-I118 HydrophobicContact CE1-CD1 3.5Å; F114-I118 VanDerWaalsContact CE1-CD1 3.5Å; F114-I118 HydrophobicContact CE1-CG1 4.32Å; F114-I118 HydrophobicContact CZ-CD1 3.93Å; F114-I118 HydrophobicContact CZ-CG1 4.37Å; F114-I118 WeakPolarHBondContact O-CG1 3.41Å; F114-I118 PolarHBondContact O-N 3.25Å; I115-I118 PolarHBondContact O-N 3.17Å; I118-T120 PolarHBondContact O-N 2.81Å; I118-I121 PolarHBondContact O-N 3.11Å; I118-T122 HydrophobicContact CG2-CG2 4.17Å; I118-T122 WeakPolarHBondContact O-CB 3.44Å; I118-T122 WeakPolarHBondContact O-CG2 3.18Å; I118-T122 PolarHBondContact O-N 2.91Å; I118-T122 PolarHBondContact O-OG1 3.34Å |
| 119 | M | 93.2 | Very high | 91.9 | Very high | 22 Ų | 22 | 64.5 Ų | 64.5 | 11% | 0.108 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -59.2 | -35.7 | 176.7 | -70.9 | 177.4 | 61 | 0 | 0 | 112.4 | W59 I115 C116 T122 N123 A124 E125 | W59-M119 HydrophobicContact CH2-SD 4.4Å; W59-M119 HydrophobicContact CZ2-CE 3.84Å; W59-M119 HydrophobicContact CZ2-SD 4.02Å; I115-M119 HydrophobicContact CG2-SD 4.17Å; I115-M119 WeakPolarHBondContact O-CG 3.33Å; I115-M119 PolarHBondContact O-N 3.26Å; C116-M119 PolarHBondContact O-N 3.13Å; M119-T122 WeakPolarHBondContact CA-OG1 3.24Å; M119-T122 PolarHBondContact O-OG1 3.23Å; M119-N123 PolarHBondContact O-N 3.45Å; M119-A124 HydrophobicContact CB-CB 4.33Å; M119-A124 HydrophobicContact CG-CB 4.42Å; M119-A124 PolarHBondContact O-N 2.83Å; M119-E125 HydrophobicContact CB-CB 4.48Å; M119-E125 HydrophobicContact CE-CB 4.28Å; M119-E125 PolarHBondContact O-N 2.99Å |
| 120 | T | 92.4 | Very high | 91.7 | Very high | 5 Ų | 5 | 66.3 Ų | 66.3 | 3% | 0.031 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -65.8 | -49.3 | 177.5 | -57.9 | 0 | 0 | 0 | 0 | 111.3 | C116 F117 I118 N123 R132 T133 D134 | C116-T120 WeakPolarHBondContact O-CB 3.32Å; C116-T120 PolarHBondContact O-N 3.46Å; C116-T120 PolarHBondContact O-OG1 2.81Å; F117-T120 WeakPolarHBondContact O-CB 3.47Å; F117-T120 PolarHBondContact O-N 3.11Å; I118-T120 PolarHBondContact O-N 2.81Å; T120-N123 PolarHBondContact O-N 3.31Å; T120-R132 PolarHBondContact O-NH2 2.93Å; T120-T133 WeakPolarHBondContact CB-OG1 3.44Å; T120-T133 PolarHBondContact OG1-N 3.07Å; T120-T133 VanDerWaalsContact OG1-N 3.08Å; T120-T133 PolarHBondContact OG1-OG1 3.3Å; T120-D134 HydrophobicContact CG2-CB 3.75Å; T120-D134 WeakPolarHBondContact CG2-OD1 3.28Å; T120-D134 WeakPolarHBondContact CG2-OD2 3.31Å |
| 121 | I | 92.9 | Very high | 91.4 | Very high | 107 Ų | 107 | 63.2 Ų | 63.2 | 55% | 0.549 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -69.8 | -41 | -178.2 | -64.2 | 165.2 | 0 | 0 | 0 | 111.6 | F117 I118 N123 | F117-I121 HydrophobicContact CD1-CD1 3.78Å; F117-I121 HydrophobicContact CD2-CD1 4.26Å; F117-I121 HydrophobicContact CE1-CD1 3.28Å; F117-I121 HydrophobicContact CE2-CD1 3.82Å; F117-I121 HydrophobicContact CE2-CG1 4.39Å; F117-I121 HydrophobicContact CG-CD1 4.26Å; F117-I121 HydrophobicContact CZ-CD1 3.33Å; F117-I121 HydrophobicContact CZ-CG1 4.34Å; F117-I121 WeakPolarHBondContact O-CG1 3.33Å; F117-I121 PolarHBondContact O-N 3.42Å; I118-I121 PolarHBondContact O-N 3.11Å; I121-N123 PolarHBondContact O-N 3.23Å |
| 122 | T | 92.7 | Very high | 91.1 | Very high | 89 Ų | 89 | 60.3 Ų | 60.3 | 55% | 0.546 | 32% | 0.321 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.8 | -6.4 | 178.5 | 54.5 | 0 | 0 | 0 | 0 | 113.3 | I118 M119 A124 | I118-T122 HydrophobicContact CG2-CG2 4.17Å; I118-T122 WeakPolarHBondContact O-CB 3.44Å; I118-T122 WeakPolarHBondContact O-CG2 3.18Å; I118-T122 PolarHBondContact O-N 2.91Å; I118-T122 PolarHBondContact O-OG1 3.34Å; M119-T122 WeakPolarHBondContact CA-OG1 3.24Å; M119-T122 PolarHBondContact O-OG1 3.23Å; T122-A124 PolarHBondContact O-N 3.4Å |
| 123 | N | 90.1 | Very high | 90.7 | Very high | 98 Ų | 98 | 60.8 Ų | 60.8 | 52% | 0.524 | 32% | 0.324 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 52.3 | 30.4 | -170.8 | -64 | -67.9 | 0 | 0 | 0 | 113.2 | M119 T120 I121 R132 | M119-N123 PolarHBondContact O-N 3.45Å; T120-N123 PolarHBondContact O-N 3.31Å; I121-N123 PolarHBondContact O-N 3.23Å; N123-R132 PolarHBondContact OD1-NH1 2.9Å |
| 124 | A | 90.5 | Very high | 90.3 | Very high | 67 Ų | 67 | 60.7 Ų | 60.7 | 55% | 0.554 | 33% | 0.328 | S | S | * | . | trans | -67 | -30.4 | 170.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | M119 T122 | M119-A124 HydrophobicContact CB-CB 4.33Å; M119-A124 HydrophobicContact CG-CB 4.42Å; M119-A124 PolarHBondContact O-N 2.83Å; T122-A124 PolarHBondContact O-N 3.4Å | ||
| 125 | E | 89.6 | Confident | 89.7 | Confident | 20 Ų | 20 | 58.2 Ų | 58.2 | 9% | 0.093 | 32% | 0.317 | C | S | . | . | S | Bend | trans | -95.9 | 128.4 | 172.4 | -171.7 | 59.5 | -154.6 | 0 | 0 | 110.4 | H58 M119 G129 A131 R132 | H58-E125 IonicContact CD2-OE1 2.67Å; H58-E125 IonicContact CE1-OE2 2.73Å; H58-E125 IonicContact NE2-OE1 3.7Å; H58-E125 IonicContact NE2-OE2 3.17Å; H58-E125 PolarHBondContact NE2-OE2 2.85Å; H58-E125 VanDerWaalsContact NE2-OE2 3.13Å; M119-E125 HydrophobicContact CB-CB 4.48Å; M119-E125 HydrophobicContact CE-CB 4.28Å; M119-E125 PolarHBondContact O-N 2.99Å; E125-G129 WeakPolarHBondContact OE1-CA 3.45Å; E125-A131 HydrophobicContact CG-CB 4.46Å; E125-R132 HydrophobicContact CB-CG 3.89Å; E125-R132 HydrophobicContact CG-CG 3.46Å; E125-R132 VanDerWaalsContact CG-CG 3.46Å; E125-R132 PolarHBondContact O-NH1 3.35Å |
| 126 | P | 87.4 | Confident | 88.6 | Confident | 85 Ų | 85 | 61.8 Ų | 61.8 | 55% | 0.552 | 34% | 0.337 | S | S | * | . | P | Polyproline II helix | trans | -61.5 | 151.2 | 179 | 25.4 | -35.5 | 0 | 0 | 0 | 112.5 | G128 G129 R132 | P126-G128 PolarHBondContact O-N 3.29Å; P126-G129 PolarHBondContact O-N 2.98Å; P126-R132 WeakPolarHBondContact O-CD 3.4Å |
| 127 | R | 82.9 | Confident | 88 | Confident | 223 Ų | 223 | 64.8 Ų | 64.8 | 84% | 0.842 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59 | 126.7 | 176.5 | -71.1 | -175.1 | 177 | 172.8 | -0.8 | 110.2 | ||
| 128 | G | 83.8 | Confident | 87.4 | Confident | 65 Ų | 65 | 62 Ų | 62 | 67% | 0.67 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 90 | 1.9 | -173.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | P126 | P126-G128 PolarHBondContact O-N 3.29Š|
| 129 | G | 87.2 | Confident | 87 | Confident | 10 Ų | 10 | 61.1 Ų | 61.1 | 10% | 0.103 | 35% | 0.347 | C | S | . | . | trans | -63.4 | 145.1 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | E125 P126 A131 R132 Q135 | E125-G129 WeakPolarHBondContact OE1-CA 3.45Å; P126-G129 PolarHBondContact O-N 2.98Å; G129-A131 PolarHBondContact O-N 2.98Å; G129-R132 PolarHBondContact O-N 3.2Å; G129-Q135 PolarHBondContact O-NE2 3.16Å | ||
| 130 | E | 89.1 | Confident | 86.7 | Confident | 75 Ų | 75 | 63 Ų | 63 | 35% | 0.35 | 36% | 0.36 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.4 | -19.5 | -176.8 | -63.4 | -60.5 | 158.8 | 0 | 0 | 113.2 | L57 P269 P271 | L57-E130 HydrophobicContact CB-CB 4.25Å; L57-E130 HydrophobicContact CB-CG 4.28Å; L57-E130 HydrophobicContact CD2-CG 4.37Å; E130-P269 WeakPolarHBondContact O-CB 3.4Å; E130-P271 HydrophobicContact CB-CG 3.98Å; E130-P271 WeakPolarHBondContact O-CD 3.31Å |
| 131 | A | 89.4 | Confident | 86.4 | Confident | 0 Ų | 0 | 65.9 Ų | 65.9 | 0% | 0 | 38% | 0.378 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -93.6 | 1.9 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | H58 I60 C116 E125 G129 | H58-A131 HydrophobicContact CB-CB 4.41Å; H58-A131 WeakPolarHBondContact ND1-CB 3.19Å; I60-A131 HydrophobicContact CG2-CB 4.05Å; C116-A131 WeakPolarHBondContact CB-O 3.26Å; C116-A131 PolarHBondContact SG-O 3.37Å; C116-A131 VanDerWaalsContact SG-O 3.41Å; E125-A131 HydrophobicContact CG-CB 4.46Å; G129-A131 PolarHBondContact O-N 2.98Å |
| 132 | R | 89.7 | Confident | 86.3 | Confident | 13 Ų | 13 | 63.9 Ų | 63.9 | 5% | 0.049 | 37% | 0.365 | C | S | . | . | trans | -76.4 | 138.7 | 179.8 | -69.9 | -166.4 | 66 | 107 | 1.2 | 111.7 | T120 N123 E125 P126 G129 D134 | T120-R132 PolarHBondContact O-NH2 2.93Å; N123-R132 PolarHBondContact OD1-NH1 2.9Å; E125-R132 HydrophobicContact CB-CG 3.89Å; E125-R132 HydrophobicContact CG-CG 3.46Å; E125-R132 VanDerWaalsContact CG-CG 3.46Å; E125-R132 PolarHBondContact O-NH1 3.35Å; P126-R132 WeakPolarHBondContact O-CD 3.4Å; G129-R132 PolarHBondContact O-N 3.2Å; R132-D134 IonicContact CZ-OD1 2.65Å; R132-D134 IonicContact CZ-OD2 2.88Å; R132-D134 IonicContact NE-OD1 3.53Å; R132-D134 PolarHBondContact NE-OD1 2.99Å; R132-D134 IonicContact NE-OD2 2.72Å; R132-D134 IonicContact NH2-OD1 2.77Å; R132-D134 PolarHBondContact NH2-OD1 3.25Å; R132-D134 IonicContact NH2-OD2 3.26Å; R132-D134 PolarHBondContact NH2-OD2 2.99Å | ||
| 133 | T | 88.1 | Confident | 86.1 | Confident | 9 Ų | 9 | 64.8 Ų | 64.8 | 6% | 0.055 | 37% | 0.367 | C | S | . | . | S | Bend | trans | -87.6 | -12.6 | 177.9 | 55.3 | 0 | 0 | 0 | 0 | 113.2 | W113 C116 F117 T120 P269 | W113-T133 HydrophobicContact CZ2-CG2 4.34Å; C116-T133 HydrophobicContact CB-CG2 3.72Å; F117-T133 HydrophobicContact CB-CG2 4.31Å; T120-T133 WeakPolarHBondContact CB-OG1 3.44Å; T120-T133 PolarHBondContact OG1-N 3.07Å; T120-T133 VanDerWaalsContact OG1-N 3.08Å; T120-T133 PolarHBondContact OG1-OG1 3.3Å; T133-P269 HydrophobicContact CG2-CG 4.38Å |
| 134 | D | 85.5 | Confident | 86.2 | Confident | 57 Ų | 57 | 67.7 Ų | 67.7 | 31% | 0.305 | 38% | 0.377 | S | S | . | . | trans | -106.4 | 28.5 | -175.6 | 70.3 | -20.3 | 0 | 0 | 0 | 113.4 | T120 R132 N136 I139 | T120-D134 HydrophobicContact CG2-CB 3.75Å; T120-D134 WeakPolarHBondContact CG2-OD1 3.28Å; T120-D134 WeakPolarHBondContact CG2-OD2 3.31Å; R132-D134 IonicContact CZ-OD1 2.65Å; R132-D134 IonicContact CZ-OD2 2.88Å; R132-D134 IonicContact NE-OD1 3.53Å; R132-D134 PolarHBondContact NE-OD1 2.99Å; R132-D134 IonicContact NE-OD2 2.72Å; R132-D134 IonicContact NH2-OD1 2.77Å; R132-D134 PolarHBondContact NH2-OD1 3.25Å; R132-D134 IonicContact NH2-OD2 3.26Å; R132-D134 PolarHBondContact NH2-OD2 2.99Å; D134-N136 PolarHBondContact O-N 2.9Å; D134-I139 HydrophobicContact CB-CD1 3.92Å; D134-I139 WeakPolarHBondContact O-CD1 3.34Å | ||
| 135 | Q | 82.3 | Confident | 86.2 | Confident | 61 Ų | 61 | 65.8 Ų | 65.8 | 29% | 0.285 | 36% | 0.359 | S | S | . | . | trans | -57.6 | 127.9 | 176.3 | -74.2 | -173.7 | 2.4 | 0 | 0 | 110.4 | G129 A137 S138 I139 | G129-Q135 PolarHBondContact O-NE2 3.16Å; Q135-A137 PolarHBondContact O-N 3.28Å; Q135-S138 PolarHBondContact O-N 3.41Å; Q135-I139 PolarHBondContact O-N 2.74Å | ||
| 136 | N | 71.6 | Confident | 86.3 | Confident | 135 Ų | 135 | 67.8 Ų | 67.8 | 72% | 0.722 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -53.4 | -34.2 | -178.3 | -69.3 | 15.9 | 0 | 0 | 0 | 112 | D134 T140 | D134-N136 PolarHBondContact O-N 2.9Å; N136-T140 VanDerWaalsContact O-CB 3.28Å; N136-T140 WeakPolarHBondContact O-CB 3.24Å; N136-T140 WeakPolarHBondContact O-CG2 3.13Å; N136-T140 PolarHBondContact O-N 3.13Å; N136-T140 PolarHBondContact O-OG1 3.45Å |
| 137 | A | 81.9 | Confident | 86.5 | Confident | 62 Ų | 62 | 72.7 Ų | 72.7 | 51% | 0.512 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -65 | -50.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q135 I139 T140 V141 | Q135-A137 PolarHBondContact O-N 3.28Å; A137-I139 PolarHBondContact O-N 3.32Å; A137-T140 WeakPolarHBondContact CA-OG1 3.46Å; A137-T140 PolarHBondContact O-N 2.72Å; A137-T140 PolarHBondContact O-OG1 2.95Å; A137-V141 WeakPolarHBondContact O-CB 3.45Å; A137-V141 VanDerWaalsContact O-CG2 3.24Å; A137-V141 WeakPolarHBondContact O-CG2 3.43Å; A137-V141 PolarHBondContact O-N 3.4Å |
| 138 | S | 81.4 | Confident | 86.9 | Confident | 19 Ų | 19 | 66.5 Ų | 66.5 | 13% | 0.133 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -68.9 | -36.4 | -178.4 | -46.7 | 0 | 0 | 0 | 0 | 112.5 | Q135 F142 | Q135-S138 PolarHBondContact O-N 3.41Å; S138-F142 WeakPolarHBondContact O-CB 3.35Å; S138-F142 PolarHBondContact O-N 3.21Å |
| 139 | I | 85.3 | Confident | 87.1 | Confident | 61 Ų | 61 | 67.9 Ų | 67.9 | 31% | 0.313 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -66 | -46.3 | 173.9 | -64 | 174.5 | 0 | 0 | 0 | 110.6 | D134 Q135 A137 V141 F142 D143 M267 | D134-I139 HydrophobicContact CB-CD1 3.92Å; D134-I139 WeakPolarHBondContact O-CD1 3.34Å; Q135-I139 PolarHBondContact O-N 2.74Å; A137-I139 PolarHBondContact O-N 3.32Å; I139-V141 VanDerWaalsContact C-N 3.33Å; I139-V141 PolarHBondContact O-N 2.86Å; I139-F142 WeakPolarHBondContact O-CB 3.34Å; I139-F142 PolarHBondContact O-N 3.33Å; I139-F142 VanDerWaalsContact O-N 3.12Å; I139-D143 PolarHBondContact O-N 3.35Å; I139-M267 HydrophobicContact CG1-CE 4.4Å |
| 140 | T | 86.5 | Confident | 87 | Confident | 62 Ų | 62 | 73.4 Ų | 73.4 | 38% | 0.38 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -63.7 | -39.7 | 178.8 | 50.2 | 0 | 0 | 0 | 0 | 111.7 | N136 A137 D143 Q144 | N136-T140 VanDerWaalsContact O-CB 3.28Å; N136-T140 WeakPolarHBondContact O-CB 3.24Å; N136-T140 WeakPolarHBondContact O-CG2 3.13Å; N136-T140 PolarHBondContact O-N 3.13Å; N136-T140 PolarHBondContact O-OG1 3.45Å; A137-T140 WeakPolarHBondContact CA-OG1 3.46Å; A137-T140 PolarHBondContact O-N 2.72Å; A137-T140 PolarHBondContact O-OG1 2.95Å; T140-D143 PolarHBondContact O-N 3.44Å; T140-Q144 WeakPolarHBondContact O-CB 3.34Å; T140-Q144 WeakPolarHBondContact O-CG 3.45Å; T140-Q144 PolarHBondContact O-N 3.46Å |
| 141 | V | 87.6 | Confident | 86.7 | Confident | 65 Ų | 65 | 73.3 Ų | 73.3 | 39% | 0.394 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -59.5 | -47.2 | 171.1 | 170.4 | 0 | 0 | 0 | 0 | 110.3 | A137 I139 D143 T145 A263 | A137-V141 WeakPolarHBondContact O-CB 3.45Å; A137-V141 VanDerWaalsContact O-CG2 3.24Å; A137-V141 WeakPolarHBondContact O-CG2 3.43Å; A137-V141 PolarHBondContact O-N 3.4Å; I139-V141 VanDerWaalsContact C-N 3.33Å; I139-V141 PolarHBondContact O-N 2.86Å; V141-D143 PolarHBondContact O-N 2.83Å; V141-T145 WeakPolarHBondContact O-CB 3.34Å; V141-T145 PolarHBondContact O-N 3.18Å; V141-T145 PolarHBondContact O-OG1 2.84Å; V141-A263 HydrophobicContact CG1-CB 4.29Å |
| 142 | F | 89.3 | Confident | 86.6 | Confident | 66 Ų | 66 | 79.1 Ų | 79.1 | 29% | 0.289 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -59.2 | -46.9 | 177.8 | -175.9 | -95 | 0 | 0 | 0 | 112.2 | S138 I139 K260 A263 F264 M267 | S138-F142 WeakPolarHBondContact O-CB 3.35Å; S138-F142 PolarHBondContact O-N 3.21Å; I139-F142 WeakPolarHBondContact O-CB 3.34Å; I139-F142 PolarHBondContact O-N 3.33Å; I139-F142 VanDerWaalsContact O-N 3.12Å; F142-K260 HydrophobicContact CE2-CD 4.36Å; F142-K260 WeakPolarHBondContact O-CD 3.45Å; F142-K260 PolarHBondContact O-NZ 3.37Å; F142-A263 HydrophobicContact CD2-CB 4.09Å; F142-F264 HydrophobicContact CD2-CB 4.49Å; F142-F264 HydrophobicContact CE2-CB 4.24Å; F142-M267 HydrophobicContact CB-SD 4.03Å; F142-M267 HydrophobicContact CD2-SD 3.99Å; F142-M267 HydrophobicContact CG-SD 4.06Å |
| 143 | D | 89.7 | Confident | 86.5 | Confident | 107 Ų | 107 | 81.5 Ų | 81.5 | 57% | 0.572 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -69.5 | -44.7 | -177.6 | -74.4 | -20.9 | 0 | 0 | 0 | 112.4 | I139 T140 V141 K260 | I139-D143 PolarHBondContact O-N 3.35Å; T140-D143 PolarHBondContact O-N 3.44Å; V141-D143 PolarHBondContact O-N 2.83Å; D143-K260 PolarHBondContact O-NZ 3.19Å; D143-K260 VanDerWaalsContact O-NZ 3.13Å |
| 144 | Q | 91.4 | Very high | 86.5 | Confident | 159 Ų | 159 | 84.9 Ų | 84.9 | 74% | 0.743 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -76.4 | -23.5 | -175.8 | -66.1 | 176.3 | 1.4 | 0 | 0 | 113.5 | T140 | T140-Q144 WeakPolarHBondContact O-CB 3.34Å; T140-Q144 WeakPolarHBondContact O-CG 3.45Å; T140-Q144 PolarHBondContact O-N 3.46Å |
| 145 | T | 90.4 | Very high | 86.4 | Confident | 28 Ų | 28 | 88.6 Ų | 88.6 | 17% | 0.172 | 46% | 0.464 | C | S | . | . | S | Bend | trans | -68.2 | 129.6 | -178.9 | -64.7 | 0 | 0 | 0 | 0 | 110.5 | V141 K260 A263 | V141-T145 WeakPolarHBondContact O-CB 3.34Å; V141-T145 PolarHBondContact O-N 3.18Å; V141-T145 PolarHBondContact O-OG1 2.84Å; T145-K260 WeakPolarHBondContact O-CD 3.18Å; T145-K260 WeakPolarHBondContact O-CE 3.4Å; T145-K260 PolarHBondContact O-NZ 2.84Å; T145-A263 HydrophobicContact CG2-CB 4.21Å |
| 146 | P | 92.4 | Very high | 86.6 | Confident | 62 Ų | 62 | 90 Ų | 90 | 40% | 0.403 | 47% | 0.47 | S | S | . | . | trans | -65.4 | 158.2 | 174.9 | 28.4 | -36 | 0 | 0 | 0 | 111.6 | V148 Q149 | P146-V148 VanDerWaalsContact C-N 3.3Å; P146-V148 PolarHBondContact O-N 3.02Å; P146-Q149 HydrophobicContact CG-CB 4.1Å; P146-Q149 HydrophobicContact CG-CG 4.42Å | ||
| 147 | W | 90.4 | Very high | 87.3 | Confident | 187 Ų | 187 | 85 Ų | 85 | 71% | 0.708 | 45% | 0.449 | S | S | * | . | S | Bend | trans | -61.1 | -39.1 | 177.3 | -79.4 | 94.9 | 0 | 0 | 0 | 113.3 | S259 K260 | W147-S259 PolarHBondContact O-N 2.91Å; W147-K260 HydrophobicContact CD2-CG 3.88Å; W147-K260 HydrophobicContact CE3-CB 4.16Å; W147-K260 HydrophobicContact CE3-CG 3.82Å; W147-K260 HydrophobicContact CG-CG 4.25Å; W147-K260 HydrophobicContact CZ3-CB 4.36Å; W147-K260 HydrophobicContact CZ3-CG 4.28Å |
| 148 | V | 92 | Very high | 87.6 | Confident | 94 Ų | 94 | 86.4 Ų | 86.4 | 57% | 0.57 | 45% | 0.453 | S | S | * | . | trans | -130.6 | 123.8 | -179.8 | 176.1 | 0 | 0 | 0 | 0 | 108.4 | P146 V257 | P146-V148 VanDerWaalsContact C-N 3.3Å; P146-V148 PolarHBondContact O-N 3.02Å; V148-V257 WeakPolarHBondContact CA-O 3.46Å; V148-V257 HydrophobicContact CG1-CG1 3.73Å | ||
| 149 | Q | 87.6 | Confident | 87.9 | Confident | 93 Ų | 93 | 88.7 Ų | 88.7 | 44% | 0.435 | 47% | 0.468 | S | S | . | . | trans | -133.1 | 117.2 | 170.8 | -161.7 | 178.1 | -24.1 | 0 | 0 | 107.9 | P146 P151 V257 S259 | P146-Q149 HydrophobicContact CG-CB 4.1Å; P146-Q149 HydrophobicContact CG-CG 4.42Å; Q149-P151 WeakPolarHBondContact O-CD 3.42Å; Q149-V257 PolarHBondContact N-O 3.16Å; Q149-S259 WeakPolarHBondContact CA-OG 3.21Å; Q149-S259 WeakPolarHBondContact CB-OG 3.38Å; Q149-S259 PolarHBondContact N-OG 3.2Å | ||
| 150 | M | 86.3 | Confident | 88.2 | Confident | 127 Ų | 127 | 91.2 Ų | 91.2 | 63% | 0.626 | 48% | 0.476 | S | S | * | . | P | Polyproline II helix | trans | -75.5 | 122.4 | 171.8 | -73.1 | -67.4 | -85.1 | 0 | 0 | 108.3 | M152 V257 | M150-M152 PolarHBondContact O-N 3.11Å; M150-V257 HydrophobicContact SD-CB 4.42Å; M150-V257 HydrophobicContact SD-CG1 3.8Å; M150-V257 HydrophobicContact SD-CG2 3.72Å |
| 151 | P | 82.8 | Confident | 88.4 | Confident | 73 Ų | 73 | 95.1 Ų | 95.1 | 47% | 0.474 | 49% | 0.488 | S | S | . | . | P | Polyproline II helix | trans | -70.3 | 123.3 | 178.7 | 32.9 | -36.2 | 0 | 0 | 0 | 107.5 | Q149 W218 | Q149-P151 WeakPolarHBondContact O-CD 3.42Å; P151-W218 PolarHBondContact O-NE1 2.85Å |
| 152 | M | 86.4 | Confident | 88.7 | Confident | 121 Ų | 121 | 94.6 Ų | 94.6 | 60% | 0.596 | 48% | 0.483 | S | S | * | . | P | Polyproline II helix | trans | -87.9 | 135.6 | -177.6 | -71.1 | -65.9 | -69.2 | 0 | 0 | 110 | M150 F155 | M150-M152 PolarHBondContact O-N 3.11Å; M152-F155 PolarHBondContact O-N 3.19Å |
| 153 | P | 88.1 | Confident | 88.8 | Confident | 63 Ų | 63 | 96.2 Ų | 96.2 | 41% | 0.409 | 50% | 0.495 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.3 | 146 | 170.1 | 28.9 | -34.2 | 0 | 0 | 0 | 109.4 | F155 W218 | P153-F155 VanDerWaalsContact C-N 3.27Å; P153-F155 PolarHBondContact O-N 3.36Å; P153-W218 HydrophobicContact CB-CD2 4.47Å; P153-W218 HydrophobicContact CB-CE3 4.48Å |
| 154 | L | 86.9 | Confident | 88.8 | Confident | 80 Ų | 80 | 91.4 Ų | 91.4 | 42% | 0.419 | 47% | 0.47 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 58.2 | 35.5 | -179.3 | -56.2 | 174.8 | 0 | 0 | 0 | 113.8 | F156 G157 L217 | L154-F156 PolarHBondContact O-N 3.14Å; L154-F156 VanDerWaalsContact O-N 3.13Å; L154-G157 PolarHBondContact O-N 3.09Å; L154-L217 HydrophobicContact CD2-CD2 4.15Å; L154-L217 PolarHBondContact N-O 3.28Å |
| 155 | F | 84.2 | Confident | 88.7 | Confident | 136 Ų | 136 | 86.5 Ų | 86.5 | 60% | 0.596 | 45% | 0.448 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.3 | -35.8 | 177.8 | -174.4 | -99.5 | 0 | 0 | 0 | 113.4 | M152 P153 G157 | M152-F155 PolarHBondContact O-N 3.19Å; P153-F155 VanDerWaalsContact C-N 3.27Å; P153-F155 PolarHBondContact O-N 3.36Å; F155-G157 VanDerWaalsContact C-N 3.3Å; F155-G157 PolarHBondContact O-N 2.82Å |
| 156 | F | 85.7 | Confident | 88.9 | Confident | 91 Ų | 91 | 86.2 Ų | 86.2 | 40% | 0.399 | 45% | 0.446 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.6 | 9.7 | 179.1 | -59.4 | -70.9 | 0 | 0 | 0 | 114.4 | M1 Q2 L154 G219 | M1-F156 HydrophobicContact CB-CD1 3.98Å; M1-F156 HydrophobicContact CB-CD2 4.02Å; M1-F156 HydrophobicContact CB-CE1 4.06Å; M1-F156 HydrophobicContact CB-CE2 4.1Å; M1-F156 HydrophobicContact CB-CG 3.96Å; M1-F156 HydrophobicContact CB-CZ 4.12Å; M1-F156 HydrophobicContact CG-CE1 4.28Å; M1-F156 HydrophobicContact CG-CZ 4.21Å; Q2-F156 HydrophobicContact CB-CB 4.32Å; L154-F156 PolarHBondContact O-N 3.14Å; L154-F156 VanDerWaalsContact O-N 3.13Å; F156-G219 WeakPolarHBondContact CE2-O 3.35Å |
| 157 | G | 87.4 | Confident | 88.9 | Confident | 28 Ų | 28 | 85 Ų | 85 | 29% | 0.289 | 44% | 0.439 | S | S | . | . | trans | 94 | -174.4 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | L154 F155 | L154-G157 PolarHBondContact O-N 3.09Å; F155-G157 VanDerWaalsContact C-N 3.3Å; F155-G157 PolarHBondContact O-N 2.82Å | ||
| 158 | P | 88.6 | Confident | 89 | Confident | 92 Ų | 92 | 76.6 Ų | 76.6 | 60% | 0.597 | 41% | 0.41 | S | S | * | . | S | Bend | trans | -62.7 | 146.8 | -176.8 | 25.4 | -34.3 | 0 | 0 | 0 | 112 | Q2 K160 | Q2-P158 VanDerWaalsContact CG-O 3.3Å; Q2-P158 WeakPolarHBondContact CG-O 3.47Å; Q2-P158 PolarHBondContact NE2-O 3.44Å; P158-K160 PolarHBondContact O-N 3.17Å |
| 159 | P | 87.3 | Confident | 89.1 | Confident | 67 Ų | 67 | 74.2 Ų | 74.2 | 44% | 0.435 | 39% | 0.392 | S | S | . | . | trans | -64.3 | 130.2 | -173.8 | 26 | -33.4 | 0 | 0 | 0 | 111.5 | L9 | L9-P159 HydrophobicContact CD2-CB 4.28Å; L9-P159 HydrophobicContact CD2-CG 4.41Å | ||
| 160 | K | 91.1 | Very high | 89.4 | Confident | 115 Ų | 115 | 71.1 Ų | 71.1 | 50% | 0.5 | 38% | 0.38 | S | S | . | . | trans | -110.7 | 148.9 | 168.6 | -68.9 | -178.2 | -179 | 168.8 | 0 | 108.6 | Q2 M3 G6 S7 P158 | Q2-K160 HydrophobicContact CG-CB 4.4Å; Q2-K160 HydrophobicContact CG-CD 4.39Å; Q2-K160 HydrophobicContact CG-CG 4.22Å; M3-K160 WeakPolarHBondContact CA-O 3.29Å; G6-K160 CarbonylContact C-O 3.44Å; G6-K160 VanDerWaalsContact CA-O 3.23Å; G6-K160 WeakPolarHBondContact CA-O 3.21Å; S7-K160 PolarHBondContact N-O 3.47Å; P158-K160 PolarHBondContact O-N 3.17Å | ||
| 161 | F | 91.6 | Very high | 89.6 | Confident | 143 Ų | 143 | 65.4 Ų | 65.4 | 63% | 0.627 | 35% | 0.353 | S | S | * | . | trans | -129.6 | 150.1 | -178.5 | 57.3 | -90.4 | 0 | 0 | 0 | 111.7 | S7 I10 V166 | S7-F161 WeakPolarHBondContact OG-CA 3.48Å; I10-F161 HydrophobicContact CD1-CB 3.56Å; I10-F161 HydrophobicContact CD1-CD1 3.74Å; I10-F161 HydrophobicContact CD1-CD2 4.28Å; I10-F161 HydrophobicContact CD1-CG 3.6Å; F161-V166 HydrophobicContact CB-CG2 4.22Å | ||
| 162 | N | 92.7 | Very high | 90 | Very high | 54 Ų | 54 | 64.5 Ų | 64.5 | 29% | 0.289 | 35% | 0.348 | S | S | . | . | trans | -125.1 | 133.1 | 170.6 | 172.8 | -66 | 0 | 0 | 0 | 107.8 | M3 S7 A164 L165 V166 | M3-N162 HydrophobicContact CG-CB 3.91Å; M3-N162 HydrophobicContact SD-CB 3.65Å; S7-N162 PolarHBondContact OG-N 3.28Å; N162-A164 PolarHBondContact O-N 3.12Å; N162-A164 WeakPolarHBondContact OD1-CB 3.31Å; N162-A164 PolarHBondContact OD1-N 3.48Å; N162-L165 HydrophobicContact CB-CB 4.25Å; N162-L165 HydrophobicContact CB-CD1 4.1Å; N162-L165 HydrophobicContact CB-CG 4.18Å; N162-L165 PolarHBondContact O-N 2.91Å; N162-L165 PolarHBondContact OD1-N 3.41Å; N162-V166 VanDerWaalsContact O-CG2 3.31Å; N162-V166 WeakPolarHBondContact O-CG2 3.47Å; N162-V166 PolarHBondContact O-N 3.01Å | ||
| 163 | L | 91 | Very high | 90.2 | Very high | 101 Ų | 101 | 59.2 Ų | 59.2 | 53% | 0.529 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -59.3 | -44.2 | -173.5 | -165.9 | 88.9 | 0 | 0 | 0 | 112.5 | L165 V166 C167 I331 V335 | L163-L165 PolarHBondContact O-N 2.85Å; L163-V166 PolarHBondContact O-N 3.29Å; L163-C167 PolarHBondContact O-N 3.06Å; L163-C167 PolarHBondContact O-SG 2.87Å; L163-C167 VanDerWaalsContact O-SG 3.35Å; L163-I331 HydrophobicContact CD2-CG2 3.54Å; L163-V335 HydrophobicContact CD2-CG2 3.63Å; L163-V335 HydrophobicContact CG-CG2 4.16Å |
| 164 | A | 89.4 | Confident | 90.3 | Very high | 6 Ų | 6 | 60.1 Ų | 60.1 | 5% | 0.05 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -64.5 | -41.9 | 180 | 0 | 0 | 0 | 0 | 0 | 111.8 | N162 C167 G168 D334 V335 | N162-A164 PolarHBondContact O-N 3.12Å; N162-A164 WeakPolarHBondContact OD1-CB 3.31Å; N162-A164 PolarHBondContact OD1-N 3.48Å; A164-C167 PolarHBondContact O-N 2.97Å; A164-G168 PolarHBondContact O-N 2.9Å; A164-D334 HydrophobicContact CB-CB 3.75Å; A164-V335 HydrophobicContact CB-CG2 4.31Å |
| 165 | L | 90.9 | Very high | 90.4 | Very high | 56 Ų | 56 | 56.5 Ų | 56.5 | 29% | 0.293 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -65 | -40.8 | 174 | -67.3 | -178.9 | 0 | 0 | 0 | 112.1 | M3 I4 N162 L163 C167 G168 F169 | M3-L165 HydrophobicContact CG-CD1 4.14Å; M3-L165 HydrophobicContact SD-CD1 4.33Å; I4-L165 HydrophobicContact CG1-CD1 4.39Å; N162-L165 HydrophobicContact CB-CB 4.25Å; N162-L165 HydrophobicContact CB-CD1 4.1Å; N162-L165 HydrophobicContact CB-CG 4.18Å; N162-L165 PolarHBondContact O-N 2.91Å; N162-L165 PolarHBondContact OD1-N 3.41Å; L163-L165 PolarHBondContact O-N 2.85Å; L165-C167 VanDerWaalsContact C-N 3.34Å; L165-C167 PolarHBondContact O-N 3.44Å; L165-G168 PolarHBondContact O-N 2.94Å; L165-F169 HydrophobicContact CB-CD2 4.43Å; L165-F169 HydrophobicContact CB-CE2 4.48Å; L165-F169 WeakPolarHBondContact O-CB 3.31Å; L165-F169 WeakPolarHBondContact O-CD2 3.42Å; L165-F169 PolarHBondContact O-N 3.43Å |
| 166 | V | 94.3 | Very high | 90.6 | Very high | 22 Ų | 22 | 50.8 Ų | 50.8 | 13% | 0.133 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -60.5 | -46.1 | 175.6 | 171.7 | 0 | 0 | 0 | 0 | 110.1 | I10 F161 N162 L163 T170 | I10-V166 HydrophobicContact CB-CG1 4.45Å; I10-V166 HydrophobicContact CB-CG2 4.27Å; I10-V166 HydrophobicContact CD1-CG2 4.46Å; I10-V166 HydrophobicContact CG2-CG1 3.93Å; I10-V166 HydrophobicContact CG2-CG2 4.41Å; F161-V166 HydrophobicContact CB-CG2 4.22Å; N162-V166 VanDerWaalsContact O-CG2 3.31Å; N162-V166 WeakPolarHBondContact O-CG2 3.47Å; N162-V166 PolarHBondContact O-N 3.01Å; L163-V166 PolarHBondContact O-N 3.29Å; V166-T170 VanDerWaalsContact O-CB 3.28Å; V166-T170 WeakPolarHBondContact O-CB 3.42Å; V166-T170 PolarHBondContact O-N 3.26Å; V166-T170 PolarHBondContact O-OG1 2.9Å |
| 167 | C | 93 | Very high | 90.8 | Very high | 37 Ų | 37 | 47 Ų | 47 | 25% | 0.25 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -63.1 | -45.6 | 176.9 | -69.6 | 0 | 0 | 0 | 0 | 112 | L163 A164 L165 T170 A171 V335 L339 | L163-C167 PolarHBondContact O-N 3.06Å; L163-C167 PolarHBondContact O-SG 2.87Å; L163-C167 VanDerWaalsContact O-SG 3.35Å; A164-C167 PolarHBondContact O-N 2.97Å; L165-C167 VanDerWaalsContact C-N 3.34Å; L165-C167 PolarHBondContact O-N 3.44Å; C167-T170 PolarHBondContact O-N 3.32Å; C167-A171 WeakPolarHBondContact O-CB 3.5Å; C167-A171 PolarHBondContact O-N 3.37Å; C167-V335 HydrophobicContact CB-CG1 4Å; C167-L339 HydrophobicContact CB-CD2 4.39Å |
| 168 | G | 91.9 | Very high | 90.8 | Very high | 9 Ų | 9 | 47 Ų | 47 | 9% | 0.093 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -60.6 | -47.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | A164 L165 T170 A171 S172 | A164-G168 PolarHBondContact O-N 2.9Å; L165-G168 PolarHBondContact O-N 2.94Å; G168-T170 VanDerWaalsContact C-N 3.33Å; G168-T170 PolarHBondContact O-N 2.85Å; G168-A171 PolarHBondContact O-N 2.87Å; G168-S172 PolarHBondContact O-N 3Å |
| 169 | F | 93.8 | Very high | 90.7 | Very high | 44 Ų | 44 | 43.4 Ų | 43.4 | 19% | 0.193 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -64.2 | -37.5 | 174.8 | -79 | -56.1 | 0 | 0 | 0 | 112.4 | I4 C8 A11 L165 S172 C173 | I4-F169 HydrophobicContact CG2-CE2 3.99Å; I4-F169 HydrophobicContact CG2-CZ 3.71Å; C8-F169 HydrophobicContact CB-CD1 4.43Å; C8-F169 HydrophobicContact CB-CD2 3.96Å; C8-F169 HydrophobicContact CB-CE1 4.44Å; C8-F169 HydrophobicContact CB-CE2 3.97Å; C8-F169 HydrophobicContact CB-CG 4.21Å; C8-F169 HydrophobicContact CB-CZ 4.22Å; A11-F169 HydrophobicContact CB-CB 3.43Å; A11-F169 VanDerWaalsContact CB-CB 3.43Å; L165-F169 HydrophobicContact CB-CD2 4.43Å; L165-F169 HydrophobicContact CB-CE2 4.48Å; L165-F169 WeakPolarHBondContact O-CB 3.31Å; L165-F169 WeakPolarHBondContact O-CD2 3.42Å; L165-F169 PolarHBondContact O-N 3.43Å; F169-S172 PolarHBondContact O-N 3.48Å; F169-C173 WeakPolarHBondContact O-CB 3.48Å; F169-C173 PolarHBondContact O-N 2.91Å; F169-C173 PolarHBondContact O-SG 3.2Å |
| 170 | T | 93.4 | Very high | 90.8 | Very high | 29 Ų | 29 | 40.2 Ų | 40.2 | 18% | 0.178 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -64.2 | -43.5 | 177.2 | -58.8 | 0 | 0 | 0 | 0 | 110.7 | A11 I14 V166 C167 G168 C173 F174 | A11-T170 WeakPolarHBondContact CB-OG1 3.44Å; I14-T170 HydrophobicContact CD1-CG2 3.88Å; I14-T170 HydrophobicContact CG2-CG2 4.48Å; V166-T170 VanDerWaalsContact O-CB 3.28Å; V166-T170 WeakPolarHBondContact O-CB 3.42Å; V166-T170 PolarHBondContact O-N 3.26Å; V166-T170 PolarHBondContact O-OG1 2.9Å; C167-T170 PolarHBondContact O-N 3.32Å; G168-T170 VanDerWaalsContact C-N 3.33Å; G168-T170 PolarHBondContact O-N 2.85Å; T170-C173 WeakPolarHBondContact O-CB 3.44Å; T170-C173 PolarHBondContact O-N 3.44Å; T170-F174 HydrophobicContact CG2-CD2 4.08Å; T170-F174 HydrophobicContact CG2-CE2 3.75Å; T170-F174 WeakPolarHBondContact O-CD2 3.45Å; T170-F174 PolarHBondContact O-N 2.83Å |
| 171 | A | 91.6 | Very high | 90.7 | Very high | 7 Ų | 7 | 35 Ų | 35 | 6% | 0.058 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -62.2 | -43.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | C167 G168 C173 F174 A175 L339 I342 L345 | C167-A171 WeakPolarHBondContact O-CB 3.5Å; C167-A171 PolarHBondContact O-N 3.37Å; G168-A171 PolarHBondContact O-N 2.87Å; A171-C173 VanDerWaalsContact C-N 3.33Å; A171-C173 PolarHBondContact O-N 3.41Å; A171-F174 PolarHBondContact O-N 3.04Å; A171-A175 PolarHBondContact O-N 3.47Å; A171-A175 VanDerWaalsContact O-N 3.1Å; A171-L339 HydrophobicContact CB-CD2 3.49Å; A171-L339 VanDerWaalsContact CB-CD2 3.49Å; A171-I342 HydrophobicContact CB-CD1 4.07Å; A171-L345 HydrophobicContact CB-CD1 3.92Å; A171-L345 HydrophobicContact CB-CD2 3.72Å; A171-L345 HydrophobicContact CB-CG 4.3Å |
| 172 | S | 90 | Very high | 90.3 | Very high | 53 Ų | 53 | 28.4 Ų | 28.4 | 37% | 0.371 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -61.7 | -39.9 | 173.7 | 177.4 | 0 | 0 | 0 | 0 | 111.8 | G168 F169 F174 A175 A176 | G168-S172 PolarHBondContact O-N 3Å; F169-S172 PolarHBondContact O-N 3.48Å; S172-F174 PolarHBondContact O-N 3.29Å; S172-A175 PolarHBondContact O-N 3.25Å; S172-A176 WeakPolarHBondContact O-CB 3.48Å; S172-A176 PolarHBondContact O-N 2.87Å |
| 173 | C | 91.8 | Very high | 89.9 | Confident | 10 Ų | 10 | 25.8 Ų | 25.8 | 7% | 0.068 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -59.4 | -46.4 | 174.4 | -70.3 | 0 | 0 | 0 | 0 | 111.5 | I14 M15 F169 T170 A171 A175 A176 M177 | I14-C173 HydrophobicContact CG2-CB 4.33Å; M15-C173 HydrophobicContact CE-CB 3.67Å; M15-C173 HydrophobicContact CG-CB 4.5Å; F169-C173 WeakPolarHBondContact O-CB 3.48Å; F169-C173 PolarHBondContact O-N 2.91Å; F169-C173 PolarHBondContact O-SG 3.2Å; T170-C173 WeakPolarHBondContact O-CB 3.44Å; T170-C173 PolarHBondContact O-N 3.44Å; A171-C173 VanDerWaalsContact C-N 3.33Å; A171-C173 PolarHBondContact O-N 3.41Å; C173-A175 VanDerWaalsContact C-N 3.3Å; C173-A175 PolarHBondContact O-N 3.36Å; C173-A176 PolarHBondContact O-N 3.4Å; C173-M177 WeakPolarHBondContact O-CG 2.99Å; C173-M177 PolarHBondContact O-N 2.82Å |
| 174 | F | 90.1 | Very high | 89.8 | Confident | 82 Ų | 82 | 22.6 Ų | 22.6 | 36% | 0.36 | 13% | 0.128 | S | C | . | . | H | α-helix | trans | -61 | -40.2 | 177.1 | -81.4 | -66.2 | 0 | 0 | 0 | 112.7 | I14 L18 T170 A171 S172 M177 I178 | I14-F174 HydrophobicContact CD1-CE2 3.77Å; I14-F174 HydrophobicContact CD1-CZ 3.58Å; I14-F174 HydrophobicContact CG1-CZ 4.3Å; L18-F174 HydrophobicContact CD1-CE1 3.58Å; L18-F174 HydrophobicContact CD1-CZ 4.06Å; T170-F174 HydrophobicContact CG2-CD2 4.08Å; T170-F174 HydrophobicContact CG2-CE2 3.75Å; T170-F174 WeakPolarHBondContact O-CD2 3.45Å; T170-F174 PolarHBondContact O-N 2.83Å; A171-F174 PolarHBondContact O-N 3.04Å; S172-F174 PolarHBondContact O-N 3.29Å; F174-M177 HydrophobicContact CD1-SD 4.32Å; F174-M177 WeakPolarHBondContact O-CB 3.35Å; F174-M177 PolarHBondContact O-N 3.24Å; F174-I178 WeakPolarHBondContact O-CG1 3.39Å; F174-I178 PolarHBondContact O-N 3.49Å; F174-I178 VanDerWaalsContact O-N 3.17Å |
| 175 | A | 87.7 | Confident | 89.5 | Confident | 4 Ų | 4 | 24.5 Ų | 24.5 | 3% | 0.033 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -68.9 | -43.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | A171 S172 C173 M177 I178 E179 M344 | A171-A175 PolarHBondContact O-N 3.47Å; A171-A175 VanDerWaalsContact O-N 3.1Å; S172-A175 PolarHBondContact O-N 3.25Å; C173-A175 VanDerWaalsContact C-N 3.3Å; C173-A175 PolarHBondContact O-N 3.36Å; A175-M177 VanDerWaalsContact C-N 3.26Å; A175-M177 PolarHBondContact O-N 3.1Å; A175-I178 WeakPolarHBondContact O-CB 3.14Å; A175-I178 PolarHBondContact O-N 3.44Å; A175-I178 VanDerWaalsContact O-N 3.08Å; A175-E179 PolarHBondContact O-N 3.37Å; A175-M344 HydrophobicContact CB-CE 3.23Å; A175-M344 HydrophobicContact CB-CG 3.79Å; A175-M344 HydrophobicContact CB-SD 3.57Å; A175-M344 VanDerWaalsContact CB-SD 3.57Å |
| 176 | A | 88.9 | Confident | 89.1 | Confident | 16 Ų | 16 | 23.3 Ų | 23.3 | 13% | 0.132 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -59.3 | -37 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | S172 C173 I178 E179 S180 | S172-A176 WeakPolarHBondContact O-CB 3.48Å; S172-A176 PolarHBondContact O-N 2.87Å; C173-A176 PolarHBondContact O-N 3.4Å; A176-I178 VanDerWaalsContact C-N 3.32Å; A176-I178 PolarHBondContact O-N 2.98Å; A176-E179 WeakPolarHBondContact O-CB 2.99Å; A176-E179 PolarHBondContact O-N 3.48Å; A176-S180 WeakPolarHBondContact O-CB 3.24Å; A176-S180 PolarHBondContact O-N 2.69Å; A176-S180 PolarHBondContact O-OG 3.46Å |
| 177 | M | 90.1 | Very high | 88.7 | Confident | 11 Ų | 11 | 24 Ų | 24 | 5% | 0.054 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -62.8 | -38.5 | 174.5 | -69.8 | 169.8 | 68 | 0 | 0 | 112.6 | M15 L18 V24 C173 F174 A175 I181 F205 | M15-M177 HydrophobicContact CE-CG 4.04Å; M15-M177 HydrophobicContact CG-CG 4.3Å; M15-M177 HydrophobicContact CG-SD 4.03Å; L18-M177 HydrophobicContact CB-CE 4.45Å; L18-M177 HydrophobicContact CD1-CE 3.95Å; L18-M177 HydrophobicContact CD1-SD 4.26Å; V24-M177 HydrophobicContact CB-CE 4.29Å; V24-M177 HydrophobicContact CG1-CE 3.86Å; V24-M177 HydrophobicContact CG2-CE 3.43Å; V24-M177 VanDerWaalsContact CG2-CE 3.43Å; C173-M177 WeakPolarHBondContact O-CG 2.99Å; C173-M177 PolarHBondContact O-N 2.82Å; F174-M177 HydrophobicContact CD1-SD 4.32Å; F174-M177 WeakPolarHBondContact O-CB 3.35Å; F174-M177 PolarHBondContact O-N 3.24Å; A175-M177 VanDerWaalsContact C-N 3.26Å; A175-M177 PolarHBondContact O-N 3.1Å; M177-I181 WeakPolarHBondContact O-CD1 3.46Å; M177-I181 VanDerWaalsContact O-CG1 3.29Å; M177-I181 WeakPolarHBondContact O-CG1 3.43Å; M177-I181 PolarHBondContact O-N 2.88Å; M177-I181 VanDerWaalsContact O-N 3.12Å; M177-F205 HydrophobicContact CB-CD1 4.33Å; M177-F205 HydrophobicContact CB-CE1 3.7Å; M177-F205 HydrophobicContact CB-CZ 4.02Å; M177-F205 HydrophobicContact CE-CD1 4.29Å; M177-F205 HydrophobicContact CE-CG 4.37Å; M177-F205 HydrophobicContact CG-CD1 3.76Å; M177-F205 HydrophobicContact CG-CE1 3.59Å; M177-F205 HydrophobicContact CG-CZ 4.34Å; M177-F205 VanDerWaalsContact O-CZ 3.27Å; M177-F205 WeakPolarHBondContact O-CZ 3.48Å |
| 178 | I | 88.1 | Confident | 88.3 | Confident | 28 Ų | 28 | 22.5 Ų | 22.5 | 14% | 0.144 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -67.5 | -41.5 | 177.3 | -64.8 | 164.7 | 0 | 0 | 0 | 110.5 | I31 I36 I39 F174 A175 A176 I181 G182 | I31-I178 HydrophobicContact CD1-CG1 3.84Å; I31-I178 HydrophobicContact CG2-CG2 3.69Å; I36-I178 HydrophobicContact CG1-CG2 3.92Å; I39-I178 HydrophobicContact CD1-CB 3.97Å; I39-I178 HydrophobicContact CD1-CD1 3.65Å; I39-I178 HydrophobicContact CD1-CG1 4.38Å; I39-I178 HydrophobicContact CD1-CG2 3.39Å; F174-I178 WeakPolarHBondContact O-CG1 3.39Å; F174-I178 PolarHBondContact O-N 3.49Å; F174-I178 VanDerWaalsContact O-N 3.17Å; A175-I178 WeakPolarHBondContact O-CB 3.14Å; A175-I178 PolarHBondContact O-N 3.44Å; A175-I178 VanDerWaalsContact O-N 3.08Å; A176-I178 VanDerWaalsContact C-N 3.32Å; A176-I178 PolarHBondContact O-N 2.98Å; I178-I181 PolarHBondContact O-N 3.09Å; I178-G182 PolarHBondContact O-N 3.43Å |
| 179 | E | 86.3 | Confident | 87.8 | Confident | 17 Ų | 17 | 29.2 Ų | 29.2 | 8% | 0.079 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -59.9 | -52.6 | 173.5 | -178.8 | 177 | -162.8 | 0 | 0 | 111.6 | M40 A175 A176 I181 G182 D183 | M40-E179 HydrophobicContact CE-CG 4.32Å; M40-E179 HydrophobicContact CG-CG 4.24Å; A175-E179 PolarHBondContact O-N 3.37Å; A176-E179 WeakPolarHBondContact O-CB 2.99Å; A176-E179 PolarHBondContact O-N 3.48Å; E179-I181 PolarHBondContact O-N 3.04Å; E179-G182 WeakPolarHBondContact O-CA 3.33Å; E179-G182 PolarHBondContact O-N 3.29Å; E179-D183 PolarHBondContact O-N 2.96Å |
| 180 | S | 89.1 | Confident | 87.3 | Confident | 0 Ų | 0 | 29.1 Ų | 29.1 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -56.8 | -33.9 | 178.6 | -72.3 | 0 | 0 | 0 | 0 | 112.8 | A176 G182 D183 Y184 E208 T225 | A176-S180 WeakPolarHBondContact O-CB 3.24Å; A176-S180 PolarHBondContact O-N 2.69Å; A176-S180 PolarHBondContact O-OG 3.46Å; S180-G182 VanDerWaalsContact C-N 3.34Å; S180-G182 PolarHBondContact O-N 3.21Å; S180-D183 PolarHBondContact O-N 3.11Å; S180-Y184 WeakPolarHBondContact O-CD1 3.38Å; S180-Y184 VanDerWaalsContact O-CD2 3.26Å; S180-Y184 WeakPolarHBondContact O-CD2 3.4Å; S180-Y184 PolarHBondContact O-N 2.99Å; S180-E208 PolarHBondContact OG-OE1 3.16Å; S180-E208 PolarHBondContact OG-OE2 3.17Å; S180-T225 PolarHBondContact OG-OG1 3.39Å |
| 181 | I | 88.3 | Confident | 86.9 | Confident | 7 Ų | 7 | 29 Ų | 29 | 4% | 0.036 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -62.1 | -42.1 | 172.8 | -71.3 | 161.5 | 0 | 0 | 0 | 111.2 | I31 M177 I178 E179 N185 F205 | I31-I181 HydrophobicContact CD1-CD1 3.62Å; M177-I181 WeakPolarHBondContact O-CD1 3.46Å; M177-I181 VanDerWaalsContact O-CG1 3.29Å; M177-I181 WeakPolarHBondContact O-CG1 3.43Å; M177-I181 PolarHBondContact O-N 2.88Å; M177-I181 VanDerWaalsContact O-N 3.12Å; I178-I181 PolarHBondContact O-N 3.09Å; E179-I181 PolarHBondContact O-N 3.04Å; I181-N185 PolarHBondContact O-N 2.94Å; I181-N185 PolarHBondContact O-ND2 3.21Å; I181-F205 HydrophobicContact CD1-CE2 4.4Å; I181-F205 HydrophobicContact CD1-CZ 4.46Å; I181-F205 HydrophobicContact CG1-CE2 3.86Å; I181-F205 HydrophobicContact CG1-CZ 3.86Å |
| 182 | G | 83 | Confident | 86.4 | Confident | 3 Ų | 3 | 36.8 Ų | 36.8 | 3% | 0.031 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -62.2 | -46.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | I178 E179 S180 Y184 N185 L186 | I178-G182 PolarHBondContact O-N 3.43Å; E179-G182 WeakPolarHBondContact O-CA 3.33Å; E179-G182 PolarHBondContact O-N 3.29Å; S180-G182 VanDerWaalsContact C-N 3.34Å; S180-G182 PolarHBondContact O-N 3.21Å; G182-Y184 PolarHBondContact O-N 3.05Å; G182-N185 PolarHBondContact O-N 2.76Å; G182-L186 PolarHBondContact O-N 3.35Å |
| 183 | D | 86.1 | Confident | 86 | Confident | 0 Ų | 0 | 36.3 Ų | 36.3 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -61.4 | -42.3 | 178.5 | -81.5 | 0.3 | 0 | 0 | 0 | 112.7 | E179 S180 N185 L186 C187 T226 A228 I231 | E179-D183 PolarHBondContact O-N 2.96Å; S180-D183 PolarHBondContact O-N 3.11Å; D183-N185 VanDerWaalsContact C-N 3.31Å; D183-N185 PolarHBondContact O-N 2.99Å; D183-L186 PolarHBondContact O-N 3.04Å; D183-C187 VanDerWaalsContact O-CB 3.24Å; D183-C187 WeakPolarHBondContact O-CB 3.32Å; D183-C187 PolarHBondContact O-N 3.47Å; D183-T226 HydrophobicContact CB-CG2 3.91Å; D183-A228 PolarHBondContact OD2-N 3.28Å; D183-I231 HydrophobicContact CB-CD1 3.54Å; D183-I231 WeakPolarHBondContact O-CD1 3.27Å |
| 184 | Y | 88.3 | Confident | 85.5 | Confident | 34 Ų | 34 | 37.8 Ų | 37.8 | 13% | 0.133 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -62.5 | -39.3 | 176.4 | -58.8 | -23.9 | 0 | 0 | 0 | 112.1 | S180 G182 A188 A204 F205 E208 T226 | S180-Y184 WeakPolarHBondContact O-CD1 3.38Å; S180-Y184 VanDerWaalsContact O-CD2 3.26Å; S180-Y184 WeakPolarHBondContact O-CD2 3.4Å; S180-Y184 PolarHBondContact O-N 2.99Å; G182-Y184 PolarHBondContact O-N 3.05Å; Y184-A188 WeakPolarHBondContact O-CB 3.37Å; Y184-A188 PolarHBondContact O-N 3.23Å; Y184-A204 HydrophobicContact CD2-CB 4.4Å; Y184-A204 HydrophobicContact CE1-CB 4.34Å; Y184-A204 HydrophobicContact CE2-CB 3.56Å; Y184-A204 WeakPolarHBondContact OH-CB 3.32Å; Y184-F205 HydrophobicContact CE2-CD2 4.48Å; Y184-F205 AromaticContact CE2-CE2 3.91Å; Y184-F205 HydrophobicContact CE2-CE2 3.91Å; Y184-F205 AromaticContact CE2-CZ 3.91Å; Y184-F205 HydrophobicContact CE2-CZ 3.91Å; Y184-E208 PolarHBondContact OH-OE2 3.2Å; Y184-T226 HydrophobicContact CE1-CG2 4.4Å; Y184-T226 WeakPolarHBondContact CE1-OG1 3.36Å |
| 185 | N | 83.1 | Confident | 84.9 | Confident | 45 Ų | 45 | 37.1 Ų | 37.1 | 24% | 0.241 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -67.6 | -40.9 | 176.6 | -67 | -42.3 | 0 | 0 | 0 | 111.6 | I181 G182 D183 A188 K189 | I181-N185 PolarHBondContact O-N 2.94Å; I181-N185 PolarHBondContact O-ND2 3.21Å; G182-N185 PolarHBondContact O-N 2.76Å; D183-N185 VanDerWaalsContact C-N 3.31Å; D183-N185 PolarHBondContact O-N 2.99Å; N185-A188 PolarHBondContact O-N 3.33Å; N185-K189 PolarHBondContact O-N 3.45Å |
| 186 | L | 81.8 | Confident | 84.7 | Confident | 31 Ų | 31 | 37.7 Ų | 37.7 | 16% | 0.162 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -65.8 | -43 | 176.6 | -177 | 60.5 | 0 | 0 | 0 | 111.3 | G182 D183 A188 K189 I190 I231 V287 | G182-L186 PolarHBondContact O-N 3.35Å; D183-L186 PolarHBondContact O-N 3.04Å; L186-A188 VanDerWaalsContact C-N 3.34Å; L186-A188 PolarHBondContact O-N 3.1Å; L186-K189 PolarHBondContact O-N 2.99Å; L186-I190 HydrophobicContact CD1-CD1 4.14Å; L186-I190 HydrophobicContact CG-CD1 3.92Å; L186-I190 WeakPolarHBondContact O-CG1 3.35Å; L186-I190 PolarHBondContact O-N 3.47Å; L186-I231 HydrophobicContact CB-CG2 4.37Å; L186-I231 HydrophobicContact CD2-CG2 3.87Å; L186-I231 HydrophobicContact CG-CG2 3.81Å; L186-V287 HydrophobicContact CD2-CG1 3.59Å |
| 187 | C | 86.3 | Confident | 84.5 | Confident | 36 Ų | 36 | 38.8 Ų | 38.8 | 24% | 0.243 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -61.5 | -41.5 | 175.5 | -174.6 | 0 | 0 | 0 | 0 | 111.7 | D183 I190 S191 I231 | D183-C187 VanDerWaalsContact O-CB 3.24Å; D183-C187 WeakPolarHBondContact O-CB 3.32Å; D183-C187 PolarHBondContact O-N 3.47Å; C187-I190 PolarHBondContact O-N 3.41Å; C187-S191 WeakPolarHBondContact O-CB 3.41Å; C187-S191 PolarHBondContact O-N 3.2Å; C187-S191 PolarHBondContact O-OG 3.11Å; C187-I231 HydrophobicContact CB-CD1 4.18Å; C187-I231 HydrophobicContact CB-CG1 4.4Å; C187-I231 HydrophobicContact CB-CG2 4.46Å |
| 188 | A | 85.5 | Confident | 84.3 | Confident | 7 Ų | 7 | 40.9 Ų | 40.9 | 6% | 0.058 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -60.5 | -47 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y184 N185 L186 I190 S191 K192 Q193 P196 Y389 | Y184-A188 WeakPolarHBondContact O-CB 3.37Å; Y184-A188 PolarHBondContact O-N 3.23Å; N185-A188 PolarHBondContact O-N 3.33Å; L186-A188 VanDerWaalsContact C-N 3.34Å; L186-A188 PolarHBondContact O-N 3.1Å; A188-I190 PolarHBondContact O-N 3.18Å; A188-S191 CarbonylContact O-C 3.47Å; A188-S191 PolarHBondContact O-N 3.4Å; A188-K192 PolarHBondContact O-N 3.35Å; A188-Q193 HydrophobicContact CB-CB 4.4Å; A188-Q193 PolarHBondContact O-N 2.93Å; A188-P196 HydrophobicContact CB-CG 4.32Å; A188-Y389 VanDerWaalsContact CB-OH 3.32Å; A188-Y389 WeakPolarHBondContact CB-OH 3.14Å |
| 189 | K | 81.2 | Confident | 84.2 | Confident | 149 Ų | 149 | 40.3 Ų | 40.3 | 65% | 0.648 | 21% | 0.207 | S | C | * | . | H | α-helix | trans | -59.9 | -45 | 177.2 | -172.2 | 176.5 | -177.8 | 178.4 | 0 | 112.5 | N185 L186 S191 K192 | N185-K189 PolarHBondContact O-N 3.45Å; L186-K189 PolarHBondContact O-N 2.99Å; K189-S191 VanDerWaalsContact C-N 3.31Å; K189-S191 PolarHBondContact O-N 2.98Å; K189-K192 PolarHBondContact O-N 3.41Å |
| 190 | I | 82.9 | Confident | 84.3 | Confident | 42 Ų | 42 | 40.4 Ų | 40.4 | 22% | 0.215 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -66.4 | -36.2 | 177.7 | -70 | 160.8 | 0 | 0 | 0 | 111.3 | L186 C187 A188 K192 I231 M234 T240 | L186-I190 HydrophobicContact CD1-CD1 4.14Å; L186-I190 HydrophobicContact CG-CD1 3.92Å; L186-I190 WeakPolarHBondContact O-CG1 3.35Å; L186-I190 PolarHBondContact O-N 3.47Å; C187-I190 PolarHBondContact O-N 3.41Å; A188-I190 PolarHBondContact O-N 3.18Å; I190-K192 PolarHBondContact O-N 3.44Å; I190-I231 HydrophobicContact CD1-CG2 3.38Å; I190-M234 HydrophobicContact CG2-CB 4.18Å; I190-T240 HydrophobicContact CG2-CG2 4.07Å |
| 191 | S | 84.3 | Confident | 84.3 | Confident | 27 Ų | 27 | 40.9 Ų | 40.9 | 19% | 0.189 | 21% | 0.211 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -81.9 | 1.2 | 179.2 | -53.3 | 0 | 0 | 0 | 0 | 113.8 | C187 A188 K189 Q193 T240 | C187-S191 WeakPolarHBondContact O-CB 3.41Å; C187-S191 PolarHBondContact O-N 3.2Å; C187-S191 PolarHBondContact O-OG 3.11Å; A188-S191 CarbonylContact O-C 3.47Å; A188-S191 PolarHBondContact O-N 3.4Å; K189-S191 VanDerWaalsContact C-N 3.31Å; K189-S191 PolarHBondContact O-N 2.98Å; S191-Q193 VanDerWaalsContact C-N 3.26Å; S191-Q193 PolarHBondContact O-N 3.02Å; S191-Q193 PolarHBondContact O-NE2 2.84Å; S191-T240 WeakPolarHBondContact OG-CG2 3.37Å |
| 192 | K | 82.8 | Confident | 84.5 | Confident | 171 Ų | 171 | 40.8 Ų | 40.8 | 74% | 0.743 | 21% | 0.211 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 52 | 45.6 | -174.5 | -55.4 | -176.3 | 177.6 | -171.4 | 0 | 112.2 | A188 K189 I190 | A188-K192 PolarHBondContact O-N 3.35Å; K189-K192 PolarHBondContact O-N 3.41Å; I190-K192 PolarHBondContact O-N 3.44Å |
| 193 | Q | 81.5 | Confident | 84.9 | Confident | 43 Ų | 43 | 43.1 Ų | 43.1 | 20% | 0.201 | 22% | 0.219 | C | C | . | . | trans | -110 | 154.4 | 175.6 | -61.2 | -62.6 | -61.6 | 0 | 0 | 109.5 | A188 S191 M386 Y389 | A188-Q193 HydrophobicContact CB-CB 4.4Å; A188-Q193 PolarHBondContact O-N 2.93Å; S191-Q193 VanDerWaalsContact C-N 3.26Å; S191-Q193 PolarHBondContact O-N 3.02Å; S191-Q193 PolarHBondContact O-NE2 2.84Å; Q193-M386 VanDerWaalsContact CD-O 3.27Å; Q193-M386 PolarHBondContact NE2-O 3Å; Q193-M386 PolarHBondContact OE1-O 3.34Å; Q193-Y389 HydrophobicContact CB-CE2 4.15Å | ||
| 194 | S | 80.8 | Confident | 85.2 | Confident | 41 Ų | 41 | 44.5 Ų | 44.5 | 29% | 0.287 | 23% | 0.23 | S | C | . | . | P | Polyproline II helix | trans | -59.7 | 166.7 | 166.5 | 54.7 | 0 | 0 | 0 | 0 | 111.1 | Y389 | S194-Y389 VanDerWaalsContact O-CE2 3.23Å; S194-Y389 WeakPolarHBondContact O-CE2 3.18Å; S194-Y389 VanDerWaalsContact O-CZ 3.31Å; S194-Y389 PolarHBondContact O-OH 3.2Å |
| 195 | R | 78 | Confident | 85.4 | Confident | 68 Ų | 68 | 42.9 Ų | 42.9 | 26% | 0.257 | 22% | 0.224 | S | C | . | . | P | Polyproline II helix | trans | -57.4 | 141.3 | 178 | -174.5 | 177.8 | 174.1 | 132.2 | 1.4 | 110.6 | S28 P197 E374 | S28-R195 PolarHBondContact O-NH2 3.43Å; R195-P197 WeakPolarHBondContact O-CD 3.25Å; R195-E374 VanDerWaalsContact CB-OE1 3.23Å; R195-E374 WeakPolarHBondContact CB-OE1 3.15Å; R195-E374 PolarHBondContact N-OE1 3.05Å |
| 196 | P | 83.5 | Confident | 85.9 | Confident | 15 Ų | 15 | 41.2 Ų | 41.2 | 10% | 0.097 | 22% | 0.215 | C | C | . | . | P | Polyproline II helix | trans | -55.8 | 123.9 | 178 | -24.2 | 31.8 | 0 | 0 | 0 | 111.5 | A188 Y389 | A188-P196 HydrophobicContact CB-CG 4.32Å; P196-Y389 HydrophobicContact CB-CE1 4.12Å; P196-Y389 WeakPolarHBondContact CD-OH 3.31Å; P196-Y389 HydrophobicContact CG-CE1 4.28Å; P196-Y389 WeakPolarHBondContact CG-OH 3.37Å |
| 197 | P | 84.1 | Confident | 86.5 | Confident | 39 Ų | 39 | 44.2 Ų | 44.2 | 25% | 0.253 | 23% | 0.234 | S | C | . | . | P | Polyproline II helix | trans | -64.6 | 156.8 | 177.7 | 23.6 | -31.1 | 0 | 0 | 0 | 110.4 | R195 S199 N200 T201 Y389 | R195-P197 WeakPolarHBondContact O-CD 3.25Å; P197-S199 PolarHBondContact O-N 2.88Å; P197-N200 HydrophobicContact CG-CB 3.87Å; P197-N200 PolarHBondContact O-N 3.22Å; P197-T201 PolarHBondContact O-N 3.3Å; P197-T201 PolarHBondContact O-OG1 3.27Å; P197-Y389 HydrophobicContact CG-CG 4.46Å |
| 198 | P | 85.1 | Confident | 86.8 | Confident | 56 Ų | 56 | 43.2 Ų | 43.2 | 36% | 0.364 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -55.6 | -37.1 | -178.9 | -27.2 | 35.1 | 0 | 0 | 0 | 113.5 | N200 T201 N202 | P198-N200 VanDerWaalsContact C-N 3.34Å; P198-N200 PolarHBondContact O-N 3.5Å; P198-T201 PolarHBondContact O-N 3.49Å; P198-N202 WeakPolarHBondContact O-CB 3.3Å; P198-N202 PolarHBondContact O-N 2.96Å; P198-N202 PolarHBondContact O-ND2 3.18Å; P198-N202 VanDerWaalsContact O-ND2 3.13Å |
| 199 | S | 86.5 | Confident | 87.2 | Confident | 16 Ų | 16 | 42.9 Ų | 42.9 | 11% | 0.112 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -61.9 | -41.2 | 177.8 | 55.3 | 0 | 0 | 0 | 0 | 112.5 | P197 R203 P409 | P197-S199 PolarHBondContact O-N 2.88Å; S199-R203 WeakPolarHBondContact O-CB 3.46Å; S199-R203 PolarHBondContact O-N 2.97Å; S199-P409 VanDerWaalsContact CA-O 3.3Å; S199-P409 WeakPolarHBondContact CA-O 3.48Å |
| 200 | N | 88.6 | Confident | 87.9 | Confident | 18 Ų | 18 | 39.7 Ų | 39.7 | 10% | 0.096 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -72.5 | -37.8 | 176.8 | -78.3 | 30.4 | 0 | 0 | 0 | 112.6 | P197 P198 R203 A204 Y389 | P197-N200 HydrophobicContact CG-CB 3.87Å; P197-N200 PolarHBondContact O-N 3.22Å; P198-N200 VanDerWaalsContact C-N 3.34Å; P198-N200 PolarHBondContact O-N 3.5Å; N200-R203 PolarHBondContact ND2-NH2 3.48Å; N200-R203 PolarHBondContact O-N 3.3Å; N200-R203 PolarHBondContact OD1-NH1 3.15Å; N200-R203 PolarHBondContact OD1-NH2 3.25Å; N200-A204 WeakPolarHBondContact O-CB 3.42Å; N200-A204 PolarHBondContact O-N 3.28Å; N200-Y389 HydrophobicContact CB-CD1 4.46Å; N200-Y389 WeakPolarHBondContact ND2-CA 3.33Å; N200-Y389 WeakPolarHBondContact ND2-CB 3.41Å; N200-Y389 WeakPolarHBondContact ND2-CD1 3.39Å; N200-Y389 PolarHBondContact ND2-O 2.8Å |
| 201 | T | 89 | Confident | 88.4 | Confident | 10 Ų | 10 | 38.7 Ų | 38.7 | 6% | 0.061 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -61.6 | -47.2 | 174.6 | -56.9 | 0 | 0 | 0 | 0 | 110.3 | V24 P197 P198 R203 A204 F205 | V24-T201 HydrophobicContact CG1-CG2 4.36Å; P197-T201 PolarHBondContact O-N 3.3Å; P197-T201 PolarHBondContact O-OG1 3.27Å; P198-T201 PolarHBondContact O-N 3.49Å; T201-R203 VanDerWaalsContact C-N 3.31Å; T201-R203 PolarHBondContact O-N 2.7Å; T201-A204 PolarHBondContact O-N 2.98Å; T201-F205 HydrophobicContact CG2-CD2 4.04Å; T201-F205 HydrophobicContact CG2-CE2 3.75Å; T201-F205 WeakPolarHBondContact O-CD2 3.4Å; T201-F205 PolarHBondContact O-N 3.02Å |
| 202 | N | 91.6 | Very high | 88.9 | Confident | 6 Ų | 6 | 37.5 Ų | 37.5 | 3% | 0.032 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -57.7 | -44.2 | 174.6 | -69.6 | -28.3 | 0 | 0 | 0 | 111.9 | G19 G22 G25 P198 F205 V206 P409 V410 | G19-N202 WeakPolarHBondContact O-CB 3.42Å; G22-N202 WeakPolarHBondContact CA-ND2 3.46Å; G25-N202 WeakPolarHBondContact CA-OD1 3.37Å; G25-N202 PolarHBondContact N-OD1 3.45Å; P198-N202 WeakPolarHBondContact O-CB 3.3Å; P198-N202 PolarHBondContact O-N 2.96Å; P198-N202 PolarHBondContact O-ND2 3.18Å; P198-N202 VanDerWaalsContact O-ND2 3.13Å; N202-F205 PolarHBondContact O-N 3.08Å; N202-V206 WeakPolarHBondContact O-CG2 3.1Å; N202-V206 PolarHBondContact O-N 3.49Å; N202-V206 VanDerWaalsContact O-N 3.11Å; N202-P409 WeakPolarHBondContact CB-O 3.46Å; N202-P409 PolarHBondContact ND2-O 3.08Å; N202-V410 HydrophobicContact CB-CG2 4.22Å |
| 203 | R | 91.7 | Very high | 89.5 | Confident | 52 Ų | 52 | 31 Ų | 31 | 20% | 0.196 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -62.4 | -41.5 | 177.1 | -170.7 | 166.1 | 65.4 | -117.4 | 6 | 112.9 | S199 N200 T201 F205 V206 V207 V410 | S199-R203 WeakPolarHBondContact O-CB 3.46Å; S199-R203 PolarHBondContact O-N 2.97Å; N200-R203 PolarHBondContact ND2-NH2 3.48Å; N200-R203 PolarHBondContact O-N 3.3Å; N200-R203 PolarHBondContact OD1-NH1 3.15Å; N200-R203 PolarHBondContact OD1-NH2 3.25Å; T201-R203 VanDerWaalsContact C-N 3.31Å; T201-R203 PolarHBondContact O-N 2.7Å; R203-F205 VanDerWaalsContact C-N 3.34Å; R203-F205 PolarHBondContact O-N 2.93Å; R203-V206 PolarHBondContact O-N 3.26Å; R203-V207 WeakPolarHBondContact O-CG2 3.49Å; R203-V207 PolarHBondContact O-N 3.33Å; R203-V410 HydrophobicContact CB-CG1 3.7Å; R203-V410 HydrophobicContact CG-CG1 3.74Å; R203-V410 PolarHBondContact NH1-O 3.17Å |
| 204 | A | 92 | Very high | 90 | Very high | 29 Ų | 29 | 32.9 Ų | 32.9 | 24% | 0.24 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -59.7 | -46.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | Y184 N200 T201 V206 V207 E208 | Y184-A204 HydrophobicContact CD2-CB 4.4Å; Y184-A204 HydrophobicContact CE1-CB 4.34Å; Y184-A204 HydrophobicContact CE2-CB 3.56Å; Y184-A204 WeakPolarHBondContact OH-CB 3.32Å; N200-A204 WeakPolarHBondContact O-CB 3.42Å; N200-A204 PolarHBondContact O-N 3.28Å; T201-A204 PolarHBondContact O-N 2.98Å; A204-V206 PolarHBondContact O-N 2.65Å; A204-V207 PolarHBondContact O-N 2.89Å; A204-V207 VanDerWaalsContact O-N 3.12Å; A204-E208 WeakPolarHBondContact O-CB 3.38Å; A204-E208 PolarHBondContact O-N 2.9Å |
| 205 | F | 93 | Very high | 90.5 | Very high | 0 Ų | 0 | 31.4 Ų | 31.4 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -67.5 | -30.1 | 176.9 | -75.4 | -63.3 | 0 | 0 | 0 | 115 | V24 M177 I181 Y184 T201 N202 R203 G209 | V24-F205 HydrophobicContact CB-CD2 4Å; V24-F205 HydrophobicContact CG1-CD2 3.22Å; V24-F205 HydrophobicContact CG1-CE2 3.34Å; V24-F205 HydrophobicContact CG1-CG 4.08Å; V24-F205 HydrophobicContact CG1-CZ 4.3Å; V24-F205 HydrophobicContact CG2-CD2 4.3Å; V24-F205 HydrophobicContact CG2-CG 4.49Å; M177-F205 HydrophobicContact CB-CD1 4.33Å; M177-F205 HydrophobicContact CB-CE1 3.7Å; M177-F205 HydrophobicContact CB-CZ 4.02Å; M177-F205 HydrophobicContact CE-CD1 4.29Å; M177-F205 HydrophobicContact CE-CG 4.37Å; M177-F205 HydrophobicContact CG-CD1 3.76Å; M177-F205 HydrophobicContact CG-CE1 3.59Å; M177-F205 HydrophobicContact CG-CZ 4.34Å; M177-F205 VanDerWaalsContact O-CZ 3.27Å; M177-F205 WeakPolarHBondContact O-CZ 3.48Å; I181-F205 HydrophobicContact CD1-CE2 4.4Å; I181-F205 HydrophobicContact CD1-CZ 4.46Å; I181-F205 HydrophobicContact CG1-CE2 3.86Å; I181-F205 HydrophobicContact CG1-CZ 3.86Å; Y184-F205 HydrophobicContact CE2-CD2 4.48Å; Y184-F205 AromaticContact CE2-CE2 3.91Å; Y184-F205 HydrophobicContact CE2-CE2 3.91Å; Y184-F205 AromaticContact CE2-CZ 3.91Å; Y184-F205 HydrophobicContact CE2-CZ 3.91Å; T201-F205 HydrophobicContact CG2-CD2 4.04Å; T201-F205 HydrophobicContact CG2-CE2 3.75Å; T201-F205 WeakPolarHBondContact O-CD2 3.4Å; T201-F205 PolarHBondContact O-N 3.02Å; N202-F205 PolarHBondContact O-N 3.08Å; R203-F205 VanDerWaalsContact C-N 3.34Å; R203-F205 PolarHBondContact O-N 2.93Å; F205-G209 PolarHBondContact O-N 3.2Å |
| 206 | V | 94.3 | Very high | 91.1 | Very high | 9 Ų | 9 | 28.4 Ų | 28.4 | 6% | 0.055 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -63.7 | -45.9 | 170 | 172.3 | 0 | 0 | 0 | 0 | 110.3 | F20 N202 R203 A204 G209 I210 V410 | F20-V206 HydrophobicContact CD1-CG2 4.44Å; F20-V206 HydrophobicContact CD2-CG1 4.47Å; F20-V206 HydrophobicContact CD2-CG2 4.02Å; F20-V206 HydrophobicContact CE1-CG1 4.44Å; F20-V206 HydrophobicContact CE1-CG2 4.44Å; F20-V206 HydrophobicContact CE2-CG1 3.67Å; F20-V206 HydrophobicContact CE2-CG2 4.02Å; F20-V206 HydrophobicContact CG-CG2 4.22Å; F20-V206 HydrophobicContact CZ-CG1 3.65Å; F20-V206 HydrophobicContact CZ-CG2 4.23Å; N202-V206 WeakPolarHBondContact O-CG2 3.1Å; N202-V206 PolarHBondContact O-N 3.49Å; N202-V206 VanDerWaalsContact O-N 3.11Å; R203-V206 PolarHBondContact O-N 3.26Å; A204-V206 PolarHBondContact O-N 2.65Å; V206-G209 PolarHBondContact O-N 3.16Å; V206-I210 HydrophobicContact CG1-CD1 3.85Å; V206-I210 WeakPolarHBondContact O-CD1 3.28Å; V206-I210 WeakPolarHBondContact O-CG1 3.47Å; V206-I210 PolarHBondContact O-N 3Å; V206-V410 HydrophobicContact CG2-CG2 3.82Å |
| 207 | V | 93.4 | Very high | 91.5 | Very high | 94 Ų | 94 | 29.9 Ų | 29.9 | 57% | 0.57 | 18% | 0.175 | S | C | * | . | H | α-helix | trans | -67.4 | -43.5 | 180 | 175.3 | 0 | 0 | 0 | 0 | 111.4 | R203 A204 I210 G211 | R203-V207 WeakPolarHBondContact O-CG2 3.49Å; R203-V207 PolarHBondContact O-N 3.33Å; A204-V207 PolarHBondContact O-N 2.89Å; A204-V207 VanDerWaalsContact O-N 3.12Å; V207-I210 PolarHBondContact O-N 3.04Å; V207-G211 PolarHBondContact O-N 2.82Å |
| 208 | E | 93.7 | Very high | 91.8 | Very high | 15 Ų | 15 | 32.8 Ų | 32.8 | 7% | 0.07 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -61.4 | -45.9 | 175.8 | -166.6 | 165.2 | 134.2 | 0 | 0 | 110.9 | S180 Y184 A204 I210 G211 C212 T226 | S180-E208 PolarHBondContact OG-OE1 3.16Å; S180-E208 PolarHBondContact OG-OE2 3.17Å; Y184-E208 PolarHBondContact OH-OE2 3.2Å; A204-E208 WeakPolarHBondContact O-CB 3.38Å; A204-E208 PolarHBondContact O-N 2.9Å; E208-I210 PolarHBondContact O-N 3.31Å; E208-G211 CarbonylContact O-C 3.07Å; E208-G211 WeakPolarHBondContact O-CA 3.28Å; E208-G211 PolarHBondContact O-N 3.37Å; E208-G211 VanDerWaalsContact O-N 3.09Å; E208-C212 PolarHBondContact O-N 3.09Å; E208-C212 PolarHBondContact O-SG 2.95Å; E208-T226 PolarHBondContact OE2-OG1 3.33Å |
| 209 | G | 94.4 | Very high | 91.8 | Very high | 0 Ų | 0 | 30.4 Ų | 30.4 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -61.6 | -40 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | F205 V206 G211 C212 I213 | F205-G209 PolarHBondContact O-N 3.2Å; V206-G209 PolarHBondContact O-N 3.16Å; G209-G211 VanDerWaalsContact C-N 3.34Å; G209-C212 WeakPolarHBondContact O-CB 3.27Å; G209-C212 PolarHBondContact O-N 3.49Å; G209-I213 VanDerWaalsContact O-CG1 3.27Å; G209-I213 WeakPolarHBondContact O-CG1 3.39Å; G209-I213 PolarHBondContact O-N 2.97Å |
| 210 | I | 94.8 | Very high | 91.7 | Very high | 82 Ų | 82 | 33.7 Ų | 33.7 | 42% | 0.421 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -62.2 | -43.8 | 171.8 | -70.4 | 163.9 | 0 | 0 | 0 | 110.2 | V206 V207 E208 C212 I213 L214 | V206-I210 HydrophobicContact CG1-CD1 3.85Å; V206-I210 WeakPolarHBondContact O-CD1 3.28Å; V206-I210 WeakPolarHBondContact O-CG1 3.47Å; V206-I210 PolarHBondContact O-N 3Å; V207-I210 PolarHBondContact O-N 3.04Å; E208-I210 PolarHBondContact O-N 3.31Å; I210-C212 VanDerWaalsContact C-N 3.29Å; I210-C212 PolarHBondContact O-N 3.46Å; I210-I213 WeakPolarHBondContact O-CB 3.28Å; I210-I213 PolarHBondContact O-N 2.96Å; I210-L214 HydrophobicContact CG2-CD1 4.25Å; I210-L214 HydrophobicContact CG2-CG 4.47Å; I210-L214 WeakPolarHBondContact O-CG 3.39Å; I210-L214 PolarHBondContact O-N 3.25Å |
| 211 | G | 94.2 | Very high | 91.1 | Very high | 21 Ų | 21 | 33.3 Ų | 33.3 | 22% | 0.216 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -56.4 | -43.4 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | V207 E208 G209 L214 A215 | V207-G211 PolarHBondContact O-N 2.82Å; E208-G211 CarbonylContact O-C 3.07Å; E208-G211 WeakPolarHBondContact O-CA 3.28Å; E208-G211 PolarHBondContact O-N 3.37Å; E208-G211 VanDerWaalsContact O-N 3.09Å; G209-G211 VanDerWaalsContact C-N 3.34Å; G211-L214 PolarHBondContact O-N 3.3Å; G211-A215 PolarHBondContact O-N 3.39Å |
| 212 | C | 94.3 | Very high | 90.9 | Very high | 2 Ų | 2 | 36.8 Ų | 36.8 | 1% | 0.014 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -64.8 | -40.4 | 176.5 | -73.9 | 0 | 0 | 0 | 0 | 112.4 | V12 E208 G209 I210 L214 A215 A216 V224 | V12-C212 HydrophobicContact CB-CB 3.64Å; V12-C212 HydrophobicContact CG1-CB 3.63Å; V12-C212 HydrophobicContact CG2-CB 4.05Å; E208-C212 PolarHBondContact O-N 3.09Å; E208-C212 PolarHBondContact O-SG 2.95Å; G209-C212 WeakPolarHBondContact O-CB 3.27Å; G209-C212 PolarHBondContact O-N 3.49Å; I210-C212 VanDerWaalsContact C-N 3.29Å; I210-C212 PolarHBondContact O-N 3.46Å; C212-L214 VanDerWaalsContact C-N 3.34Å; C212-A215 PolarHBondContact O-N 2.9Å; C212-A216 WeakPolarHBondContact O-CB 3.45Å; C212-A216 PolarHBondContact O-N 3.21Å; C212-V224 HydrophobicContact CB-CG2 4.47Å; C212-V224 PolarHBondContact SG-N 3.01Å; C212-V224 PolarHBondContact SG-O 3.17Å |
| 213 | I | 94.2 | Very high | 90.5 | Very high | 35 Ų | 35 | 38.6 Ų | 38.6 | 18% | 0.179 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -60.8 | -46 | 174.7 | -69.5 | 163.7 | 0 | 0 | 0 | 109.9 | L9 V12 L13 P16 G209 I210 A216 L217 | L9-I213 HydrophobicContact CD1-CG2 3.97Å; V12-I213 HydrophobicContact CG2-CG1 3.76Å; L13-I213 HydrophobicContact CD2-CD1 3.83Å; L13-I213 HydrophobicContact CD2-CG1 4.25Å; P16-I213 HydrophobicContact CG-CD1 4.15Å; G209-I213 VanDerWaalsContact O-CG1 3.27Å; G209-I213 WeakPolarHBondContact O-CG1 3.39Å; G209-I213 PolarHBondContact O-N 2.97Å; I210-I213 WeakPolarHBondContact O-CB 3.28Å; I210-I213 PolarHBondContact O-N 2.96Å; I213-A216 PolarHBondContact O-N 2.86Å; I213-L217 HydrophobicContact CG2-CD1 3.91Å; I213-L217 HydrophobicContact CG2-CG 4.34Å; I213-L217 WeakPolarHBondContact O-CB 3.48Å; I213-L217 VanDerWaalsContact O-CG 3.26Å; I213-L217 WeakPolarHBondContact O-CG 3.47Å; I213-L217 PolarHBondContact O-N 3.44Å |
| 214 | L | 92.6 | Very high | 90.5 | Very high | 83 Ų | 83 | 39 Ų | 39 | 44% | 0.435 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -61.8 | -46.9 | 176 | -63.1 | 172.8 | 0 | 0 | 0 | 110.6 | I210 G211 C212 A216 L217 W218 | I210-L214 HydrophobicContact CG2-CD1 4.25Å; I210-L214 HydrophobicContact CG2-CG 4.47Å; I210-L214 WeakPolarHBondContact O-CG 3.39Å; I210-L214 PolarHBondContact O-N 3.25Å; G211-L214 PolarHBondContact O-N 3.3Å; C212-L214 VanDerWaalsContact C-N 3.34Å; L214-A216 VanDerWaalsContact C-N 3.31Å; L214-A216 PolarHBondContact O-N 3.4Å; L214-L217 PolarHBondContact O-N 3.24Å; L214-W218 HydrophobicContact CB-CE3 4.26Å; L214-W218 HydrophobicContact CB-CZ3 4.24Å; L214-W218 HydrophobicContact CD2-CE3 4.33Å; L214-W218 HydrophobicContact CD2-CH2 4.24Å; L214-W218 HydrophobicContact CD2-CZ3 3.51Å; L214-W218 HydrophobicContact CG-CZ3 4.46Å; L214-W218 PolarHBondContact O-N 3.34Å |
| 215 | A | 91.7 | Very high | 90.4 | Very high | 10 Ų | 10 | 40 Ų | 40 | 8% | 0.083 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -58.5 | -41.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | G211 C212 G219 V220 V224 | G211-A215 PolarHBondContact O-N 3.39Å; C212-A215 PolarHBondContact O-N 2.9Å; A215-G219 PolarHBondContact O-N 3.23Å; A215-V220 HydrophobicContact CB-CB 4.32Å; A215-V220 HydrophobicContact CB-CG2 4.24Å; A215-V220 WeakPolarHBondContact O-CB 3.38Å; A215-V220 WeakPolarHBondContact O-CG2 3.49Å; A215-V220 PolarHBondContact O-N 3.27Å; A215-V224 HydrophobicContact CB-CG1 4.04Å |
| 216 | A | 91.5 | Very high | 90.2 | Very high | 4 Ų | 4 | 41.7 Ų | 41.7 | 3% | 0.033 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -67 | -42.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | C8 L9 C212 I213 L214 G219 | C8-A216 HydrophobicContact CB-CB 4.45Å; L9-A216 HydrophobicContact CB-CB 3.89Å; L9-A216 HydrophobicContact CD1-CB 4.06Å; C212-A216 WeakPolarHBondContact O-CB 3.45Å; C212-A216 PolarHBondContact O-N 3.21Å; I213-A216 PolarHBondContact O-N 2.86Å; L214-A216 VanDerWaalsContact C-N 3.31Å; L214-A216 PolarHBondContact O-N 3.4Å; A216-G219 PolarHBondContact O-N 3.39Å; A216-G219 VanDerWaalsContact O-N 3.15Å |
| 217 | L | 91.3 | Very high | 89.9 | Confident | 47 Ų | 47 | 47.6 Ų | 47.6 | 25% | 0.246 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -64.2 | -39.3 | 177.5 | -74.7 | 174 | 0 | 0 | 0 | 112.4 | L9 L154 I213 L214 G219 | L9-L217 HydrophobicContact CD1-CD2 4.08Å; L9-L217 HydrophobicContact CD1-CG 4.03Å; L9-L217 HydrophobicContact CD2-CD2 4.02Å; L154-L217 HydrophobicContact CD2-CD2 4.15Å; L154-L217 PolarHBondContact N-O 3.28Å; I213-L217 HydrophobicContact CG2-CD1 3.91Å; I213-L217 HydrophobicContact CG2-CG 4.34Å; I213-L217 WeakPolarHBondContact O-CB 3.48Å; I213-L217 VanDerWaalsContact O-CG 3.26Å; I213-L217 WeakPolarHBondContact O-CG 3.47Å; I213-L217 PolarHBondContact O-N 3.44Å; L214-L217 PolarHBondContact O-N 3.24Å; L217-G219 PolarHBondContact O-N 3.06Å |
| 218 | W | 90.1 | Very high | 89.3 | Confident | 99 Ų | 99 | 43.4 Ų | 43.4 | 38% | 0.375 | 25% | 0.246 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -78.4 | -1.4 | 176.5 | -91.4 | -89.5 | 0 | 0 | 0 | 113.9 | P151 P153 L214 | P151-W218 PolarHBondContact O-NE1 2.85Å; P153-W218 HydrophobicContact CB-CD2 4.47Å; P153-W218 HydrophobicContact CB-CE3 4.48Å; L214-W218 HydrophobicContact CB-CE3 4.26Å; L214-W218 HydrophobicContact CB-CZ3 4.24Å; L214-W218 HydrophobicContact CD2-CE3 4.33Å; L214-W218 HydrophobicContact CD2-CH2 4.24Å; L214-W218 HydrophobicContact CD2-CZ3 3.51Å; L214-W218 HydrophobicContact CG-CZ3 4.46Å; L214-W218 PolarHBondContact O-N 3.34Å |
| 219 | G | 84.4 | Confident | 88.7 | Confident | 7 Ų | 7 | 44.8 Ų | 44.8 | 7% | 0.072 | 25% | 0.253 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 79.2 | 19.4 | 172.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | F156 A215 A216 L217 G221 | F156-G219 WeakPolarHBondContact CE2-O 3.35Å; A215-G219 PolarHBondContact O-N 3.23Å; A216-G219 PolarHBondContact O-N 3.39Å; A216-G219 VanDerWaalsContact O-N 3.15Å; L217-G219 PolarHBondContact O-N 3.06Å; G219-G221 PolarHBondContact O-N 3.48Å |
| 220 | V | 84.4 | Confident | 88.3 | Confident | 85 Ų | 85 | 48.4 Ų | 48.4 | 52% | 0.515 | 27% | 0.272 | S | S | . | . | trans | -59.2 | -33.7 | 177.7 | -175.1 | 0 | 0 | 0 | 0 | 110.7 | A215 T222 | A215-V220 HydrophobicContact CB-CB 4.32Å; A215-V220 HydrophobicContact CB-CG2 4.24Å; A215-V220 WeakPolarHBondContact O-CB 3.38Å; A215-V220 WeakPolarHBondContact O-CG2 3.49Å; A215-V220 PolarHBondContact O-N 3.27Å; V220-T222 WeakPolarHBondContact CG1-OG1 3.42Å; V220-T222 PolarHBondContact O-N 3.27Å | ||
| 221 | G | 76.2 | Confident | 87.8 | Confident | 9 Ų | 9 | 44.8 Ų | 44.8 | 9% | 0.093 | 25% | 0.253 | C | S | . | . | trans | 80.3 | 2.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | G219 | G219-G221 PolarHBondContact O-N 3.48Š| ||
| 222 | T | 84.5 | Confident | 87.2 | Confident | 84 Ų | 84 | 44.7 Ų | 44.7 | 52% | 0.515 | 25% | 0.251 | S | S | . | . | S | Bend | trans | -129.9 | 158.3 | 175.2 | 60.4 | 0 | 0 | 0 | 0 | 110.4 | V220 | V220-T222 WeakPolarHBondContact CG1-OG1 3.42Å; V220-T222 PolarHBondContact O-N 3.27Å |
| 223 | G | 85 | Confident | 86.5 | Confident | 43 Ų | 43 | 47.2 Ų | 47.2 | 44% | 0.443 | 26% | 0.264 | S | S | . | . | trans | -80.9 | 166.5 | 170.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 224 | V | 89.9 | Confident | 86.1 | Confident | 61 Ų | 61 | 46.8 Ų | 46.8 | 37% | 0.37 | 26% | 0.261 | S | S | . | . | trans | -105.2 | 147 | 168.7 | -59.7 | 0 | 0 | 0 | 0 | 109.2 | C212 A215 | C212-V224 HydrophobicContact CB-CG2 4.47Å; C212-V224 PolarHBondContact SG-N 3.01Å; C212-V224 PolarHBondContact SG-O 3.17Å; A215-V224 HydrophobicContact CB-CG1 4.04Å | ||
| 225 | T | 90.5 | Very high | 85.5 | Confident | 49 Ų | 49 | 44.9 Ų | 44.9 | 30% | 0.301 | 26% | 0.255 | S | S | . | . | trans | -142.7 | 171.5 | 178 | -171.7 | 0 | 0 | 0 | 0 | 109.5 | S180 Y227 | S180-T225 PolarHBondContact OG-OG1 3.39Å; T225-Y227 WeakPolarHBondContact O-CD2 3.45Å | ||
| 226 | T | 89.6 | Confident | 84.9 | Confident | 37 Ų | 37 | 46.7 Ų | 46.7 | 23% | 0.227 | 27% | 0.265 | C | S | . | . | trans | -70.1 | 134.7 | 169.7 | -59.8 | 0 | 0 | 0 | 0 | 109.6 | D183 Y184 E208 I231 | D183-T226 HydrophobicContact CB-CG2 3.91Å; Y184-T226 HydrophobicContact CE1-CG2 4.4Å; Y184-T226 WeakPolarHBondContact CE1-OG1 3.36Å; E208-T226 PolarHBondContact OE2-OG1 3.33Å; T226-I231 HydrophobicContact CG2-CD1 3.97Å | ||
| 227 | Y | 86.6 | Confident | 84.5 | Confident | 133 Ų | 133 | 48.4 Ų | 48.4 | 52% | 0.522 | 28% | 0.275 | S | S | . | . | trans | -94.8 | 108.2 | -178.2 | -89.6 | -120.4 | 0 | 0 | 0 | 110.4 | T225 E229 N230 I231 | T225-Y227 WeakPolarHBondContact O-CD2 3.45Å; Y227-E229 WeakPolarHBondContact CD1-OE2 3.44Å; Y227-E229 PolarHBondContact O-N 3.4Å; Y227-E229 VanDerWaalsContact O-N 3.16Å; Y227-N230 WeakPolarHBondContact O-CB 3.4Å; Y227-N230 PolarHBondContact O-N 2.93Å; Y227-I231 PolarHBondContact O-N 3.11Å | ||
| 228 | A | 81.6 | Confident | 84.1 | Confident | 5 Ų | 5 | 53.9 Ų | 53.9 | 4% | 0.041 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -54.9 | -30 | 174 | 0 | 0 | 0 | 0 | 0 | 113.1 | D183 I231 A232 | D183-A228 PolarHBondContact OD2-N 3.28Å; A228-I231 WeakPolarHBondContact O-CB 3.34Å; A228-I231 PolarHBondContact O-N 3.48Å; A228-A232 PolarHBondContact O-N 3.18Å |
| 229 | E | 81.8 | Confident | 83.9 | Confident | 44 Ų | 44 | 52.6 Ų | 52.6 | 21% | 0.206 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -64.1 | -40.7 | 176.8 | -59.3 | 165.7 | 140.4 | 0 | 0 | 111.9 | Y227 I231 A232 I233 G280 L283 I284 | Y227-E229 WeakPolarHBondContact CD1-OE2 3.44Å; Y227-E229 PolarHBondContact O-N 3.4Å; Y227-E229 VanDerWaalsContact O-N 3.16Å; E229-I231 VanDerWaalsContact C-N 3.27Å; E229-I231 PolarHBondContact O-N 3.23Å; E229-A232 WeakPolarHBondContact O-CB 3.49Å; E229-A232 PolarHBondContact O-N 2.69Å; E229-I233 WeakPolarHBondContact O-CG1 3.2Å; E229-I233 PolarHBondContact O-N 3.12Å; E229-G280 WeakPolarHBondContact OE1-CA 3.2Å; E229-L283 HydrophobicContact CB-CD2 4.44Å; E229-L283 HydrophobicContact CG-CD2 4.24Å; E229-I284 HydrophobicContact CG-CG1 4.26Å |
| 230 | N | 86.1 | Confident | 84 | Confident | 77 Ų | 77 | 55 Ų | 55 | 41% | 0.412 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -65.5 | -35.6 | 174.8 | -70.2 | -22.1 | 0 | 0 | 0 | 110.9 | Y227 I233 M234 | Y227-N230 WeakPolarHBondContact O-CB 3.4Å; Y227-N230 PolarHBondContact O-N 2.93Å; N230-I233 PolarHBondContact O-N 3.08Å; N230-M234 WeakPolarHBondContact O-CG 3.29Å; N230-M234 PolarHBondContact O-N 3.32Å |
| 231 | I | 84.6 | Confident | 84.1 | Confident | 5 Ų | 5 | 53.6 Ų | 53.6 | 3% | 0.026 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -66.1 | -41.6 | 175.2 | -60.4 | 172.7 | 0 | 0 | 0 | 110.9 | D183 L186 C187 I190 T226 Y227 A228 E229 I233 M234 S235 | D183-I231 HydrophobicContact CB-CD1 3.54Å; D183-I231 WeakPolarHBondContact O-CD1 3.27Å; L186-I231 HydrophobicContact CB-CG2 4.37Å; L186-I231 HydrophobicContact CD2-CG2 3.87Å; L186-I231 HydrophobicContact CG-CG2 3.81Å; C187-I231 HydrophobicContact CB-CD1 4.18Å; C187-I231 HydrophobicContact CB-CG1 4.4Å; C187-I231 HydrophobicContact CB-CG2 4.46Å; I190-I231 HydrophobicContact CD1-CG2 3.38Å; T226-I231 HydrophobicContact CG2-CD1 3.97Å; Y227-I231 PolarHBondContact O-N 3.11Å; A228-I231 WeakPolarHBondContact O-CB 3.34Å; A228-I231 PolarHBondContact O-N 3.48Å; E229-I231 VanDerWaalsContact C-N 3.27Å; E229-I231 PolarHBondContact O-N 3.23Å; I231-I233 VanDerWaalsContact C-N 3.33Å; I231-I233 PolarHBondContact O-N 3.15Å; I231-M234 HydrophobicContact CB-CE 4.09Å; I231-M234 HydrophobicContact CG1-CE 3.74Å; I231-M234 HydrophobicContact CG2-CE 4.36Å; I231-M234 WeakPolarHBondContact O-CB 3.47Å; I231-M234 PolarHBondContact O-N 2.77Å; I231-S235 PolarHBondContact O-N 3.44Å; I231-S235 VanDerWaalsContact O-N 3.11Å |
| 232 | A | 79.8 | Confident | 84.6 | Confident | 19 Ų | 19 | 59.3 Ų | 59.3 | 16% | 0.157 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -58.7 | -44.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | A228 E229 M234 S235 V236 L283 | A228-A232 PolarHBondContact O-N 3.18Å; E229-A232 WeakPolarHBondContact O-CB 3.49Å; E229-A232 PolarHBondContact O-N 2.69Å; A232-M234 PolarHBondContact O-N 2.82Å; A232-S235 WeakPolarHBondContact O-CB 3.48Å; A232-S235 PolarHBondContact O-N 3.05Å; A232-S235 VanDerWaalsContact O-N 3.1Å; A232-S235 PolarHBondContact O-OG 3.16Å; A232-V236 PolarHBondContact O-N 2.86Å; A232-L283 HydrophobicContact CB-CD2 4.31Å |
| 233 | I | 81.1 | Confident | 84.8 | Confident | 56 Ų | 56 | 60.6 Ų | 60.6 | 29% | 0.287 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -64.3 | -38.5 | 176.8 | -65.3 | 168.7 | 0 | 0 | 0 | 111.8 | E229 N230 I231 S235 V236 T237 | E229-I233 WeakPolarHBondContact O-CG1 3.2Å; E229-I233 PolarHBondContact O-N 3.12Å; N230-I233 PolarHBondContact O-N 3.08Å; I231-I233 VanDerWaalsContact C-N 3.33Å; I231-I233 PolarHBondContact O-N 3.15Å; I233-S235 PolarHBondContact O-N 3.31Å; I233-V236 PolarHBondContact O-N 3.37Å; I233-V236 VanDerWaalsContact O-N 3.14Å; I233-T237 HydrophobicContact CG2-CG2 3.76Å; I233-T237 WeakPolarHBondContact O-CB 3.4Å; I233-T237 WeakPolarHBondContact O-CG2 3.5Å; I233-T237 PolarHBondContact O-N 3.26Å; I233-T237 PolarHBondContact O-OG1 3.04Å |
| 234 | M | 85.4 | Confident | 85 | Confident | 25 Ų | 25 | 62 Ų | 62 | 12% | 0.123 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -59 | -37 | 173.3 | -73 | -169.6 | -70.6 | 0 | 0 | 111.8 | I190 N230 I231 A232 V236 T237 K238 T240 | I190-M234 HydrophobicContact CG2-CB 4.18Å; N230-M234 WeakPolarHBondContact O-CG 3.29Å; N230-M234 PolarHBondContact O-N 3.32Å; I231-M234 HydrophobicContact CB-CE 4.09Å; I231-M234 HydrophobicContact CG1-CE 3.74Å; I231-M234 HydrophobicContact CG2-CE 4.36Å; I231-M234 WeakPolarHBondContact O-CB 3.47Å; I231-M234 PolarHBondContact O-N 2.77Å; A232-M234 PolarHBondContact O-N 2.82Å; M234-V236 VanDerWaalsContact C-N 3.28Å; M234-V236 PolarHBondContact O-N 3.49Å; M234-T237 WeakPolarHBondContact CA-OG1 3.48Å; M234-K238 WeakPolarHBondContact O-CA 3.4Å; M234-K238 PolarHBondContact O-N 3.08Å; M234-T240 HydrophobicContact CB-CG2 4.37Å; M234-T240 HydrophobicContact SD-CG2 4.44Å |
| 235 | S | 80.1 | Confident | 85 | Confident | 44 Ų | 44 | 63.8 Ų | 63.8 | 31% | 0.308 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -64.6 | -31.5 | 177.8 | 87.2 | 0 | 0 | 0 | 0 | 113 | I231 A232 I233 K238 | I231-S235 PolarHBondContact O-N 3.44Å; I231-S235 VanDerWaalsContact O-N 3.11Å; A232-S235 WeakPolarHBondContact O-CB 3.48Å; A232-S235 PolarHBondContact O-N 3.05Å; A232-S235 VanDerWaalsContact O-N 3.1Å; A232-S235 PolarHBondContact O-OG 3.16Å; I233-S235 PolarHBondContact O-N 3.31Å; S235-K238 WeakPolarHBondContact O-CD 3.39Å; S235-K238 WeakPolarHBondContact O-CE 3.42Å; S235-K238 PolarHBondContact O-NZ 3.38Å |
| 236 | V | 78.8 | Confident | 85.1 | Confident | 47 Ų | 47 | 67.5 Ų | 67.5 | 29% | 0.285 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -86 | -49.8 | 179 | -179.4 | 0 | 0 | 0 | 0 | 111.3 | S101 A232 I233 M234 K238 | S101-V236 WeakPolarHBondContact OG-CG1 3.45Å; A232-V236 PolarHBondContact O-N 2.86Å; I233-V236 PolarHBondContact O-N 3.37Å; I233-V236 VanDerWaalsContact O-N 3.14Å; M234-V236 VanDerWaalsContact C-N 3.28Å; M234-V236 PolarHBondContact O-N 3.49Å; V236-K238 VanDerWaalsContact C-N 3.25Å; V236-K238 PolarHBondContact O-N 3.17Å |
| 237 | T | 83.3 | Confident | 85.3 | Confident | 40 Ų | 40 | 71.6 Ų | 71.6 | 25% | 0.245 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -69.5 | -23.1 | -177 | 55.7 | 0 | 0 | 0 | 0 | 113 | Q102 I233 M234 V239 | Q102-T237 HydrophobicContact CG-CG2 4Å; I233-T237 HydrophobicContact CG2-CG2 3.76Å; I233-T237 WeakPolarHBondContact O-CB 3.4Å; I233-T237 WeakPolarHBondContact O-CG2 3.5Å; I233-T237 PolarHBondContact O-N 3.26Å; I233-T237 PolarHBondContact O-OG1 3.04Å; M234-T237 WeakPolarHBondContact CA-OG1 3.48Å; T237-V239 PolarHBondContact O-N 3.41Å; T237-V239 PolarHBondContact OG1-N 3.28Å |
| 238 | K | 83 | Confident | 85.6 | Confident | 163 Ų | 163 | 67.4 Ų | 67.4 | 71% | 0.709 | 36% | 0.359 | S | S | * | . | trans | 57.2 | 23.8 | -171.8 | -52.8 | -57.3 | -174.4 | -167 | 0 | 113.1 | M234 S235 V236 | M234-K238 WeakPolarHBondContact O-CA 3.4Å; M234-K238 PolarHBondContact O-N 3.08Å; S235-K238 WeakPolarHBondContact O-CD 3.39Å; S235-K238 WeakPolarHBondContact O-CE 3.42Å; S235-K238 PolarHBondContact O-NZ 3.38Å; V236-K238 VanDerWaalsContact C-N 3.25Å; V236-K238 PolarHBondContact O-N 3.17Å | ||
| 239 | V | 85.5 | Confident | 86.1 | Confident | 72 Ų | 72 | 68.6 Ų | 68.6 | 44% | 0.436 | 37% | 0.371 | S | S | . | . | trans | -107.3 | 103.1 | 175.6 | -180 | 0 | 0 | 0 | 0 | 108.6 | T237 T244 | T237-V239 PolarHBondContact O-N 3.41Å; T237-V239 PolarHBondContact OG1-N 3.28Å; V239-T244 HydrophobicContact CG1-CG2 4.4Å | ||
| 240 | T | 86.4 | Confident | 86.7 | Confident | 58 Ų | 58 | 70.2 Ų | 70.2 | 36% | 0.356 | 38% | 0.384 | S | S | . | . | trans | -110.5 | 19.7 | 179.5 | 55.8 | 0 | 0 | 0 | 0 | 112.6 | I190 S191 M234 | I190-T240 HydrophobicContact CG2-CG2 4.07Å; S191-T240 WeakPolarHBondContact OG-CG2 3.37Å; M234-T240 HydrophobicContact CB-CG2 4.37Å; M234-T240 HydrophobicContact SD-CG2 4.44Å | ||
| 241 | S | 86.8 | Confident | 87.1 | Confident | 54 Ų | 54 | 73.1 Ų | 73.1 | 38% | 0.378 | 39% | 0.393 | S | S | . | . | trans | -70.1 | 130.7 | -178.4 | 179.8 | 0 | 0 | 0 | 0 | 112.4 | I243 T244 | S241-I243 PolarHBondContact O-N 2.85Å; S241-I243 PolarHBondContact OG-N 3.38Å; S241-T244 WeakPolarHBondContact O-CB 3.19Å; S241-T244 PolarHBondContact O-N 3.19Å | ||
| 242 | R | 87.2 | Confident | 87.5 | Confident | 129 Ų | 129 | 78.7 Ų | 78.7 | 49% | 0.487 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -58.9 | -34.2 | 174.7 | -67.5 | -178.2 | -96.3 | -167.7 | -5.9 | 112.6 | T244 M245 Q246 N387 G388 A390 | R242-T244 VanDerWaalsContact C-N 3.33Å; R242-T244 PolarHBondContact O-N 3.36Å; R242-M245 PolarHBondContact O-N 3.34Å; R242-Q246 WeakPolarHBondContact O-CG 3.41Å; R242-Q246 PolarHBondContact O-N 3.07Å; R242-Q246 VanDerWaalsContact O-N 3.08Å; R242-N387 PolarHBondContact NH2-O 3.37Å; R242-G388 PolarHBondContact NH1-O 3.29Å; R242-A390 PolarHBondContact NH1-O 2.77Å |
| 243 | I | 88.5 | Confident | 88 | Confident | 111 Ų | 111 | 83.6 Ų | 83.6 | 57% | 0.569 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -65.9 | -38.6 | -178.6 | -62.4 | 173.8 | 0 | 0 | 0 | 110.4 | S241 M245 Q246 M247 | S241-I243 PolarHBondContact O-N 2.85Å; S241-I243 PolarHBondContact OG-N 3.38Å; I243-M245 VanDerWaalsContact C-N 3.3Å; I243-M245 PolarHBondContact O-N 2.87Å; I243-Q246 PolarHBondContact O-N 3.44Å; I243-M247 HydrophobicContact CG2-CG 4.18Å; I243-M247 WeakPolarHBondContact O-CG 3.47Å; I243-M247 PolarHBondContact O-N 2.91Å |
| 244 | T | 89.7 | Confident | 88.5 | Confident | 73 Ų | 73 | 85.8 Ų | 85.8 | 45% | 0.448 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -58.4 | -44.9 | 177.3 | -53.8 | 0 | 0 | 0 | 0 | 110.9 | V239 S241 R242 M247 A248 | V239-T244 HydrophobicContact CG1-CG2 4.4Å; S241-T244 WeakPolarHBondContact O-CB 3.19Å; S241-T244 PolarHBondContact O-N 3.19Å; R242-T244 VanDerWaalsContact C-N 3.33Å; R242-T244 PolarHBondContact O-N 3.36Å; T244-M247 PolarHBondContact O-N 3.4Å; T244-A248 WeakPolarHBondContact O-CB 3.4Å; T244-A248 PolarHBondContact O-N 3.34Å |
| 245 | M | 89.9 | Confident | 88.8 | Confident | 99 Ų | 99 | 85.1 Ų | 85.1 | 49% | 0.488 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -67.6 | -38.1 | 177.9 | -61.9 | -56.3 | -69.4 | 0 | 0 | 112.6 | R242 I243 A248 G249 | R242-M245 PolarHBondContact O-N 3.34Å; I243-M245 VanDerWaalsContact C-N 3.3Å; I243-M245 PolarHBondContact O-N 2.87Å; M245-A248 PolarHBondContact O-N 2.92Å; M245-G249 PolarHBondContact O-N 2.93Å |
| 246 | Q | 91.8 | Very high | 89.2 | Confident | 126 Ų | 126 | 85.2 Ų | 85.2 | 59% | 0.589 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -63.7 | -45.3 | 175.4 | -71.7 | 171.9 | -14.1 | 0 | 0 | 111.8 | R242 I243 A248 G249 V250 | R242-Q246 WeakPolarHBondContact O-CG 3.41Å; R242-Q246 PolarHBondContact O-N 3.07Å; R242-Q246 VanDerWaalsContact O-N 3.08Å; I243-Q246 PolarHBondContact O-N 3.44Å; Q246-A248 VanDerWaalsContact C-N 3.35Å; Q246-G249 PolarHBondContact O-N 3.25Å; Q246-V250 WeakPolarHBondContact O-CG2 3.28Å; Q246-V250 PolarHBondContact O-N 3.35Å |
| 247 | M | 93.5 | Very high | 89.7 | Confident | 124 Ų | 124 | 84.6 Ų | 84.6 | 61% | 0.611 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -64 | -40.8 | 177.1 | -69.3 | -58.5 | -62.2 | 0 | 0 | 111.5 | I243 T244 V250 F251 | I243-M247 HydrophobicContact CG2-CG 4.18Å; I243-M247 WeakPolarHBondContact O-CG 3.47Å; I243-M247 PolarHBondContact O-N 2.91Å; T244-M247 PolarHBondContact O-N 3.4Å; M247-V250 PolarHBondContact O-N 2.94Å; M247-F251 WeakPolarHBondContact O-CB 3.46Å; M247-F251 PolarHBondContact O-N 3.01Å |
| 248 | A | 92 | Very high | 90.2 | Very high | 45 Ų | 45 | 86.4 Ų | 86.4 | 37% | 0.372 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -60.4 | -44.5 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | T244 M245 Q246 F251 L252 | T244-A248 WeakPolarHBondContact O-CB 3.4Å; T244-A248 PolarHBondContact O-N 3.34Å; M245-A248 PolarHBondContact O-N 2.92Å; Q246-A248 VanDerWaalsContact C-N 3.35Å; A248-F251 PolarHBondContact O-N 3.38Å; A248-L252 WeakPolarHBondContact O-CG 3.43Å; A248-L252 PolarHBondContact O-N 2.99Å |
| 249 | G | 93.4 | Very high | 90.5 | Very high | 30 Ų | 30 | 79.2 Ų | 79.2 | 31% | 0.309 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -60.9 | -45.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | M245 Q246 F251 L252 I253 | M245-G249 PolarHBondContact O-N 2.93Å; Q246-G249 PolarHBondContact O-N 3.25Å; G249-F251 VanDerWaalsContact C-N 3.33Å; G249-F251 PolarHBondContact O-N 3.43Å; G249-L252 PolarHBondContact O-N 3.41Å; G249-I253 VanDerWaalsContact O-CG1 3.31Å; G249-I253 WeakPolarHBondContact O-CG1 3.39Å; G249-I253 PolarHBondContact O-N 2.86Å |
| 250 | V | 94.5 | Very high | 90.7 | Very high | 77 Ų | 77 | 77 Ų | 77 | 47% | 0.467 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -61.8 | -43.1 | 175.6 | 173 | 0 | 0 | 0 | 0 | 110.9 | Q246 M247 L252 I253 L254 | Q246-V250 WeakPolarHBondContact O-CG2 3.28Å; Q246-V250 PolarHBondContact O-N 3.35Å; M247-V250 PolarHBondContact O-N 2.94Å; V250-L252 PolarHBondContact O-N 3.06Å; V250-I253 PolarHBondContact O-N 2.9Å; V250-L254 HydrophobicContact CG1-CD1 4.15Å; V250-L254 WeakPolarHBondContact O-CG 3.43Å; V250-L254 PolarHBondContact O-N 3.5Å |
| 251 | F | 93.9 | Very high | 90.9 | Very high | 139 Ų | 139 | 78.7 Ų | 78.7 | 61% | 0.61 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -61.2 | -44.2 | 176.7 | -179.1 | -96.1 | 0 | 0 | 0 | 112 | M247 A248 G249 I253 L254 A255 | M247-F251 WeakPolarHBondContact O-CB 3.46Å; M247-F251 PolarHBondContact O-N 3.01Å; A248-F251 PolarHBondContact O-N 3.38Å; G249-F251 VanDerWaalsContact C-N 3.33Å; G249-F251 PolarHBondContact O-N 3.43Å; F251-I253 PolarHBondContact O-N 3.03Å; F251-L254 PolarHBondContact O-N 3.36Å; F251-A255 WeakPolarHBondContact O-CB 3.4Å; F251-A255 PolarHBondContact O-N 3.37Å |
| 252 | L | 92.1 | Very high | 90.9 | Very high | 121 Ų | 121 | 78.6 Ų | 78.6 | 63% | 0.634 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -65.2 | -37.2 | 177.3 | -70.9 | 173.2 | 0 | 0 | 0 | 112.5 | A248 G249 V250 A255 G256 | A248-L252 WeakPolarHBondContact O-CG 3.43Å; A248-L252 PolarHBondContact O-N 2.99Å; G249-L252 PolarHBondContact O-N 3.41Å; V250-L252 PolarHBondContact O-N 3.06Å; L252-A255 PolarHBondContact O-N 3.25Å; L252-G256 PolarHBondContact O-N 3.39Å |
| 253 | I | 91.4 | Very high | 91 | Very high | 122 Ų | 122 | 72.6 Ų | 72.6 | 63% | 0.626 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -62.6 | -47.6 | 173.4 | -69.3 | 165.7 | 0 | 0 | 0 | 110.3 | G249 V250 F251 A255 G256 V257 | G249-I253 VanDerWaalsContact O-CG1 3.31Å; G249-I253 WeakPolarHBondContact O-CG1 3.39Å; G249-I253 PolarHBondContact O-N 2.86Å; V250-I253 PolarHBondContact O-N 2.9Å; F251-I253 PolarHBondContact O-N 3.03Å; I253-A255 VanDerWaalsContact C-N 3.35Å; I253-A255 PolarHBondContact O-N 2.94Å; I253-G256 PolarHBondContact O-N 3.46Å; I253-V257 WeakPolarHBondContact O-CG2 3.48Å; I253-V257 PolarHBondContact O-N 3.1Å; I253-V257 VanDerWaalsContact O-N 3.13Å |
| 254 | L | 91.6 | Very high | 91 | Very high | 103 Ų | 103 | 71.9 Ų | 71.9 | 54% | 0.539 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -62.3 | -43 | 177.7 | -68.8 | 173.4 | 0 | 0 | 0 | 111.6 | V250 F251 G256 V257 I258 | V250-L254 HydrophobicContact CG1-CD1 4.15Å; V250-L254 WeakPolarHBondContact O-CG 3.43Å; V250-L254 PolarHBondContact O-N 3.5Å; F251-L254 PolarHBondContact O-N 3.36Å; L254-G256 VanDerWaalsContact C-N 3.31Å; L254-G256 PolarHBondContact O-N 3.44Å; L254-V257 PolarHBondContact O-N 3.14Å; L254-I258 WeakPolarHBondContact O-CG1 3.36Å; L254-I258 PolarHBondContact O-N 3.02Å |
| 255 | A | 90.8 | Very high | 90.9 | Very high | 11 Ų | 11 | 72.2 Ų | 72.2 | 9% | 0.091 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -62.5 | -36.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | F251 L252 I253 I258 F261 | F251-A255 WeakPolarHBondContact O-CB 3.4Å; F251-A255 PolarHBondContact O-N 3.37Å; L252-A255 PolarHBondContact O-N 3.25Å; I253-A255 VanDerWaalsContact C-N 3.35Å; I253-A255 PolarHBondContact O-N 2.94Å; A255-I258 PolarHBondContact O-N 2.94Å; A255-F261 HydrophobicContact CB-CD1 3.91Å; A255-F261 HydrophobicContact CB-CE1 4.02Å |
| 256 | G | 88.6 | Confident | 90.8 | Very high | 45 Ų | 45 | 70.3 Ų | 70.3 | 46% | 0.464 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -68 | -32 | 175.8 | 0 | 0 | 0 | 0 | 0 | 114 | L252 I253 L254 I258 | L252-G256 PolarHBondContact O-N 3.39Å; I253-G256 PolarHBondContact O-N 3.46Å; L254-G256 VanDerWaalsContact C-N 3.31Å; L254-G256 PolarHBondContact O-N 3.44Å; G256-I258 VanDerWaalsContact C-N 3.33Å |
| 257 | V | 90.5 | Very high | 90.6 | Very high | 35 Ų | 35 | 65.8 Ų | 65.8 | 21% | 0.212 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -72.2 | -29.1 | 174.8 | 172.6 | 0 | 0 | 0 | 0 | 111.6 | V148 Q149 M150 I253 L254 S259 | V148-V257 WeakPolarHBondContact CA-O 3.46Å; V148-V257 HydrophobicContact CG1-CG1 3.73Å; Q149-V257 PolarHBondContact N-O 3.16Å; M150-V257 HydrophobicContact SD-CB 4.42Å; M150-V257 HydrophobicContact SD-CG1 3.8Å; M150-V257 HydrophobicContact SD-CG2 3.72Å; I253-V257 WeakPolarHBondContact O-CG2 3.48Å; I253-V257 PolarHBondContact O-N 3.1Å; I253-V257 VanDerWaalsContact O-N 3.13Å; L254-V257 PolarHBondContact O-N 3.14Å; V257-S259 PolarHBondContact O-N 2.89Å; V257-S259 VanDerWaalsContact O-N 3.13Å; V257-S259 PolarHBondContact O-OG 3.23Å |
| 258 | I | 93.2 | Very high | 90.6 | Very high | 78 Ų | 78 | 61.2 Ų | 61.2 | 40% | 0.4 | 35% | 0.349 | S | S | . | . | trans | -82.4 | 85.1 | 175.3 | -58.6 | 165.5 | 0 | 0 | 0 | 108.9 | L254 A255 G256 K260 F261 | L254-I258 WeakPolarHBondContact O-CG1 3.36Å; L254-I258 PolarHBondContact O-N 3.02Å; A255-I258 PolarHBondContact O-N 2.94Å; G256-I258 VanDerWaalsContact C-N 3.33Å; I258-K260 PolarHBondContact O-N 3.28Å; I258-K260 VanDerWaalsContact O-N 3.15Å; I258-F261 HydrophobicContact CB-CB 4.45Å; I258-F261 HydrophobicContact CG2-CB 4.23Å; I258-F261 WeakPolarHBondContact O-CB 3.41Å; I258-F261 PolarHBondContact O-N 3.35Å | ||
| 259 | S | 89.2 | Confident | 90.6 | Very high | 12 Ų | 12 | 59.4 Ų | 59.4 | 8% | 0.084 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -66.3 | -22.6 | -169.9 | -46.9 | 0 | 0 | 0 | 0 | 114.3 | W147 Q149 V257 F261 A262 A263 | W147-S259 PolarHBondContact O-N 2.91Å; Q149-S259 WeakPolarHBondContact CA-OG 3.21Å; Q149-S259 WeakPolarHBondContact CB-OG 3.38Å; Q149-S259 PolarHBondContact N-OG 3.2Å; V257-S259 PolarHBondContact O-N 2.89Å; V257-S259 VanDerWaalsContact O-N 3.13Å; V257-S259 PolarHBondContact O-OG 3.23Å; S259-F261 PolarHBondContact O-N 2.95Å; S259-A262 PolarHBondContact O-N 3.09Å; S259-A263 PolarHBondContact O-N 2.97Å |
| 260 | K | 90.6 | Very high | 90.5 | Very high | 25 Ų | 25 | 61.9 Ų | 61.9 | 11% | 0.109 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -62.4 | -31.2 | 169.6 | -73.1 | -69.8 | -159.1 | -163.4 | 0 | 112.7 | F142 D143 T145 W147 I258 A263 F264 | F142-K260 HydrophobicContact CE2-CD 4.36Å; F142-K260 WeakPolarHBondContact O-CD 3.45Å; F142-K260 PolarHBondContact O-NZ 3.37Å; D143-K260 PolarHBondContact O-NZ 3.19Å; D143-K260 VanDerWaalsContact O-NZ 3.13Å; T145-K260 WeakPolarHBondContact O-CD 3.18Å; T145-K260 WeakPolarHBondContact O-CE 3.4Å; T145-K260 PolarHBondContact O-NZ 2.84Å; W147-K260 HydrophobicContact CD2-CG 3.88Å; W147-K260 HydrophobicContact CE3-CB 4.16Å; W147-K260 HydrophobicContact CE3-CG 3.82Å; W147-K260 HydrophobicContact CG-CG 4.25Å; W147-K260 HydrophobicContact CZ3-CB 4.36Å; W147-K260 HydrophobicContact CZ3-CG 4.28Å; I258-K260 PolarHBondContact O-N 3.28Å; I258-K260 VanDerWaalsContact O-N 3.15Å; K260-A263 PolarHBondContact O-N 2.7Å; K260-F264 WeakPolarHBondContact O-CB 3.36Å; K260-F264 PolarHBondContact O-N 2.89Å |
| 261 | F | 89.6 | Confident | 90.5 | Very high | 93 Ų | 93 | 58.2 Ų | 58.2 | 41% | 0.408 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -65.4 | -44.9 | 173.7 | -179.6 | -104.1 | 0 | 0 | 0 | 110.6 | A255 I258 S259 A263 F264 L265 | A255-F261 HydrophobicContact CB-CD1 3.91Å; A255-F261 HydrophobicContact CB-CE1 4.02Å; I258-F261 HydrophobicContact CB-CB 4.45Å; I258-F261 HydrophobicContact CG2-CB 4.23Å; I258-F261 WeakPolarHBondContact O-CB 3.41Å; I258-F261 PolarHBondContact O-N 3.35Å; S259-F261 PolarHBondContact O-N 2.95Å; F261-A263 PolarHBondContact O-N 2.9Å; F261-F264 WeakPolarHBondContact O-CB 3.31Å; F261-F264 PolarHBondContact O-N 3.33Å; F261-L265 HydrophobicContact CD1-CD1 4.16Å; F261-L265 HydrophobicContact CE1-CD1 3.66Å; F261-L265 HydrophobicContact CE1-CG 4.32Å; F261-L265 HydrophobicContact CZ-CD1 4.09Å; F261-L265 HydrophobicContact CZ-CD2 4.48Å; F261-L265 HydrophobicContact CZ-CG 4.42Å; F261-L265 WeakPolarHBondContact O-CG 3.26Å; F261-L265 PolarHBondContact O-N 3.38Å |
| 262 | A | 86.6 | Confident | 90.6 | Very high | 52 Ų | 52 | 51.6 Ų | 51.6 | 43% | 0.43 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -63.2 | -40.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | S259 F264 L265 S266 | S259-A262 PolarHBondContact O-N 3.09Å; A262-F264 VanDerWaalsContact C-N 3.33Å; A262-F264 PolarHBondContact O-N 3.05Å; A262-L265 PolarHBondContact O-N 3.44Å; A262-S266 PolarHBondContact O-N 3.37Å |
| 263 | A | 89 | Confident | 90.7 | Very high | 4 Ų | 4 | 49 Ų | 49 | 3% | 0.033 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -63.3 | -39.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | V141 F142 T145 S259 K260 F261 S266 M267 | V141-A263 HydrophobicContact CG1-CB 4.29Å; F142-A263 HydrophobicContact CD2-CB 4.09Å; T145-A263 HydrophobicContact CG2-CB 4.21Å; S259-A263 PolarHBondContact O-N 2.97Å; K260-A263 PolarHBondContact O-N 2.7Å; F261-A263 PolarHBondContact O-N 2.9Å; A263-S266 WeakPolarHBondContact O-CB 3.28Å; A263-S266 PolarHBondContact O-N 2.92Å; A263-S266 PolarHBondContact O-OG 3.34Å; A263-M267 PolarHBondContact O-N 2.79Å |
| 264 | F | 88.8 | Confident | 90.8 | Very high | 95 Ų | 95 | 43.2 Ų | 43.2 | 42% | 0.417 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -61.5 | -43.9 | 173 | 176 | -100.3 | 0 | 0 | 0 | 112.1 | F142 K260 F261 A262 S266 M267 | F142-F264 HydrophobicContact CD2-CB 4.49Å; F142-F264 HydrophobicContact CE2-CB 4.24Å; K260-F264 WeakPolarHBondContact O-CB 3.36Å; K260-F264 PolarHBondContact O-N 2.89Å; F261-F264 WeakPolarHBondContact O-CB 3.31Å; F261-F264 PolarHBondContact O-N 3.33Å; A262-F264 VanDerWaalsContact C-N 3.33Å; A262-F264 PolarHBondContact O-N 3.05Å; F264-S266 VanDerWaalsContact C-N 3.25Å; F264-S266 PolarHBondContact O-N 3.41Å; F264-M267 HydrophobicContact CD2-SD 4.46Å; F264-M267 VanDerWaalsContact O-CB 3.3Å; F264-M267 WeakPolarHBondContact O-CB 3.34Å; F264-M267 PolarHBondContact O-N 3.1Å |
| 265 | L | 88.4 | Confident | 91 | Very high | 81 Ų | 81 | 38.3 Ų | 38.3 | 42% | 0.424 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -62.5 | -32.5 | 175.3 | -66.4 | 178.8 | 0 | 0 | 0 | 112.5 | F261 A262 M267 I268 | F261-L265 HydrophobicContact CD1-CD1 4.16Å; F261-L265 HydrophobicContact CE1-CD1 3.66Å; F261-L265 HydrophobicContact CE1-CG 4.32Å; F261-L265 HydrophobicContact CZ-CD1 4.09Å; F261-L265 HydrophobicContact CZ-CD2 4.48Å; F261-L265 HydrophobicContact CZ-CG 4.42Å; F261-L265 WeakPolarHBondContact O-CG 3.26Å; F261-L265 PolarHBondContact O-N 3.38Å; A262-L265 PolarHBondContact O-N 3.44Å; L265-M267 PolarHBondContact O-N 3.41Å; L265-I268 HydrophobicContact CD2-CD1 3.93Å; L265-I268 WeakPolarHBondContact O-CB 3.14Å; L265-I268 WeakPolarHBondContact O-CG1 3.43Å; L265-I268 PolarHBondContact O-N 3.43Å; L265-I268 VanDerWaalsContact O-N 3.12Å |
| 266 | S | 87.7 | Confident | 91.1 | Very high | 58 Ų | 58 | 39.9 Ų | 39.9 | 41% | 0.406 | 22% | 0.223 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -68.9 | -11.7 | 174.6 | 79.3 | 0 | 0 | 0 | 0 | 114.2 | A262 A263 F264 I268 | A262-S266 PolarHBondContact O-N 3.37Å; A263-S266 WeakPolarHBondContact O-CB 3.28Å; A263-S266 PolarHBondContact O-N 2.92Å; A263-S266 PolarHBondContact O-OG 3.34Å; F264-S266 VanDerWaalsContact C-N 3.25Å; F264-S266 PolarHBondContact O-N 3.41Å; S266-I268 VanDerWaalsContact C-N 3.28Å |
| 267 | M | 87.7 | Confident | 91.3 | Very high | 31 Ų | 31 | 41.4 Ų | 41.4 | 15% | 0.153 | 22% | 0.22 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -83.1 | -5.2 | 172.7 | -57.9 | 176.9 | 70.3 | 0 | 0 | 112.7 | I139 F142 A263 F264 L265 P269 | I139-M267 HydrophobicContact CG1-CE 4.4Å; F142-M267 HydrophobicContact CB-SD 4.03Å; F142-M267 HydrophobicContact CD2-SD 3.99Å; F142-M267 HydrophobicContact CG-SD 4.06Å; A263-M267 PolarHBondContact O-N 2.79Å; F264-M267 HydrophobicContact CD2-SD 4.46Å; F264-M267 VanDerWaalsContact O-CB 3.3Å; F264-M267 WeakPolarHBondContact O-CB 3.34Å; F264-M267 PolarHBondContact O-N 3.1Å; L265-M267 PolarHBondContact O-N 3.41Å; M267-P269 VanDerWaalsContact O-CD 3.25Å; M267-P269 WeakPolarHBondContact O-CD 3.19Å |
| 268 | I | 92.3 | Very high | 91.5 | Very high | 28 Ų | 28 | 40.1 Ų | 40.1 | 14% | 0.144 | 21% | 0.213 | C | C | . | . | S | Bend | trans | -71 | 120.9 | 174.9 | -62.2 | 168.9 | 0 | 0 | 0 | 108.1 | I109 L265 S266 E270 I272 I273 | I109-I268 HydrophobicContact CG2-CD1 3.94Å; I109-I268 HydrophobicContact CG2-CG1 4.39Å; I109-I268 HydrophobicContact CG2-CG2 4.46Å; L265-I268 HydrophobicContact CD2-CD1 3.93Å; L265-I268 WeakPolarHBondContact O-CB 3.14Å; L265-I268 WeakPolarHBondContact O-CG1 3.43Å; L265-I268 PolarHBondContact O-N 3.43Å; L265-I268 VanDerWaalsContact O-N 3.12Å; S266-I268 VanDerWaalsContact C-N 3.28Å; I268-E270 PolarHBondContact O-N 2.87Å; I268-I272 HydrophobicContact CG2-CB 4.07Å; I268-I272 HydrophobicContact CG2-CG2 3.96Å; I268-I273 HydrophobicContact CG2-CG1 4.13Å |
| 269 | P | 92.8 | Very high | 91.5 | Very high | 7 Ų | 7 | 37 Ų | 37 | 5% | 0.045 | 20% | 0.197 | C | C | . | . | trans | -52.4 | 137 | 175.7 | -29.1 | 34.9 | 0 | 0 | 0 | 113.3 | C116 E130 T133 M267 P271 I272 I273 | C116-P269 HydrophobicContact CB-CG 4.46Å; E130-P269 WeakPolarHBondContact O-CB 3.4Å; T133-P269 HydrophobicContact CG2-CG 4.38Å; M267-P269 VanDerWaalsContact O-CD 3.25Å; M267-P269 WeakPolarHBondContact O-CD 3.19Å; P269-P271 VanDerWaalsContact C-N 3.32Å; P269-I272 HydrophobicContact CB-CD1 4.26Å; P269-I272 HydrophobicContact CG-CD1 4.09Å; P269-I272 WeakPolarHBondContact O-CB 3.47Å; P269-I272 PolarHBondContact O-N 3.09Å; P269-I272 VanDerWaalsContact O-N 3.07Å; P269-I273 PolarHBondContact O-N 3.01Å | ||
| 270 | E | 92.1 | Very high | 91.5 | Very high | 82 Ų | 82 | 36.7 Ų | 36.7 | 38% | 0.383 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -54.5 | -37.4 | 177.7 | -58.8 | -158 | 144 | 0 | 0 | 114.7 | K54 L57 I268 I272 I273 G274 | K54-E270 HydrophobicContact CD-CB 4.24Å; K54-E270 IonicContact NZ-OE1 2.97Å; K54-E270 PolarHBondContact NZ-OE1 3.4Å; K54-E270 IonicContact NZ-OE2 3.66Å; K54-E270 PolarHBondContact NZ-OE2 3.2Å; L57-E270 HydrophobicContact CD1-CB 3.65Å; L57-E270 WeakPolarHBondContact CD1-OE2 3.41Å; I268-E270 PolarHBondContact O-N 2.87Å; E270-I272 VanDerWaalsContact C-N 3.28Å; E270-I272 PolarHBondContact O-N 2.94Å; E270-I273 WeakPolarHBondContact O-CA 3.24Å; E270-I273 WeakPolarHBondContact O-CB 3.44Å; E270-I273 PolarHBondContact O-N 3.02Å; E270-I273 VanDerWaalsContact O-N 3.07Å; E270-G274 PolarHBondContact O-N 2.91Å |
| 271 | P | 94 | Very high | 91.6 | Very high | 0 Ų | 0 | 36.7 Ų | 36.7 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -56.8 | -37.4 | 175.3 | -28.4 | 36.3 | 0 | 0 | 0 | 114.1 | L57 H58 I60 S61 E130 P269 I273 G274 G275 | L57-P271 HydrophobicContact CB-CG 3.9Å; H58-P271 HydrophobicContact CB-CB 3.85Å; H58-P271 HydrophobicContact CB-CG 3.56Å; I60-P271 HydrophobicContact CG2-CB 3.38Å; I60-P271 HydrophobicContact CG2-CG 4.19Å; S61-P271 WeakPolarHBondContact CA-O 3.41Å; S61-P271 VanDerWaalsContact CB-O 3.28Å; S61-P271 WeakPolarHBondContact CB-O 3.44Å; S61-P271 WeakPolarHBondContact OG-CA 3.42Å; S61-P271 VanDerWaalsContact OG-CB 3.26Å; S61-P271 WeakPolarHBondContact OG-CB 3.38Å; S61-P271 PolarHBondContact OG-O 3.02Å; E130-P271 HydrophobicContact CB-CG 3.98Å; E130-P271 WeakPolarHBondContact O-CD 3.31Å; P269-P271 VanDerWaalsContact C-N 3.32Å; P271-I273 VanDerWaalsContact C-N 3.33Å; P271-G274 PolarHBondContact O-N 3.13Å; P271-G275 PolarHBondContact O-N 3.05Å; P271-G275 VanDerWaalsContact O-N 3.16Å |
| 272 | I | 95.9 | Very high | 91.7 | Very high | 1 Ų | 1 | 35.5 Ų | 35.5 | 1% | 0.005 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -65.2 | -42 | 176.6 | -69.5 | 166.7 | 0 | 0 | 0 | 109.6 | E64 I109 V112 W113 I268 P269 E270 G274 G275 L276 | E64-I272 HydrophobicContact CG-CG2 4.09Å; I109-I272 HydrophobicContact CG1-CG2 4.19Å; V112-I272 HydrophobicContact CB-CD1 4.5Å; V112-I272 HydrophobicContact CG1-CD1 4.06Å; V112-I272 HydrophobicContact CG1-CG1 3.87Å; W113-I272 HydrophobicContact CB-CD1 4.29Å; I268-I272 HydrophobicContact CG2-CB 4.07Å; I268-I272 HydrophobicContact CG2-CG2 3.96Å; P269-I272 HydrophobicContact CB-CD1 4.26Å; P269-I272 HydrophobicContact CG-CD1 4.09Å; P269-I272 WeakPolarHBondContact O-CB 3.47Å; P269-I272 PolarHBondContact O-N 3.09Å; P269-I272 VanDerWaalsContact O-N 3.07Å; E270-I272 VanDerWaalsContact C-N 3.28Å; E270-I272 PolarHBondContact O-N 2.94Å; I272-G274 VanDerWaalsContact C-N 3.26Å; I272-G274 PolarHBondContact O-N 3.19Å; I272-G275 PolarHBondContact O-N 3.29Å; I272-L276 WeakPolarHBondContact O-CB 3.39Å; I272-L276 PolarHBondContact O-N 3.33Å |
| 273 | I | 93.6 | Very high | 91.7 | Very high | 67 Ų | 67 | 35.3 Ų | 35.3 | 34% | 0.344 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -61 | -38.3 | 175.7 | -56.2 | 174.9 | 0 | 0 | 0 | 110.4 | I268 P269 E270 P271 L276 L277 | I268-I273 HydrophobicContact CG2-CG1 4.13Å; P269-I273 PolarHBondContact O-N 3.01Å; E270-I273 WeakPolarHBondContact O-CA 3.24Å; E270-I273 WeakPolarHBondContact O-CB 3.44Å; E270-I273 PolarHBondContact O-N 3.02Å; E270-I273 VanDerWaalsContact O-N 3.07Å; P271-I273 VanDerWaalsContact C-N 3.33Å; I273-L276 WeakPolarHBondContact O-CB 3.27Å; I273-L276 PolarHBondContact O-N 3.03Å; I273-L277 HydrophobicContact CG2-CD1 3.93Å; I273-L277 HydrophobicContact CG2-CG 4.16Å; I273-L277 WeakPolarHBondContact O-CB 3.26Å; I273-L277 VanDerWaalsContact O-CG 3.25Å; I273-L277 WeakPolarHBondContact O-CG 3.34Å; I273-L277 PolarHBondContact O-N 3.47Å |
| 274 | G | 94.2 | Very high | 91.6 | Very high | 0 Ų | 0 | 36.6 Ų | 36.6 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -58.3 | -49.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | E270 P271 I272 L276 L277 A278 | E270-G274 PolarHBondContact O-N 2.91Å; P271-G274 PolarHBondContact O-N 3.13Å; I272-G274 VanDerWaalsContact C-N 3.26Å; I272-G274 PolarHBondContact O-N 3.19Å; G274-L276 VanDerWaalsContact C-N 3.34Å; G274-L276 PolarHBondContact O-N 3.47Å; G274-L277 PolarHBondContact O-N 2.85Å; G274-A278 WeakPolarHBondContact O-CB 3.33Å; G274-A278 PolarHBondContact O-N 2.89Å |
| 275 | G | 94.9 | Very high | 91.7 | Very high | 0 Ų | 0 | 34.5 Ų | 34.5 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -63.8 | -37.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | P271 I272 M279 | P271-G275 PolarHBondContact O-N 3.05Å; P271-G275 VanDerWaalsContact O-N 3.16Å; I272-G275 PolarHBondContact O-N 3.29Å; G275-M279 PolarHBondContact O-N 3.32Å |
| 276 | L | 93.8 | Very high | 91.7 | Very high | 44 Ų | 44 | 32.5 Ų | 32.5 | 23% | 0.23 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -62.2 | -51.6 | 174 | -172.4 | 99.5 | 0 | 0 | 0 | 112 | L68 Y105 I109 I272 I273 G274 A278 M279 G280 | L68-L276 HydrophobicContact CD1-CD1 4.42Å; Y105-L276 HydrophobicContact CD1-CD1 3.44Å; Y105-L276 VanDerWaalsContact CD1-CD1 3.44Å; Y105-L276 HydrophobicContact CD1-CG 4.07Å; Y105-L276 HydrophobicContact CE1-CD1 4.31Å; Y105-L276 HydrophobicContact CG-CD1 4.1Å; I109-L276 HydrophobicContact CD1-CD1 3.69Å; I109-L276 HydrophobicContact CG1-CD1 3.87Å; I272-L276 WeakPolarHBondContact O-CB 3.39Å; I272-L276 PolarHBondContact O-N 3.33Å; I273-L276 WeakPolarHBondContact O-CB 3.27Å; I273-L276 PolarHBondContact O-N 3.03Å; G274-L276 VanDerWaalsContact C-N 3.34Å; G274-L276 PolarHBondContact O-N 3.47Å; L276-A278 VanDerWaalsContact C-N 3.3Å; L276-A278 PolarHBondContact O-N 2.99Å; L276-M279 PolarHBondContact O-N 3.06Å; L276-G280 PolarHBondContact O-N 3.25Å |
| 277 | L | 92.6 | Very high | 91.4 | Very high | 76 Ų | 76 | 30.5 Ų | 30.5 | 40% | 0.398 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -61.3 | -40.4 | 179.6 | -71.8 | 173.2 | 0 | 0 | 0 | 111.1 | I51 I273 G274 M279 G280 V281 | I51-L277 HydrophobicContact CG1-CB 4.09Å; I273-L277 HydrophobicContact CG2-CD1 3.93Å; I273-L277 HydrophobicContact CG2-CG 4.16Å; I273-L277 WeakPolarHBondContact O-CB 3.26Å; I273-L277 VanDerWaalsContact O-CG 3.25Å; I273-L277 WeakPolarHBondContact O-CG 3.34Å; I273-L277 PolarHBondContact O-N 3.47Å; G274-L277 PolarHBondContact O-N 2.85Å; L277-M279 PolarHBondContact O-N 3.3Å; L277-G280 PolarHBondContact O-N 3.48Å; L277-V281 WeakPolarHBondContact O-CB 3.29Å; L277-V281 WeakPolarHBondContact O-CG2 3.36Å; L277-V281 PolarHBondContact O-N 3.24Å |
| 278 | A | 94.4 | Very high | 91.4 | Very high | 8 Ų | 8 | 29 Ų | 29 | 7% | 0.066 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -56.9 | -48.5 | 175 | 0 | 0 | 0 | 0 | 0 | 111.7 | I51 M55 F65 G274 L276 C282 | I51-A278 HydrophobicContact CG2-CB 3.65Å; M55-A278 HydrophobicContact CE-CB 4.43Å; M55-A278 HydrophobicContact SD-CB 3.61Å; F65-A278 HydrophobicContact CD2-CB 3.74Å; F65-A278 HydrophobicContact CE2-CB 3.86Å; G274-A278 WeakPolarHBondContact O-CB 3.33Å; G274-A278 PolarHBondContact O-N 2.89Å; L276-A278 VanDerWaalsContact C-N 3.3Å; L276-A278 PolarHBondContact O-N 2.99Å; A278-C282 PolarHBondContact O-N 3.39Å; A278-C282 PolarHBondContact O-SG 2.8Å |
| 279 | M | 92.6 | Very high | 91.3 | Very high | 13 Ų | 13 | 31.7 Ų | 31.7 | 6% | 0.064 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -66 | -42.4 | 178.6 | -173.5 | 68.8 | -157.3 | 0 | 0 | 112.4 | F65 L68 I69 V72 Y105 G275 L276 L277 C282 L283 | F65-M279 HydrophobicContact CD2-CB 4.22Å; F65-M279 HydrophobicContact CE2-CB 4.3Å; F65-M279 HydrophobicContact CE2-SD 4.37Å; L68-M279 HydrophobicContact CB-CB 4.16Å; L68-M279 HydrophobicContact CB-CG 3.85Å; L68-M279 HydrophobicContact CB-SD 4.34Å; L68-M279 HydrophobicContact CD1-CB 3.7Å; L68-M279 HydrophobicContact CD1-CG 4.13Å; I69-M279 HydrophobicContact CG1-SD 4.16Å; V72-M279 HydrophobicContact CB-CE 3.76Å; V72-M279 HydrophobicContact CG1-CE 3.66Å; V72-M279 HydrophobicContact CG2-CE 4.05Å; Y105-M279 HydrophobicContact CE1-CB 4.18Å; Y105-M279 HydrophobicContact CE1-CG 4.08Å; G275-M279 PolarHBondContact O-N 3.32Å; L276-M279 PolarHBondContact O-N 3.06Å; L277-M279 PolarHBondContact O-N 3.3Å; M279-C282 WeakPolarHBondContact O-CB 3.23Å; M279-C282 PolarHBondContact O-N 3.2Å; M279-L283 PolarHBondContact O-N 3.12Å |
| 280 | G | 90.2 | Very high | 90.9 | Very high | 5 Ų | 5 | 33.3 Ų | 33.3 | 5% | 0.052 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -59.1 | -47.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112 | Y105 E229 L276 L277 C282 L283 I284 | Y105-G280 WeakPolarHBondContact OH-CA 3.31Å; E229-G280 WeakPolarHBondContact OE1-CA 3.2Å; L276-G280 PolarHBondContact O-N 3.25Å; L277-G280 PolarHBondContact O-N 3.48Å; G280-C282 VanDerWaalsContact C-N 3.33Å; G280-C282 PolarHBondContact O-N 3.24Å; G280-L283 WeakPolarHBondContact O-CB 3.41Å; G280-L283 PolarHBondContact O-N 2.89Å; G280-L283 VanDerWaalsContact O-N 3.07Å; G280-I284 WeakPolarHBondContact O-CG1 3.3Å; G280-I284 PolarHBondContact O-N 3.5Å |
| 281 | V | 91.7 | Very high | 90.6 | Very high | 25 Ų | 25 | 30.3 Ų | 30.3 | 15% | 0.152 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -64.4 | -36.2 | 177.1 | 172.4 | 0 | 0 | 0 | 0 | 111.9 | T44 I51 L277 L283 I284 N285 | T44-V281 HydrophobicContact CG2-CG1 3.86Å; I51-V281 HydrophobicContact CD1-CB 3.73Å; I51-V281 HydrophobicContact CD1-CG1 3.99Å; I51-V281 HydrophobicContact CD1-CG2 3.59Å; L277-V281 WeakPolarHBondContact O-CB 3.29Å; L277-V281 WeakPolarHBondContact O-CG2 3.36Å; L277-V281 PolarHBondContact O-N 3.24Å; V281-L283 VanDerWaalsContact C-N 3.35Å; V281-L283 PolarHBondContact O-N 3.18Å; V281-I284 PolarHBondContact O-N 2.82Å; V281-N285 WeakPolarHBondContact O-CB 3.33Å; V281-N285 PolarHBondContact O-N 3.29Å |
| 282 | C | 91.6 | Very high | 90.4 | Very high | 69 Ų | 69 | 31.9 Ų | 31.9 | 47% | 0.466 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -60.5 | -42.5 | 170.9 | -72.9 | 0 | 0 | 0 | 0 | 112.2 | A278 M279 G280 N285 G286 | A278-C282 PolarHBondContact O-N 3.39Å; A278-C282 PolarHBondContact O-SG 2.8Å; M279-C282 WeakPolarHBondContact O-CB 3.23Å; M279-C282 PolarHBondContact O-N 3.2Å; G280-C282 VanDerWaalsContact C-N 3.33Å; G280-C282 PolarHBondContact O-N 3.24Å; C282-N285 PolarHBondContact O-N 2.87Å; C282-G286 PolarHBondContact O-N 3.36Å |
| 283 | L | 87.4 | Confident | 89.9 | Confident | 47 Ų | 47 | 39.9 Ų | 39.9 | 25% | 0.246 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -65.7 | -45.9 | 177.9 | -178.1 | 62 | 0 | 0 | 0 | 111.6 | E229 A232 M279 G280 V281 N285 G286 V287 | E229-L283 HydrophobicContact CB-CD2 4.44Å; E229-L283 HydrophobicContact CG-CD2 4.24Å; A232-L283 HydrophobicContact CB-CD2 4.31Å; M279-L283 PolarHBondContact O-N 3.12Å; G280-L283 WeakPolarHBondContact O-CB 3.41Å; G280-L283 PolarHBondContact O-N 2.89Å; G280-L283 VanDerWaalsContact O-N 3.07Å; V281-L283 VanDerWaalsContact C-N 3.35Å; V281-L283 PolarHBondContact O-N 3.18Å; L283-N285 VanDerWaalsContact C-N 3.3Å; L283-N285 PolarHBondContact O-N 3.04Å; L283-G286 WeakPolarHBondContact O-CA 3.46Å; L283-G286 PolarHBondContact O-N 2.91Å; L283-G286 VanDerWaalsContact O-N 3.11Å; L283-V287 WeakPolarHBondContact O-CG2 3.15Å; L283-V287 PolarHBondContact O-N 3.45Å |
| 284 | I | 87.3 | Confident | 89.5 | Confident | 31 Ų | 31 | 39.2 Ų | 39.2 | 16% | 0.159 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -58.3 | -43.7 | 176 | -64.8 | 167 | 0 | 0 | 0 | 110.4 | M40 T44 E229 G280 V281 G286 V287 S288 | M40-I284 HydrophobicContact CE-CG2 4.19Å; T44-I284 HydrophobicContact CG2-CB 4.02Å; T44-I284 HydrophobicContact CG2-CG2 3.71Å; E229-I284 HydrophobicContact CG-CG1 4.26Å; G280-I284 WeakPolarHBondContact O-CG1 3.3Å; G280-I284 PolarHBondContact O-N 3.5Å; V281-I284 PolarHBondContact O-N 2.82Å; I284-G286 VanDerWaalsContact C-N 3.34Å; I284-G286 PolarHBondContact O-N 2.91Å; I284-V287 PolarHBondContact O-N 2.9Å; I284-S288 PolarHBondContact O-N 3.46Å |
| 285 | N | 90.9 | Very high | 89.3 | Confident | 52 Ų | 52 | 39.7 Ų | 39.7 | 28% | 0.278 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -65.1 | -37.8 | 176.7 | -167.6 | 48.7 | 0 | 0 | 0 | 112 | S41 T44 V281 C282 L283 S288 L289 | S41-N285 PolarHBondContact OG-OD1 3.24Å; T44-N285 HydrophobicContact CG2-CB 3.89Å; T44-N285 PolarHBondContact OG1-OD1 3.39Å; V281-N285 WeakPolarHBondContact O-CB 3.33Å; V281-N285 PolarHBondContact O-N 3.29Å; C282-N285 PolarHBondContact O-N 2.87Å; L283-N285 VanDerWaalsContact C-N 3.3Å; L283-N285 PolarHBondContact O-N 3.04Å; N285-S288 WeakPolarHBondContact O-CB 3.46Å; N285-S288 PolarHBondContact O-N 3.35Å; N285-L289 WeakPolarHBondContact O-CG 3.43Å; N285-L289 PolarHBondContact O-N 2.87Å |
| 286 | G | 88.2 | Confident | 89.2 | Confident | 39 Ų | 39 | 42 Ų | 42 | 40% | 0.402 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -61.4 | -44 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | C282 L283 I284 L289 S290 | C282-G286 PolarHBondContact O-N 3.36Å; L283-G286 WeakPolarHBondContact O-CA 3.46Å; L283-G286 PolarHBondContact O-N 2.91Å; L283-G286 VanDerWaalsContact O-N 3.11Å; I284-G286 VanDerWaalsContact C-N 3.34Å; I284-G286 PolarHBondContact O-N 2.91Å; G286-L289 PolarHBondContact O-N 3.41Å; G286-S290 PolarHBondContact O-N 2.95Å |
| 287 | V | 82.3 | Confident | 89.2 | Confident | 15 Ų | 15 | 43.5 Ų | 43.5 | 9% | 0.091 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -62.3 | -44.3 | 174.6 | 174.2 | 0 | 0 | 0 | 0 | 110.7 | L186 L283 I284 L289 S290 N291 | L186-V287 HydrophobicContact CD2-CG1 3.59Å; L283-V287 WeakPolarHBondContact O-CG2 3.15Å; L283-V287 PolarHBondContact O-N 3.45Å; I284-V287 PolarHBondContact O-N 2.9Å; V287-L289 PolarHBondContact O-N 3.28Å; V287-S290 WeakPolarHBondContact O-CB 3.33Å; V287-S290 PolarHBondContact O-N 3.18Å; V287-S290 VanDerWaalsContact O-N 3.15Å; V287-S290 PolarHBondContact O-OG 2.81Å; V287-N291 PolarHBondContact O-N 3.27Å |
| 288 | S | 87.3 | Confident | 89.2 | Confident | 0 Ų | 0 | 49.1 Ų | 49.1 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -53.8 | -52.8 | 172.9 | 178.4 | 0 | 0 | 0 | 0 | 111.5 | V37 M40 S41 I284 N285 S290 N291 | V37-S288 VanDerWaalsContact CG2-O 3.24Å; V37-S288 WeakPolarHBondContact CG2-O 3.46Å; V37-S288 PolarHBondContact O-OG 3.02Å; M40-S288 WeakPolarHBondContact CB-OG 3.37Å; S41-S288 PolarHBondContact OG-OG 3.49Å; I284-S288 PolarHBondContact O-N 3.46Å; N285-S288 WeakPolarHBondContact O-CB 3.46Å; N285-S288 PolarHBondContact O-N 3.35Å; S288-S290 VanDerWaalsContact C-N 3.26Å; S288-S290 PolarHBondContact O-N 3.44Å; S288-N291 WeakPolarHBondContact O-CB 3.26Å; S288-N291 PolarHBondContact O-N 3.4Å; S288-N291 VanDerWaalsContact O-N 3.09Å |
| 289 | L | 90.1 | Very high | 89.1 | Confident | 85 Ų | 85 | 50.7 Ų | 50.7 | 45% | 0.445 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -64.3 | -30.9 | 179.3 | -66.6 | -179.8 | 0 | 0 | 0 | 112.8 | N285 G286 V287 N291 L292 | N285-L289 WeakPolarHBondContact O-CG 3.43Å; N285-L289 PolarHBondContact O-N 2.87Å; G286-L289 PolarHBondContact O-N 3.41Å; V287-L289 PolarHBondContact O-N 3.28Å; L289-N291 PolarHBondContact O-N 2.9Å; L289-L292 HydrophobicContact CD2-CD1 3.89Å; L289-L292 VanDerWaalsContact O-CB 3.27Å; L289-L292 WeakPolarHBondContact O-CB 3.33Å; L289-L292 PolarHBondContact O-N 3.11Å; L289-L292 VanDerWaalsContact O-N 3.08Å |
| 290 | S | 84.9 | Confident | 89.2 | Confident | 40 Ų | 40 | 54.1 Ų | 54.1 | 28% | 0.28 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -62.5 | -30.4 | 175.8 | 82.6 | 0 | 0 | 0 | 0 | 112.5 | G286 V287 S288 L292 Q293 | G286-S290 PolarHBondContact O-N 2.95Å; V287-S290 WeakPolarHBondContact O-CB 3.33Å; V287-S290 PolarHBondContact O-N 3.18Å; V287-S290 VanDerWaalsContact O-N 3.15Å; V287-S290 PolarHBondContact O-OG 2.81Å; S288-S290 VanDerWaalsContact C-N 3.26Å; S288-S290 PolarHBondContact O-N 3.44Å; S290-L292 PolarHBondContact O-N 3.22Å; S290-Q293 VanDerWaalsContact O-CB 3.25Å; S290-Q293 WeakPolarHBondContact O-CB 3.24Å; S290-Q293 VanDerWaalsContact O-CG 3.3Å; S290-Q293 WeakPolarHBondContact O-CG 3.44Å; S290-Q293 PolarHBondContact O-N 3.18Å |
| 291 | N | 84.5 | Confident | 89.4 | Confident | 20 Ų | 20 | 55.6 Ų | 55.6 | 11% | 0.107 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -65.2 | -22.9 | 176.1 | -73 | -32.2 | 0 | 0 | 0 | 112.5 | V37 V287 S288 L289 Q293 T294 | V37-N291 HydrophobicContact CG2-CB 3.68Å; V287-N291 PolarHBondContact O-N 3.27Å; S288-N291 WeakPolarHBondContact O-CB 3.26Å; S288-N291 PolarHBondContact O-N 3.4Å; S288-N291 VanDerWaalsContact O-N 3.09Å; L289-N291 PolarHBondContact O-N 2.9Å; N291-Q293 PolarHBondContact O-N 3.25Å; N291-T294 PolarHBondContact O-N 3.43Å; N291-T294 PolarHBondContact O-OG1 3.34Å |
| 292 | L | 89.4 | Confident | 89.5 | Confident | 33 Ų | 33 | 54.4 Ų | 54.4 | 17% | 0.173 | 30% | 0.297 | C | S | . | . | G | 310 helix | trans | -64.2 | -21.5 | 173.4 | -64.5 | 174.9 | 0 | 0 | 0 | 113 | V37 L289 S290 T294 V295 M297 I306 | V37-L292 HydrophobicContact CB-CD2 4.01Å; V37-L292 HydrophobicContact CB-CG 4.42Å; V37-L292 HydrophobicContact CG1-CD1 4.15Å; V37-L292 HydrophobicContact CG1-CD2 3.78Å; V37-L292 HydrophobicContact CG1-CG 3.86Å; V37-L292 HydrophobicContact CG2-CD2 3.88Å; V37-L292 HydrophobicContact CG2-CG 4.06Å; L289-L292 HydrophobicContact CD2-CD1 3.89Å; L289-L292 VanDerWaalsContact O-CB 3.27Å; L289-L292 WeakPolarHBondContact O-CB 3.33Å; L289-L292 PolarHBondContact O-N 3.11Å; L289-L292 VanDerWaalsContact O-N 3.08Å; S290-L292 PolarHBondContact O-N 3.22Å; L292-T294 PolarHBondContact O-N 3Å; L292-T294 VanDerWaalsContact O-N 3.16Å; L292-V295 PolarHBondContact O-N 3.43Å; L292-M297 HydrophobicContact CD2-CE 4.45Å; L292-M297 HydrophobicContact CD2-SD 4.23Å; L292-I306 HydrophobicContact CD2-CD1 3.6Å |
| 293 | Q | 87.1 | Confident | 89.7 | Confident | 168 Ų | 168 | 54.8 Ų | 54.8 | 79% | 0.785 | 29% | 0.294 | S | S | * | . | G | 310 helix | trans | -62.8 | -21 | 176.1 | -63.3 | 178.8 | -9.3 | 0 | 0 | 112.7 | S290 N291 | S290-Q293 VanDerWaalsContact O-CB 3.25Å; S290-Q293 WeakPolarHBondContact O-CB 3.24Å; S290-Q293 VanDerWaalsContact O-CG 3.3Å; S290-Q293 WeakPolarHBondContact O-CG 3.44Å; S290-Q293 PolarHBondContact O-N 3.18Å; N291-Q293 PolarHBondContact O-N 3.25Å |
| 294 | T | 84.1 | Confident | 90 | Very high | 53 Ų | 53 | 56.2 Ų | 56.2 | 33% | 0.325 | 31% | 0.305 | S | S | . | . | G | 310 helix | trans | -85.3 | -15.3 | 175.9 | 66.2 | 0 | 0 | 0 | 0 | 112.8 | P33 N291 L292 G367 | P33-T294 VanDerWaalsContact CG-OG1 3.3Å; P33-T294 WeakPolarHBondContact CG-OG1 3.3Å; N291-T294 PolarHBondContact O-N 3.43Å; N291-T294 PolarHBondContact O-OG1 3.34Å; L292-T294 PolarHBondContact O-N 3Å; L292-T294 VanDerWaalsContact O-N 3.16Å; T294-G367 WeakPolarHBondContact O-CA 3.23Å |
| 295 | V | 90.9 | Very high | 90.5 | Very high | 11 Ų | 11 | 55 Ų | 55 | 7% | 0.067 | 30% | 0.299 | C | S | . | . | S | Bend | trans | -94.6 | 139.5 | -175.3 | -178.3 | 0 | 0 | 0 | 0 | 110.1 | P33 V34 L292 M297 N302 | P33-V295 HydrophobicContact CB-CG2 3.62Å; V34-V295 HydrophobicContact CG2-CG1 3.67Å; V34-V295 HydrophobicContact CG2-CG2 3.99Å; L292-V295 PolarHBondContact O-N 3.43Å; V295-M297 HydrophobicContact CB-SD 4.31Å; V295-M297 HydrophobicContact CG1-SD 4Å; V295-M297 PolarHBondContact O-N 3.46Å; V295-N302 HydrophobicContact CG1-CB 4Å |
| 296 | D | 92.6 | Very high | 90.7 | Very high | 48 Ų | 48 | 53.2 Ų | 53.2 | 26% | 0.257 | 29% | 0.289 | S | S | . | . | trans | -74.1 | 96.6 | 170 | -171.7 | -4.9 | 0 | 0 | 0 | 110 | K298 L299 N302 Q365 | D296-K298 PolarHBondContact O-N 3.14Å; D296-K298 VanDerWaalsContact OD1-CB 3.27Å; D296-K298 WeakPolarHBondContact OD1-CB 3.46Å; D296-K298 PolarHBondContact OD1-N 3.33Å; D296-L299 HydrophobicContact CB-CD1 4.44Å; D296-N302 PolarHBondContact O-ND2 3.42Å; D296-Q365 HydrophobicContact CB-CB 3.95Å; D296-Q365 HydrophobicContact CB-CG 4.04Å; D296-Q365 PolarHBondContact N-O 3.29Å | ||
| 297 | M | 92.9 | Very high | 91.1 | Very high | 76 Ų | 76 | 53 Ų | 53 | 37% | 0.374 | 29% | 0.286 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80 | 5.5 | 178 | -63.7 | -60.7 | -78.1 | 0 | 0 | 113.1 | L292 V295 L303 I306 | L292-M297 HydrophobicContact CD2-CE 4.45Å; L292-M297 HydrophobicContact CD2-SD 4.23Å; V295-M297 HydrophobicContact CB-SD 4.31Å; V295-M297 HydrophobicContact CG1-SD 4Å; V295-M297 PolarHBondContact O-N 3.46Å; M297-L303 VanDerWaalsContact CA-CD1 3.49Å; M297-L303 HydrophobicContact CB-CD1 3.83Å; M297-L303 HydrophobicContact CE-CD1 3.56Å; M297-L303 HydrophobicContact CE-CG 3.92Å; M297-L303 HydrophobicContact CG-CD1 4.4Å; M297-L303 WeakPolarHBondContact O-CD1 3.5Å; M297-L303 HydrophobicContact SD-CD1 3.76Å; M297-I306 HydrophobicContact CE-CD1 4.31Å; M297-I306 HydrophobicContact SD-CD1 4.06Å |
| 298 | K | 92.3 | Very high | 91.8 | Very high | 193 Ų | 193 | 55 Ų | 55 | 84% | 0.839 | 30% | 0.299 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81 | -23.8 | 169.3 | -60.2 | 178.2 | -179 | 176.2 | 0 | 111.6 | D296 S300 | D296-K298 PolarHBondContact O-N 3.14Å; D296-K298 VanDerWaalsContact OD1-CB 3.27Å; D296-K298 WeakPolarHBondContact OD1-CB 3.46Å; D296-K298 PolarHBondContact OD1-N 3.33Å; K298-S300 PolarHBondContact O-N 3.05Å |
| 299 | L | 93 | Very high | 92.3 | Very high | 41 Ų | 41 | 55 Ų | 55 | 22% | 0.215 | 30% | 0.299 | C | S | . | . | trans | -76.3 | 114.8 | 177.8 | -65.3 | 178.6 | 0 | 0 | 0 | 110.3 | D296 R301 N302 L303 A361 Q365 | D296-L299 HydrophobicContact CB-CD1 4.44Å; L299-R301 PolarHBondContact O-N 2.85Å; L299-R301 VanDerWaalsContact O-N 3.1Å; L299-N302 PolarHBondContact O-N 3.47Å; L299-L303 PolarHBondContact O-N 3.41Å; L299-A361 HydrophobicContact CD1-CB 3.81Å; L299-Q365 HydrophobicContact CD1-CB 3.76Å; L299-Q365 HydrophobicContact CD1-CG 4.09Å | ||
| 300 | S | 94.1 | Very high | 92.6 | Very high | 85 Ų | 85 | 52.6 Ų | 52.6 | 59% | 0.594 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -54.4 | -32.3 | 174.4 | -175.6 | 0 | 0 | 0 | 0 | 112.1 | K298 N302 L303 T304 | K298-S300 PolarHBondContact O-N 3.05Å; S300-N302 PolarHBondContact O-N 2.9Å; S300-L303 PolarHBondContact O-N 3.29Å; S300-T304 WeakPolarHBondContact O-CB 3.43Å; S300-T304 PolarHBondContact O-N 3.22Å; S300-T304 PolarHBondContact O-OG1 2.98Å |
| 301 | R | 94.4 | Very high | 93.2 | Very high | 37 Ų | 37 | 55.6 Ų | 55.6 | 14% | 0.14 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -50.1 | -56.8 | 172.7 | 174.7 | -167.3 | 175.4 | -91.1 | 1 | 111.9 | L299 L303 T304 I305 D355 T358 G359 | L299-R301 PolarHBondContact O-N 2.85Å; L299-R301 VanDerWaalsContact O-N 3.1Å; R301-L303 PolarHBondContact O-N 3.19Å; R301-T304 PolarHBondContact O-N 3.07Å; R301-I305 HydrophobicContact CG-CD1 3.79Å; R301-I305 VanDerWaalsContact O-CG1 3.22Å; R301-I305 WeakPolarHBondContact O-CG1 3.46Å; R301-I305 PolarHBondContact O-N 3.15Å; R301-D355 IonicContact CZ-OD1 3.85Å; R301-D355 IonicContact NH1-OD1 3.08Å; R301-D355 PolarHBondContact NH1-OD1 2.8Å; R301-D355 VanDerWaalsContact NH1-OD1 3.08Å; R301-D355 PolarHBondContact NH2-O 3.26Å; R301-D355 IonicContact NH2-OD1 3.99Å; R301-D355 PolarHBondContact NH2-OD1 3.3Å; R301-T358 PolarHBondContact NE-O 2.95Å; R301-T358 PolarHBondContact NE-OG1 3.21Å; R301-T358 VanDerWaalsContact NE-OG1 3.08Å; R301-T358 PolarHBondContact NH2-O 3.32Å; R301-T358 PolarHBondContact NH2-OG1 3.27Å; R301-G359 VanDerWaalsContact CD-O 3.31Å; R301-G359 WeakPolarHBondContact CD-O 3.44Å; R301-G359 PolarHBondContact NE-O 3.17Å |
| 302 | N | 94.8 | Very high | 93.8 | Very high | 0 Ų | 0 | 58.6 Ų | 58.6 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -65.4 | -42.8 | -174.3 | -67.9 | -13 | 0 | 0 | 0 | 110.8 | V295 D296 L299 S300 T304 I305 I306 Q365 | V295-N302 HydrophobicContact CG1-CB 4Å; D296-N302 PolarHBondContact O-ND2 3.42Å; L299-N302 PolarHBondContact O-N 3.47Å; S300-N302 PolarHBondContact O-N 2.9Å; N302-T304 PolarHBondContact O-N 2.86Å; N302-I305 PolarHBondContact O-N 3.47Å; N302-I306 WeakPolarHBondContact O-CD1 3.49Å; N302-I306 WeakPolarHBondContact O-CG1 3.39Å; N302-I306 PolarHBondContact O-N 2.91Å; N302-Q365 PolarHBondContact ND2-O 3.15Å |
| 303 | L | 94.6 | Very high | 94.1 | Very high | 76 Ų | 76 | 57 Ų | 57 | 40% | 0.398 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -59.2 | -48.7 | 176.6 | -91.8 | 65.9 | 0 | 0 | 0 | 111.7 | M297 L299 S300 R301 I306 G307 | M297-L303 VanDerWaalsContact CA-CD1 3.49Å; M297-L303 HydrophobicContact CB-CD1 3.83Å; M297-L303 HydrophobicContact CE-CD1 3.56Å; M297-L303 HydrophobicContact CE-CG 3.92Å; M297-L303 HydrophobicContact CG-CD1 4.4Å; M297-L303 WeakPolarHBondContact O-CD1 3.5Å; M297-L303 HydrophobicContact SD-CD1 3.76Å; L299-L303 PolarHBondContact O-N 3.41Å; S300-L303 PolarHBondContact O-N 3.29Å; R301-L303 PolarHBondContact O-N 3.19Å; L303-I306 PolarHBondContact O-N 3.34Å; L303-G307 PolarHBondContact O-N 3.43Å |
| 304 | T | 95.5 | Very high | 94.4 | Very high | 77 Ų | 77 | 50.9 Ų | 50.9 | 47% | 0.472 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -64.2 | -41.8 | -179 | -59.9 | 0 | 0 | 0 | 0 | 111.2 | S300 R301 N302 G307 V308 | S300-T304 WeakPolarHBondContact O-CB 3.43Å; S300-T304 PolarHBondContact O-N 3.22Å; S300-T304 PolarHBondContact O-OG1 2.98Å; R301-T304 PolarHBondContact O-N 3.07Å; N302-T304 PolarHBondContact O-N 2.86Å; T304-G307 PolarHBondContact O-N 3.29Å; T304-V308 HydrophobicContact CG2-CG2 3.98Å; T304-V308 VanDerWaalsContact O-CB 3.26Å; T304-V308 WeakPolarHBondContact O-CB 3.4Å; T304-V308 WeakPolarHBondContact O-CG2 3.46Å; T304-V308 PolarHBondContact O-N 3.16Å |
| 305 | I | 96.5 | Very high | 95 | Very high | 7 Ų | 7 | 52.1 Ų | 52.1 | 4% | 0.036 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -61.6 | -49.2 | 178.1 | -67.2 | 167.2 | 0 | 0 | 0 | 110.7 | V34 R301 N302 S309 L354 D355 T358 | V34-I305 HydrophobicContact CG1-CB 4.31Å; V34-I305 HydrophobicContact CG1-CG2 3.82Å; R301-I305 HydrophobicContact CG-CD1 3.79Å; R301-I305 VanDerWaalsContact O-CG1 3.22Å; R301-I305 WeakPolarHBondContact O-CG1 3.46Å; R301-I305 PolarHBondContact O-N 3.15Å; N302-I305 PolarHBondContact O-N 3.47Å; I305-S309 VanDerWaalsContact O-CB 3.26Å; I305-S309 WeakPolarHBondContact O-CB 3.43Å; I305-S309 PolarHBondContact O-N 3.36Å; I305-S309 PolarHBondContact O-OG 3.46Å; I305-L354 HydrophobicContact CD1-CB 4.44Å; I305-L354 HydrophobicContact CG1-CB 4.04Å; I305-L354 HydrophobicContact CG2-CB 4.02Å; I305-D355 HydrophobicContact CG2-CB 4.48Å; I305-T358 WeakPolarHBondContact CD1-OG1 3.42Å |
| 306 | I | 96.3 | Very high | 95.2 | Very high | 13 Ų | 13 | 53.1 Ų | 53.1 | 7% | 0.067 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -60.6 | -49.9 | 179.7 | -68.8 | 161.9 | 0 | 0 | 0 | 110.2 | V34 P38 L292 M297 N302 L303 S309 I310 | V34-I306 HydrophobicContact CG1-CG1 4.21Å; P38-I306 HydrophobicContact CG-CB 4.38Å; P38-I306 HydrophobicContact CG-CG1 4.27Å; P38-I306 HydrophobicContact CG-CG2 4.22Å; L292-I306 HydrophobicContact CD2-CD1 3.6Å; M297-I306 HydrophobicContact CE-CD1 4.31Å; M297-I306 HydrophobicContact SD-CD1 4.06Å; N302-I306 WeakPolarHBondContact O-CD1 3.49Å; N302-I306 WeakPolarHBondContact O-CG1 3.39Å; N302-I306 PolarHBondContact O-N 2.91Å; L303-I306 PolarHBondContact O-N 3.34Å; I306-S309 PolarHBondContact O-N 3.4Å; I306-I310 HydrophobicContact CG2-CD1 3.93Å; I306-I310 WeakPolarHBondContact O-CG1 3.4Å; I306-I310 PolarHBondContact O-N 3.11Å; I306-I310 VanDerWaalsContact O-N 3.09Å |
| 307 | G | 96.1 | Very high | 95.2 | Very high | 34 Ų | 34 | 50.8 Ų | 50.8 | 35% | 0.351 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -61.9 | -48 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | L303 T304 S309 I310 I311 | L303-G307 PolarHBondContact O-N 3.43Å; T304-G307 PolarHBondContact O-N 3.29Å; G307-S309 VanDerWaalsContact C-N 3.31Å; G307-S309 PolarHBondContact O-N 3.29Å; G307-I310 PolarHBondContact O-N 2.95Å; G307-I311 WeakPolarHBondContact O-CG1 3.44Å; G307-I311 PolarHBondContact O-N 3.47Å |
| 308 | V | 97.2 | Very high | 95.2 | Very high | 58 Ų | 58 | 49.4 Ų | 49.4 | 35% | 0.352 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -60.7 | -43.1 | 177.7 | 169.6 | 0 | 0 | 0 | 0 | 110.6 | T304 I310 M312 I350 L354 | T304-V308 HydrophobicContact CG2-CG2 3.98Å; T304-V308 VanDerWaalsContact O-CB 3.26Å; T304-V308 WeakPolarHBondContact O-CB 3.4Å; T304-V308 WeakPolarHBondContact O-CG2 3.46Å; T304-V308 PolarHBondContact O-N 3.16Å; V308-I310 PolarHBondContact O-N 2.96Å; V308-M312 HydrophobicContact CG1-CG 4.01Å; V308-M312 WeakPolarHBondContact O-CB 3.42Å; V308-M312 VanDerWaalsContact O-CG 3.28Å; V308-M312 WeakPolarHBondContact O-CG 3.37Å; V308-M312 PolarHBondContact O-N 2.92Å; V308-I350 HydrophobicContact CG1-CG2 4.2Å; V308-L354 HydrophobicContact CG1-CD1 4.18Å |
| 309 | S | 97.1 | Very high | 95.3 | Very high | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -64 | -43.1 | -178 | -57.3 | 0 | 0 | 0 | 0 | 112.4 | I305 I306 G307 G313 G347 A351 | I305-S309 VanDerWaalsContact O-CB 3.26Å; I305-S309 WeakPolarHBondContact O-CB 3.43Å; I305-S309 PolarHBondContact O-N 3.36Å; I305-S309 PolarHBondContact O-OG 3.46Å; I306-S309 PolarHBondContact O-N 3.4Å; G307-S309 VanDerWaalsContact C-N 3.31Å; G307-S309 PolarHBondContact O-N 3.29Å; S309-G313 PolarHBondContact O-N 3.29Å; S309-G347 VanDerWaalsContact O-CA 3.31Å; S309-G347 WeakPolarHBondContact O-CA 3.4Å; S309-A351 WeakPolarHBondContact OG-CA 3.32Å; S309-A351 VanDerWaalsContact OG-CB 3.3Å; S309-A351 WeakPolarHBondContact OG-CB 3.46Å; S309-A351 PolarHBondContact OG-N 2.98Å |
| 310 | I | 96.7 | Very high | 95.3 | Very high | 34 Ų | 34 | 45.2 Ų | 45.2 | 17% | 0.174 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -67 | -52.2 | 177.4 | -65.5 | 170.3 | 0 | 0 | 0 | 110.4 | P38 L42 I306 G307 V308 M312 G313 L314 | P38-I310 HydrophobicContact CB-CG1 3.95Å; L42-I310 HydrophobicContact CD2-CG2 4.47Å; I306-I310 HydrophobicContact CG2-CD1 3.93Å; I306-I310 WeakPolarHBondContact O-CG1 3.4Å; I306-I310 PolarHBondContact O-N 3.11Å; I306-I310 VanDerWaalsContact O-N 3.09Å; G307-I310 PolarHBondContact O-N 2.95Å; V308-I310 PolarHBondContact O-N 2.96Å; I310-M312 PolarHBondContact O-N 3.49Å; I310-G313 PolarHBondContact O-N 3Å; I310-L314 HydrophobicContact CG2-CD1 4.35Å; I310-L314 WeakPolarHBondContact O-CG 3.46Å; I310-L314 PolarHBondContact O-N 3.35Å; I310-L314 VanDerWaalsContact O-N 3.09Å |
| 311 | I | 97.2 | Very high | 95.2 | Very high | 103 Ų | 103 | 45.3 Ų | 45.3 | 53% | 0.528 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -66.7 | -43 | -175.2 | -63 | -59.8 | 0 | 0 | 0 | 111.5 | G307 L314 T315 | G307-I311 WeakPolarHBondContact O-CG1 3.44Å; G307-I311 PolarHBondContact O-N 3.47Å; I311-L314 PolarHBondContact O-N 2.83Å; I311-T315 VanDerWaalsContact O-CB 3.27Å; I311-T315 WeakPolarHBondContact O-CB 3.19Å; I311-T315 PolarHBondContact O-N 3.28Å; I311-T315 PolarHBondContact O-OG1 2.85Å |
| 312 | M | 96.9 | Very high | 95.1 | Very high | 83 Ų | 83 | 51.4 Ų | 51.4 | 41% | 0.409 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -68.7 | -38.9 | 177.3 | -69.7 | -60.1 | -64.8 | 0 | 0 | 112 | V308 I310 L314 T315 V316 I350 | V308-M312 HydrophobicContact CG1-CG 4.01Å; V308-M312 WeakPolarHBondContact O-CB 3.42Å; V308-M312 VanDerWaalsContact O-CG 3.28Å; V308-M312 WeakPolarHBondContact O-CG 3.37Å; V308-M312 PolarHBondContact O-N 2.92Å; I310-M312 PolarHBondContact O-N 3.49Å; M312-L314 VanDerWaalsContact C-N 3.29Å; M312-L314 PolarHBondContact O-N 2.82Å; M312-T315 PolarHBondContact O-N 3.47Å; M312-V316 HydrophobicContact CE-CG2 3.85Å; M312-V316 VanDerWaalsContact O-CB 3.31Å; M312-V316 WeakPolarHBondContact O-CB 3.21Å; M312-V316 VanDerWaalsContact O-CG2 3.24Å; M312-V316 WeakPolarHBondContact O-CG2 3.43Å; M312-V316 PolarHBondContact O-N 3.21Å; M312-I350 HydrophobicContact CB-CD1 3.55Å; M312-I350 HydrophobicContact CG-CD1 4.44Å |
| 313 | G | 95.4 | Very high | 94.9 | Very high | 0 Ų | 0 | 55.1 Ų | 55.1 | 0% | 0 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -56.3 | -43.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | S309 I310 A317 | S309-G313 PolarHBondContact O-N 3.29Å; I310-G313 PolarHBondContact O-N 3Å; G313-A317 WeakPolarHBondContact O-CB 3.38Å; G313-A317 PolarHBondContact O-N 2.63Å |
| 314 | L | 94.9 | Very high | 94.6 | Very high | 39 Ų | 39 | 56.2 Ų | 56.2 | 20% | 0.204 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -72 | -47.6 | 175.7 | -65.9 | 174.9 | 0 | 0 | 0 | 112.5 | L42 I45 I310 I311 M312 A317 T318 R343 | L42-L314 HydrophobicContact CD2-CD1 4.48Å; L42-L314 HydrophobicContact CD2-CD2 3.58Å; L42-L314 HydrophobicContact CD2-CG 3.55Å; I45-L314 HydrophobicContact CB-CD2 4.2Å; I45-L314 HydrophobicContact CD1-CD1 4.16Å; I45-L314 HydrophobicContact CG2-CD1 4.16Å; I45-L314 HydrophobicContact CG2-CD2 3.53Å; I45-L314 HydrophobicContact CG2-CG 4.49Å; I310-L314 HydrophobicContact CG2-CD1 4.35Å; I310-L314 WeakPolarHBondContact O-CG 3.46Å; I310-L314 PolarHBondContact O-N 3.35Å; I310-L314 VanDerWaalsContact O-N 3.09Å; I311-L314 PolarHBondContact O-N 2.83Å; M312-L314 VanDerWaalsContact C-N 3.29Å; M312-L314 PolarHBondContact O-N 2.82Å; L314-A317 PolarHBondContact O-N 3.28Å; L314-T318 VanDerWaalsContact O-CB 3.3Å; L314-T318 WeakPolarHBondContact O-CB 3.38Å; L314-T318 PolarHBondContact O-N 3.34Å; L314-T318 PolarHBondContact O-OG1 2.91Å; L314-R343 HydrophobicContact CD2-CG 4.3Å |
| 315 | T | 95.3 | Very high | 94.3 | Very high | 79 Ų | 79 | 54.9 Ų | 54.9 | 49% | 0.485 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -65.5 | -45.9 | -171.4 | -57.7 | 0 | 0 | 0 | 0 | 111.3 | I311 M312 H319 | I311-T315 VanDerWaalsContact O-CB 3.27Å; I311-T315 WeakPolarHBondContact O-CB 3.19Å; I311-T315 PolarHBondContact O-N 3.28Å; I311-T315 PolarHBondContact O-OG1 2.85Å; M312-T315 PolarHBondContact O-N 3.47Å; T315-H319 WeakPolarHBondContact O-CB 3.48Å; T315-H319 PolarHBondContact O-N 2.93Å |
| 316 | V | 94.9 | Very high | 94 | Very high | 32 Ų | 32 | 61.3 Ų | 61.3 | 19% | 0.194 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -65.1 | -48 | -179.9 | 175.4 | 0 | 0 | 0 | 0 | 110.2 | M312 T318 H319 F320 I346 | M312-V316 HydrophobicContact CE-CG2 3.85Å; M312-V316 VanDerWaalsContact O-CB 3.31Å; M312-V316 WeakPolarHBondContact O-CB 3.21Å; M312-V316 VanDerWaalsContact O-CG2 3.24Å; M312-V316 WeakPolarHBondContact O-CG2 3.43Å; M312-V316 PolarHBondContact O-N 3.21Å; V316-T318 PolarHBondContact O-N 3.21Å; V316-H319 WeakPolarHBondContact O-CB 3.42Å; V316-H319 PolarHBondContact O-N 3.46Å; V316-F320 HydrophobicContact CG1-CD2 3.78Å; V316-F320 HydrophobicContact CG1-CE2 3.77Å; V316-F320 VanDerWaalsContact O-CD2 3.25Å; V316-F320 WeakPolarHBondContact O-CD2 3.49Å; V316-F320 PolarHBondContact O-N 3.5Å; V316-F320 VanDerWaalsContact O-N 3.09Å; V316-I346 HydrophobicContact CB-CD1 3.99Å; V316-I346 HydrophobicContact CB-CG2 4.12Å; V316-I346 HydrophobicContact CG1-CD1 3.59Å; V316-I346 HydrophobicContact CG1-CG1 4.43Å; V316-I346 HydrophobicContact CG1-CG2 4.29Å; V316-I346 HydrophobicContact CG2-CG2 4.42Å |
| 317 | A | 93.5 | Very high | 93.6 | Very high | 0 Ų | 0 | 64.8 Ų | 64.8 | 0% | 0 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -59.9 | -47.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | G313 L314 H319 F320 E321 L340 R343 I346 | G313-A317 WeakPolarHBondContact O-CB 3.38Å; G313-A317 PolarHBondContact O-N 2.63Å; L314-A317 PolarHBondContact O-N 3.28Å; A317-H319 PolarHBondContact O-N 2.87Å; A317-F320 PolarHBondContact O-N 3.02Å; A317-E321 WeakPolarHBondContact O-CG 3.37Å; A317-E321 PolarHBondContact O-N 3.43Å; A317-L340 VanDerWaalsContact CA-O 3.24Å; A317-L340 WeakPolarHBondContact CA-O 3.39Å; A317-R343 HydrophobicContact CB-CB 4.25Å; A317-R343 HydrophobicContact CB-CG 3.37Å; A317-I346 HydrophobicContact CB-CD1 4.18Å |
| 318 | T | 93.4 | Very high | 93.2 | Very high | 46 Ų | 46 | 66.4 Ų | 66.4 | 28% | 0.282 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -62.9 | -32.9 | 178.3 | -51.3 | 0 | 0 | 0 | 0 | 112 | L314 V316 K322 | L314-T318 VanDerWaalsContact O-CB 3.3Å; L314-T318 WeakPolarHBondContact O-CB 3.38Å; L314-T318 PolarHBondContact O-N 3.34Å; L314-T318 PolarHBondContact O-OG1 2.91Å; V316-T318 PolarHBondContact O-N 3.21Å; T318-K322 HydrophobicContact CG2-CD 4.45Å; T318-K322 WeakPolarHBondContact O-CG 3.46Å; T318-K322 PolarHBondContact O-N 3.38Å |
| 319 | H | 94.3 | Very high | 92.9 | Very high | 102 Ų | 102 | 67.4 Ų | 67.4 | 47% | 0.472 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -64.5 | -48.9 | 174.7 | 176.8 | 73.4 | 0 | 0 | 0 | 111.3 | T315 V316 A317 E321 K322 T323 | T315-H319 WeakPolarHBondContact O-CB 3.48Å; T315-H319 PolarHBondContact O-N 2.93Å; V316-H319 WeakPolarHBondContact O-CB 3.42Å; V316-H319 PolarHBondContact O-N 3.46Å; A317-H319 PolarHBondContact O-N 2.87Å; H319-E321 VanDerWaalsContact C-N 3.33Å; H319-E321 PolarHBondContact O-N 3.49Å; H319-K322 PolarHBondContact O-N 3.43Å; H319-T323 PolarHBondContact O-N 3.34Å |
| 320 | F | 92.9 | Very high | 92.5 | Very high | 44 Ų | 44 | 74.4 Ų | 74.4 | 19% | 0.193 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -73.7 | -21.4 | -178.9 | -75 | -68.6 | 0 | 0 | 0 | 113.9 | V316 A317 L325 L340 T341 | V316-F320 HydrophobicContact CG1-CD2 3.78Å; V316-F320 HydrophobicContact CG1-CE2 3.77Å; V316-F320 VanDerWaalsContact O-CD2 3.25Å; V316-F320 WeakPolarHBondContact O-CD2 3.49Å; V316-F320 PolarHBondContact O-N 3.5Å; V316-F320 VanDerWaalsContact O-N 3.09Å; A317-F320 PolarHBondContact O-N 3.02Å; F320-L325 HydrophobicContact CD1-CD2 4.3Å; F320-L325 HydrophobicContact CD1-CG 3.88Å; F320-L325 HydrophobicContact CE1-CD1 4.35Å; F320-L325 HydrophobicContact CE1-CD2 3.61Å; F320-L325 HydrophobicContact CE1-CG 3.69Å; F320-L325 HydrophobicContact CZ-CD2 4.48Å; F320-L340 HydrophobicContact CB-CB 4.11Å; F320-L340 HydrophobicContact CD1-CD1 4.15Å; F320-L340 HydrophobicContact CD2-CB 3.65Å; F320-L340 HydrophobicContact CD2-CD1 3.96Å; F320-L340 HydrophobicContact CD2-CD2 4.47Å; F320-L340 HydrophobicContact CD2-CG 4.24Å; F320-L340 HydrophobicContact CE1-CD1 3.93Å; F320-L340 HydrophobicContact CE2-CB 4.21Å; F320-L340 HydrophobicContact CE2-CD1 3.72Å; F320-L340 HydrophobicContact CE2-CD2 4.27Å; F320-L340 HydrophobicContact CE2-CG 4.3Å; F320-L340 HydrophobicContact CG-CB 3.83Å; F320-L340 HydrophobicContact CG-CD1 4.17Å; F320-L340 HydrophobicContact CZ-CD1 3.71Å; F320-T341 HydrophobicContact CB-CG2 4.41Å |
| 321 | E | 90.6 | Very high | 92.2 | Very high | 87 Ų | 87 | 77.8 Ų | 77.8 | 41% | 0.407 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -66.7 | -39.6 | 166.8 | -75.1 | 173.5 | 165.2 | 0 | 0 | 112 | A317 H319 T341 R343 | A317-E321 WeakPolarHBondContact O-CG 3.37Å; A317-E321 PolarHBondContact O-N 3.43Å; H319-E321 VanDerWaalsContact C-N 3.33Å; H319-E321 PolarHBondContact O-N 3.49Å; E321-T341 HydrophobicContact CG-CG2 3.88Å; E321-R343 IonicContact OE1-CZ 2.88Å; E321-R343 IonicContact OE1-NH1 3.46Å; E321-R343 IonicContact OE1-NH2 2.93Å; E321-R343 PolarHBondContact OE1-NH2 3.09Å; E321-R343 IonicContact OE2-CZ 3.77Å; E321-R343 IonicContact OE2-NH2 2.87Å; E321-R343 PolarHBondContact OE2-NH2 3.47Å |
| 322 | K | 92.3 | Very high | 91.8 | Very high | 165 Ų | 165 | 75.3 Ų | 75.3 | 72% | 0.717 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -84.1 | -35.3 | -178.3 | -69.8 | 177.9 | -178.3 | 179.8 | 0 | 113.1 | T318 H319 | T318-K322 HydrophobicContact CG2-CD 4.45Å; T318-K322 WeakPolarHBondContact O-CG 3.46Å; T318-K322 PolarHBondContact O-N 3.38Å; H319-K322 PolarHBondContact O-N 3.43Å |
| 323 | T | 92.1 | Very high | 91.5 | Very high | 79 Ų | 79 | 72.3 Ų | 72.3 | 49% | 0.485 | 40% | 0.4 | S | S | . | . | S | Bend | trans | -124.8 | 88.5 | -178.4 | -48.4 | 0 | 0 | 0 | 0 | 108.3 | H319 | H319-T323 PolarHBondContact O-N 3.34Š|
| 324 | P | 88.4 | Confident | 91.2 | Very high | 98 Ų | 98 | 75.7 Ų | 75.7 | 64% | 0.636 | 42% | 0.418 | S | S | * | . | trans | -57.9 | 147.9 | 178 | -24 | 33.9 | 0 | 0 | 0 | 111.6 | N326 | P324-N326 PolarHBondContact O-N 2.72Š| ||
| 325 | L | 89.4 | Confident | 91 | Very high | 49 Ų | 49 | 74.7 Ų | 74.7 | 26% | 0.257 | 41% | 0.413 | S | S | . | . | trans | -61.2 | 136.3 | 173.3 | -83 | 170.7 | 0 | 0 | 0 | 110.7 | F320 F336 L340 | F320-L325 HydrophobicContact CD1-CD2 4.3Å; F320-L325 HydrophobicContact CD1-CG 3.88Å; F320-L325 HydrophobicContact CE1-CD1 4.35Å; F320-L325 HydrophobicContact CE1-CD2 3.61Å; F320-L325 HydrophobicContact CE1-CG 3.69Å; F320-L325 HydrophobicContact CZ-CD2 4.48Å; L325-F336 HydrophobicContact CD1-CB 3.53Å; L325-L340 HydrophobicContact CD1-CD1 3.62Å; L325-L340 HydrophobicContact CG-CD1 4.44Å | ||
| 326 | N | 88.8 | Confident | 90.9 | Very high | 143 Ų | 143 | 76.1 Ų | 76.1 | 77% | 0.765 | 41% | 0.413 | S | S | * | . | trans | -137.8 | 83.5 | 173.2 | -174.3 | 2 | 0 | 0 | 0 | 109 | P324 | P324-N326 PolarHBondContact O-N 2.72Š| ||
| 327 | T | 87.9 | Confident | 90.7 | Very high | 85 Ų | 85 | 75.4 Ų | 75.4 | 52% | 0.521 | 41% | 0.412 | S | S | . | . | S | Bend | trans | -91.1 | -6.1 | 177.1 | 61.9 | 0 | 0 | 0 | 0 | 112.2 | N329 V332 D333 | T327-N329 VanDerWaalsContact C-N 3.31Å; T327-V332 HydrophobicContact CG2-CG1 4.48Å; T327-D333 VanDerWaalsContact CB-OD1 3.29Å; T327-D333 WeakPolarHBondContact CB-OD1 3.5Å; T327-D333 WeakPolarHBondContact CG2-OD1 3.36Å; T327-D333 PolarHBondContact N-OD1 3.42Å; T327-D333 PolarHBondContact N-OD2 2.96Å; T327-D333 VanDerWaalsContact N-OD2 3.1Å; T327-D333 PolarHBondContact OG1-OD1 2.97Å |
| 328 | G | 87.6 | Confident | 90.5 | Very high | 69 Ų | 69 | 77.6 Ų | 77.6 | 71% | 0.711 | 43% | 0.425 | S | S | * | . | S | Bend | trans | 86.4 | -2.8 | -175.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 329 | N | 91.4 | Very high | 90.4 | Very high | 79 Ų | 79 | 77.2 Ų | 77.2 | 42% | 0.422 | 42% | 0.421 | S | S | . | . | trans | -117 | 110 | 172 | -176.6 | -21.3 | 0 | 0 | 0 | 110.1 | T327 I331 V332 D333 | T327-N329 VanDerWaalsContact C-N 3.31Å; N329-I331 PolarHBondContact O-N 3.35Å; N329-I331 VanDerWaalsContact O-N 3.16Å; N329-I331 PolarHBondContact OD1-N 3.19Å; N329-V332 HydrophobicContact CB-CB 4.15Å; N329-V332 HydrophobicContact CB-CG2 4.01Å; N329-V332 PolarHBondContact O-N 3.44Å; N329-D333 PolarHBondContact O-N 3.31Å | ||
| 330 | Q | 89.3 | Confident | 90.4 | Very high | 147 Ų | 147 | 74.4 Ų | 74.4 | 69% | 0.687 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -55.7 | -36.2 | -176.7 | -169.3 | 173.4 | 6.2 | 0 | 0 | 113.4 | D333 D334 | Q330-D333 PolarHBondContact O-N 2.89Å; Q330-D334 VanDerWaalsContact O-CB 3.3Å; Q330-D334 WeakPolarHBondContact O-CB 3.47Å; Q330-D334 PolarHBondContact O-N 2.9Å |
| 331 | I | 89.1 | Confident | 90.3 | Very high | 104 Ų | 104 | 74.5 Ų | 74.5 | 53% | 0.533 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -68.5 | -41.3 | -179.8 | -59.9 | 174.4 | 0 | 0 | 0 | 110.8 | L163 N329 V335 | L163-I331 HydrophobicContact CD2-CG2 3.54Å; N329-I331 PolarHBondContact O-N 3.35Å; N329-I331 VanDerWaalsContact O-N 3.16Å; N329-I331 PolarHBondContact OD1-N 3.19Å; I331-V335 HydrophobicContact CG2-CG2 4.5Å; I331-V335 WeakPolarHBondContact O-CB 3.3Å; I331-V335 VanDerWaalsContact O-CG2 3.24Å; I331-V335 WeakPolarHBondContact O-CG2 3.31Å; I331-V335 PolarHBondContact O-N 2.84Å |
| 332 | V | 89.8 | Confident | 90.4 | Very high | 51 Ų | 51 | 72 Ų | 72 | 31% | 0.309 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -68.1 | -45.1 | 179.1 | 175.7 | 0 | 0 | 0 | 0 | 109.4 | T327 N329 D334 V335 F336 | T327-V332 HydrophobicContact CG2-CG1 4.48Å; N329-V332 HydrophobicContact CB-CB 4.15Å; N329-V332 HydrophobicContact CB-CG2 4.01Å; N329-V332 PolarHBondContact O-N 3.44Å; V332-D334 PolarHBondContact O-N 3.01Å; V332-V335 PolarHBondContact O-N 3.25Å; V332-F336 HydrophobicContact CG1-CD2 3.63Å; V332-F336 HydrophobicContact CG1-CE2 4.02Å; V332-F336 WeakPolarHBondContact O-CB 3.36Å; V332-F336 WeakPolarHBondContact O-CD2 3.46Å; V332-F336 PolarHBondContact O-N 2.93Å |
| 333 | D | 91.1 | Very high | 90.5 | Very high | 21 Ų | 21 | 66.2 Ų | 66.2 | 11% | 0.112 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -62.5 | -43 | 179 | -66.9 | -24 | 0 | 0 | 0 | 111.4 | T327 N329 Q330 G337 | T327-D333 VanDerWaalsContact CB-OD1 3.29Å; T327-D333 WeakPolarHBondContact CB-OD1 3.5Å; T327-D333 WeakPolarHBondContact CG2-OD1 3.36Å; T327-D333 PolarHBondContact N-OD1 3.42Å; T327-D333 PolarHBondContact N-OD2 2.96Å; T327-D333 VanDerWaalsContact N-OD2 3.1Å; T327-D333 PolarHBondContact OG1-OD1 2.97Å; N329-D333 PolarHBondContact O-N 3.31Å; Q330-D333 PolarHBondContact O-N 2.89Å; D333-G337 WeakPolarHBondContact O-CA 3.38Å; D333-G337 PolarHBondContact O-N 3.44Å |
| 334 | D | 88.8 | Confident | 90.5 | Very high | 71 Ų | 71 | 63.4 Ų | 63.4 | 38% | 0.38 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -66.6 | -45.5 | 178 | -69.4 | -17.9 | 0 | 0 | 0 | 111.7 | A164 Q330 V332 T338 | A164-D334 HydrophobicContact CB-CB 3.75Å; Q330-D334 VanDerWaalsContact O-CB 3.3Å; Q330-D334 WeakPolarHBondContact O-CB 3.47Å; Q330-D334 PolarHBondContact O-N 2.9Å; V332-D334 PolarHBondContact O-N 3.01Å; D334-T338 VanDerWaalsContact O-CB 3.27Å; D334-T338 WeakPolarHBondContact O-CB 3.26Å; D334-T338 PolarHBondContact O-N 3.33Å; D334-T338 PolarHBondContact O-OG1 2.98Å |
| 335 | V | 91.2 | Very high | 90.7 | Very high | 18 Ų | 18 | 60.6 Ų | 60.6 | 11% | 0.109 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -68.4 | -56.5 | -178.2 | 170.4 | 0 | 0 | 0 | 0 | 111.3 | L163 A164 C167 I331 V332 G337 T338 L339 | L163-V335 HydrophobicContact CD2-CG2 3.63Å; L163-V335 HydrophobicContact CG-CG2 4.16Å; A164-V335 HydrophobicContact CB-CG2 4.31Å; C167-V335 HydrophobicContact CB-CG1 4Å; I331-V335 HydrophobicContact CG2-CG2 4.5Å; I331-V335 WeakPolarHBondContact O-CB 3.3Å; I331-V335 VanDerWaalsContact O-CG2 3.24Å; I331-V335 WeakPolarHBondContact O-CG2 3.31Å; I331-V335 PolarHBondContact O-N 2.84Å; V332-V335 PolarHBondContact O-N 3.25Å; V335-G337 VanDerWaalsContact C-N 3.34Å; V335-T338 PolarHBondContact O-N 3.11Å; V335-L339 HydrophobicContact CG1-CD1 4.05Å; V335-L339 VanDerWaalsContact O-CG 3.3Å; V335-L339 WeakPolarHBondContact O-CG 3.28Å; V335-L339 PolarHBondContact O-N 2.98Å |
| 336 | F | 91.7 | Very high | 91 | Very high | 108 Ų | 108 | 59.2 Ų | 59.2 | 47% | 0.474 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -70.5 | -34.4 | -178.4 | -75.6 | -81.2 | 0 | 0 | 0 | 111.3 | L325 V332 T338 L339 L340 | L325-F336 HydrophobicContact CD1-CB 3.53Å; V332-F336 HydrophobicContact CG1-CD2 3.63Å; V332-F336 HydrophobicContact CG1-CE2 4.02Å; V332-F336 WeakPolarHBondContact O-CB 3.36Å; V332-F336 WeakPolarHBondContact O-CD2 3.46Å; V332-F336 PolarHBondContact O-N 2.93Å; F336-T338 VanDerWaalsContact C-N 3.34Å; F336-T338 PolarHBondContact O-N 3.16Å; F336-L339 PolarHBondContact O-N 3.31Å; F336-L340 HydrophobicContact CB-CD1 4.43Å; F336-L340 VanDerWaalsContact O-CB 3.24Å; F336-L340 WeakPolarHBondContact O-CB 3.26Å; F336-L340 WeakPolarHBondContact O-CG 3.3Å; F336-L340 PolarHBondContact O-N 3.31Å |
| 337 | G | 90.6 | Very high | 91.3 | Very high | 18 Ų | 18 | 52.4 Ų | 52.4 | 19% | 0.186 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -58.8 | -46.4 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | D333 V335 T341 | D333-G337 WeakPolarHBondContact O-CA 3.38Å; D333-G337 PolarHBondContact O-N 3.44Å; V335-G337 VanDerWaalsContact C-N 3.34Å; G337-T341 VanDerWaalsContact O-CG2 3.32Å; G337-T341 WeakPolarHBondContact O-CG2 3.15Å; G337-T341 PolarHBondContact O-N 2.96Å; G337-T341 PolarHBondContact O-OG1 3.47Å |
| 338 | T | 89.6 | Confident | 91.5 | Very high | 45 Ų | 45 | 48.5 Ų | 48.5 | 28% | 0.276 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -64.9 | -41.9 | 176 | -56.5 | 0 | 0 | 0 | 0 | 112 | D334 V335 F336 T341 I342 | D334-T338 VanDerWaalsContact O-CB 3.27Å; D334-T338 WeakPolarHBondContact O-CB 3.26Å; D334-T338 PolarHBondContact O-N 3.33Å; D334-T338 PolarHBondContact O-OG1 2.98Å; V335-T338 PolarHBondContact O-N 3.11Å; F336-T338 VanDerWaalsContact C-N 3.34Å; F336-T338 PolarHBondContact O-N 3.16Å; T338-T341 PolarHBondContact O-OG1 2.81Å; T338-I342 WeakPolarHBondContact O-CG1 3.4Å |
| 339 | L | 92.6 | Very high | 91.8 | Very high | 38 Ų | 38 | 49 Ų | 49 | 20% | 0.199 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -68.4 | -39 | -179.4 | -69.6 | 174.1 | 0 | 0 | 0 | 112.6 | C167 A171 V335 F336 T341 I342 L345 | C167-L339 HydrophobicContact CB-CD2 4.39Å; A171-L339 HydrophobicContact CB-CD2 3.49Å; A171-L339 VanDerWaalsContact CB-CD2 3.49Å; V335-L339 HydrophobicContact CG1-CD1 4.05Å; V335-L339 VanDerWaalsContact O-CG 3.3Å; V335-L339 WeakPolarHBondContact O-CG 3.28Å; V335-L339 PolarHBondContact O-N 2.98Å; F336-L339 PolarHBondContact O-N 3.31Å; L339-T341 VanDerWaalsContact C-N 3.31Å; L339-T341 PolarHBondContact O-N 3.17Å; L339-I342 PolarHBondContact O-N 2.65Å; L339-L345 HydrophobicContact CB-CD2 4.11Å; L339-L345 HydrophobicContact CD2-CD2 3.87Å |
| 340 | L | 93 | Very high | 92 | Very high | 44 Ų | 44 | 47.1 Ų | 47.1 | 23% | 0.23 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -78.3 | -12.5 | -176.5 | -68.4 | 170.7 | 0 | 0 | 0 | 113.5 | A317 F320 L325 F336 I346 | A317-L340 VanDerWaalsContact CA-O 3.24Å; A317-L340 WeakPolarHBondContact CA-O 3.39Å; F320-L340 HydrophobicContact CB-CB 4.11Å; F320-L340 HydrophobicContact CD1-CD1 4.15Å; F320-L340 HydrophobicContact CD2-CB 3.65Å; F320-L340 HydrophobicContact CD2-CD1 3.96Å; F320-L340 HydrophobicContact CD2-CD2 4.47Å; F320-L340 HydrophobicContact CD2-CG 4.24Å; F320-L340 HydrophobicContact CE1-CD1 3.93Å; F320-L340 HydrophobicContact CE2-CB 4.21Å; F320-L340 HydrophobicContact CE2-CD1 3.72Å; F320-L340 HydrophobicContact CE2-CD2 4.27Å; F320-L340 HydrophobicContact CE2-CG 4.3Å; F320-L340 HydrophobicContact CG-CB 3.83Å; F320-L340 HydrophobicContact CG-CD1 4.17Å; F320-L340 HydrophobicContact CZ-CD1 3.71Å; L325-L340 HydrophobicContact CD1-CD1 3.62Å; L325-L340 HydrophobicContact CG-CD1 4.44Å; F336-L340 HydrophobicContact CB-CD1 4.43Å; F336-L340 VanDerWaalsContact O-CB 3.24Å; F336-L340 WeakPolarHBondContact O-CB 3.26Å; F336-L340 WeakPolarHBondContact O-CG 3.3Å; F336-L340 PolarHBondContact O-N 3.31Å; L340-I346 WeakPolarHBondContact O-CD1 3.17Å |
| 341 | T | 91.8 | Very high | 92.3 | Very high | 46 Ų | 46 | 40.1 Ų | 40.1 | 28% | 0.282 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -85.2 | -14.3 | 170.1 | 54.6 | 0 | 0 | 0 | 0 | 112.4 | F320 E321 G337 T338 L339 R343 | F320-T341 HydrophobicContact CB-CG2 4.41Å; E321-T341 HydrophobicContact CG-CG2 3.88Å; G337-T341 VanDerWaalsContact O-CG2 3.32Å; G337-T341 WeakPolarHBondContact O-CG2 3.15Å; G337-T341 PolarHBondContact O-N 2.96Å; G337-T341 PolarHBondContact O-OG1 3.47Å; T338-T341 PolarHBondContact O-OG1 2.81Å; L339-T341 VanDerWaalsContact C-N 3.31Å; L339-T341 PolarHBondContact O-N 3.17Å; T341-R343 PolarHBondContact O-N 2.59Å |
| 342 | I | 91.8 | Very high | 92.6 | Very high | 35 Ų | 35 | 38.5 Ų | 38.5 | 18% | 0.179 | 21% | 0.206 | C | C | . | . | trans | -77.9 | 93.2 | 178.5 | -56.9 | 167.6 | 0 | 0 | 0 | 109.6 | A171 T338 L339 M344 L345 I346 | A171-I342 HydrophobicContact CB-CD1 4.07Å; T338-I342 WeakPolarHBondContact O-CG1 3.4Å; L339-I342 PolarHBondContact O-N 2.65Å; I342-M344 VanDerWaalsContact C-N 3.28Å; I342-M344 HydrophobicContact CG2-CB 4.44Å; I342-M344 PolarHBondContact O-N 3.13Å; I342-L345 HydrophobicContact CB-CB 3.89Å; I342-L345 HydrophobicContact CG2-CB 3.65Å; I342-L345 WeakPolarHBondContact O-CB 3.28Å; I342-L345 PolarHBondContact O-N 3.15Å; I342-I346 PolarHBondContact O-N 2.77Å | ||
| 343 | R | 94.3 | Very high | 92.8 | Very high | 43 Ų | 43 | 39 Ų | 39 | 16% | 0.162 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -45.5 | -50.1 | 176.5 | -67.9 | 167.4 | -175.3 | 117.8 | 8.2 | 112.7 | L42 G46 L314 A317 E321 T341 L345 I346 G347 | L42-R343 HydrophobicContact CB-CB 4.48Å; L42-R343 HydrophobicContact CD2-CB 4.37Å; G46-R343 PolarHBondContact O-NH1 2.93Å; L314-R343 HydrophobicContact CD2-CG 4.3Å; A317-R343 HydrophobicContact CB-CB 4.25Å; A317-R343 HydrophobicContact CB-CG 3.37Å; E321-R343 IonicContact OE1-CZ 2.88Å; E321-R343 IonicContact OE1-NH1 3.46Å; E321-R343 IonicContact OE1-NH2 2.93Å; E321-R343 PolarHBondContact OE1-NH2 3.09Å; E321-R343 IonicContact OE2-CZ 3.77Å; E321-R343 IonicContact OE2-NH2 2.87Å; E321-R343 PolarHBondContact OE2-NH2 3.47Å; T341-R343 PolarHBondContact O-N 2.59Å; R343-L345 VanDerWaalsContact C-N 3.34Å; R343-L345 PolarHBondContact O-N 3.4Å; R343-I346 PolarHBondContact O-N 3.44Å; R343-G347 PolarHBondContact O-N 2.91Å |
| 344 | M | 93.2 | Very high | 93 | Very high | 19 Ų | 19 | 40.6 Ų | 40.6 | 9% | 0.094 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -62.9 | -37.2 | -177.9 | -177.4 | 177.3 | 51.6 | 0 | 0 | 112.9 | I39 L43 A175 I342 G348 | I39-M344 HydrophobicContact CB-CG 4.31Å; I39-M344 HydrophobicContact CG2-CG 3.46Å; I39-M344 VanDerWaalsContact CG2-CG 3.46Å; I39-M344 HydrophobicContact CG2-SD 3.72Å; L43-M344 HydrophobicContact CB-SD 3.93Å; L43-M344 HydrophobicContact CD1-CE 4.35Å; L43-M344 HydrophobicContact CD1-SD 4.2Å; L43-M344 HydrophobicContact CG-SD 4.46Å; A175-M344 HydrophobicContact CB-CE 3.23Å; A175-M344 HydrophobicContact CB-CG 3.79Å; A175-M344 HydrophobicContact CB-SD 3.57Å; A175-M344 VanDerWaalsContact CB-SD 3.57Å; I342-M344 VanDerWaalsContact C-N 3.28Å; I342-M344 HydrophobicContact CG2-CB 4.44Å; I342-M344 PolarHBondContact O-N 3.13Å; M344-G348 WeakPolarHBondContact O-CA 3.39Å; M344-G348 PolarHBondContact O-N 3.48Å |
| 345 | L | 92.4 | Very high | 93.3 | Very high | 39 Ų | 39 | 37.2 Ų | 37.2 | 20% | 0.204 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -66.4 | -50.8 | 177.8 | 177.9 | 69 | 0 | 0 | 0 | 110.1 | A171 L339 I342 R343 G348 V349 | A171-L345 HydrophobicContact CB-CD1 3.92Å; A171-L345 HydrophobicContact CB-CD2 3.72Å; A171-L345 HydrophobicContact CB-CG 4.3Å; L339-L345 HydrophobicContact CB-CD2 4.11Å; L339-L345 HydrophobicContact CD2-CD2 3.87Å; I342-L345 HydrophobicContact CB-CB 3.89Å; I342-L345 HydrophobicContact CG2-CB 3.65Å; I342-L345 WeakPolarHBondContact O-CB 3.28Å; I342-L345 PolarHBondContact O-N 3.15Å; R343-L345 VanDerWaalsContact C-N 3.34Å; R343-L345 PolarHBondContact O-N 3.4Å; L345-G348 PolarHBondContact O-N 3.18Å; L345-V349 HydrophobicContact CD1-CG2 4.17Å; L345-V349 WeakPolarHBondContact O-CB 3.44Å; L345-V349 VanDerWaalsContact O-CG2 3.28Å; L345-V349 WeakPolarHBondContact O-CG2 3.34Å; L345-V349 PolarHBondContact O-N 3.35Å |
| 346 | I | 94.3 | Very high | 93.3 | Very high | 20 Ų | 20 | 39 Ų | 39 | 10% | 0.103 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -62 | -53.2 | -176.4 | -65.1 | 161.3 | 0 | 0 | 0 | 110.5 | V316 A317 L340 I342 R343 G348 V349 I350 | V316-I346 HydrophobicContact CB-CD1 3.99Å; V316-I346 HydrophobicContact CB-CG2 4.12Å; V316-I346 HydrophobicContact CG1-CD1 3.59Å; V316-I346 HydrophobicContact CG1-CG1 4.43Å; V316-I346 HydrophobicContact CG1-CG2 4.29Å; V316-I346 HydrophobicContact CG2-CG2 4.42Å; A317-I346 HydrophobicContact CB-CD1 4.18Å; L340-I346 WeakPolarHBondContact O-CD1 3.17Å; I342-I346 PolarHBondContact O-N 2.77Å; R343-I346 PolarHBondContact O-N 3.44Å; I346-G348 VanDerWaalsContact C-N 3.3Å; I346-G348 PolarHBondContact O-N 3.21Å; I346-V349 PolarHBondContact O-N 3.37Å; I346-I350 HydrophobicContact CG2-CD1 3.78Å; I346-I350 VanDerWaalsContact O-CG1 3.26Å; I346-I350 WeakPolarHBondContact O-CG1 3.28Å; I346-I350 PolarHBondContact O-N 2.75Å |
| 347 | G | 94.9 | Very high | 93.4 | Very high | 0 Ų | 0 | 40.1 Ų | 40.1 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -66.5 | -33.8 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | L42 S309 R343 I350 A351 | L42-G347 VanDerWaalsContact CD1-CA 3.48Å; S309-G347 VanDerWaalsContact O-CA 3.31Å; S309-G347 WeakPolarHBondContact O-CA 3.4Å; R343-G347 PolarHBondContact O-N 2.91Å; G347-I350 PolarHBondContact O-N 3.39Å; G347-A351 VanDerWaalsContact O-CB 3.26Å; G347-A351 WeakPolarHBondContact O-CB 3.38Å; G347-A351 PolarHBondContact O-N 3.42Å |
| 348 | G | 93.4 | Very high | 93.3 | Very high | 4 Ų | 4 | 41.5 Ų | 41.5 | 4% | 0.041 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -65 | -44.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | M344 L345 I346 A351 F352 | M344-G348 WeakPolarHBondContact O-CA 3.39Å; M344-G348 PolarHBondContact O-N 3.48Å; L345-G348 PolarHBondContact O-N 3.18Å; I346-G348 VanDerWaalsContact C-N 3.3Å; I346-G348 PolarHBondContact O-N 3.21Å; G348-A351 PolarHBondContact O-N 2.97Å; G348-F352 WeakPolarHBondContact O-CB 3.26Å; G348-F352 PolarHBondContact O-N 3.2Å |
| 349 | V | 94.1 | Very high | 93.2 | Very high | 79 Ų | 79 | 42.5 Ų | 42.5 | 48% | 0.479 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -62.7 | -45.5 | 175.3 | 170.2 | 0 | 0 | 0 | 0 | 110.3 | L345 I346 F352 V353 | L345-V349 HydrophobicContact CD1-CG2 4.17Å; L345-V349 WeakPolarHBondContact O-CB 3.44Å; L345-V349 VanDerWaalsContact O-CG2 3.28Å; L345-V349 WeakPolarHBondContact O-CG2 3.34Å; L345-V349 PolarHBondContact O-N 3.35Å; I346-V349 PolarHBondContact O-N 3.37Å; V349-F352 PolarHBondContact O-N 2.96Å; V349-V353 HydrophobicContact CG1-CG2 4.2Å; V349-V353 VanDerWaalsContact O-CB 3.3Å; V349-V353 WeakPolarHBondContact O-CB 3.44Å; V349-V353 WeakPolarHBondContact O-CG2 3.19Å; V349-V353 PolarHBondContact O-N 2.63Å |
| 350 | I | 95.8 | Very high | 92.8 | Very high | 40 Ų | 40 | 44.1 Ų | 44.1 | 21% | 0.205 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -60.7 | -48.2 | 177.3 | -67.2 | 169.6 | 0 | 0 | 0 | 110.6 | V308 M312 I346 G347 F352 V353 L354 | V308-I350 HydrophobicContact CG1-CG2 4.2Å; M312-I350 HydrophobicContact CB-CD1 3.55Å; M312-I350 HydrophobicContact CG-CD1 4.44Å; I346-I350 HydrophobicContact CG2-CD1 3.78Å; I346-I350 VanDerWaalsContact O-CG1 3.26Å; I346-I350 WeakPolarHBondContact O-CG1 3.28Å; I346-I350 PolarHBondContact O-N 2.75Å; G347-I350 PolarHBondContact O-N 3.39Å; I350-F352 PolarHBondContact O-N 3.35Å; I350-V353 PolarHBondContact O-N 2.75Å; I350-L354 HydrophobicContact CG2-CD1 3.66Å; I350-L354 HydrophobicContact CG2-CG 4.28Å; I350-L354 VanDerWaalsContact O-CB 3.31Å; I350-L354 WeakPolarHBondContact O-CB 3.41Å; I350-L354 VanDerWaalsContact O-CG 3.28Å; I350-L354 WeakPolarHBondContact O-CG 3.46Å; I350-L354 PolarHBondContact O-N 3.46Å |
| 351 | A | 95.6 | Very high | 92.5 | Very high | 0 Ų | 0 | 43.2 Ų | 43.2 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -62.1 | -44.8 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | T35 P38 S309 G347 G348 D355 | T35-A351 HydrophobicContact CG2-CB 4.21Å; P38-A351 HydrophobicContact CB-CB 4.21Å; P38-A351 HydrophobicContact CG-CB 4.07Å; S309-A351 WeakPolarHBondContact OG-CA 3.32Å; S309-A351 VanDerWaalsContact OG-CB 3.3Å; S309-A351 WeakPolarHBondContact OG-CB 3.46Å; S309-A351 PolarHBondContact OG-N 2.98Å; G347-A351 VanDerWaalsContact O-CB 3.26Å; G347-A351 WeakPolarHBondContact O-CB 3.38Å; G347-A351 PolarHBondContact O-N 3.42Å; G348-A351 PolarHBondContact O-N 2.97Å; A351-D355 WeakPolarHBondContact O-CB 3.08Å; A351-D355 PolarHBondContact O-N 2.89Å |
| 352 | F | 93.9 | Very high | 92.4 | Very high | 69 Ų | 69 | 45 Ų | 45 | 30% | 0.303 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -64.4 | -47.6 | 179.7 | 178.7 | -100.1 | 0 | 0 | 0 | 111.8 | I31 T35 G348 V349 I350 N356 | I31-F352 HydrophobicContact CG1-CD2 4.16Å; I31-F352 HydrophobicContact CG1-CE2 4.01Å; T35-F352 HydrophobicContact CG2-CB 3.8Å; T35-F352 HydrophobicContact CG2-CD2 4.34Å; G348-F352 WeakPolarHBondContact O-CB 3.26Å; G348-F352 PolarHBondContact O-N 3.2Å; V349-F352 PolarHBondContact O-N 2.96Å; I350-F352 PolarHBondContact O-N 3.35Å; F352-N356 WeakPolarHBondContact CE2-ND2 3.49Å; F352-N356 WeakPolarHBondContact O-CB 3.41Å; F352-N356 PolarHBondContact O-N 3.32Å; F352-N356 PolarHBondContact O-ND2 2.64Å |
| 353 | V | 94.9 | Very high | 92.2 | Very high | 61 Ų | 61 | 49.9 Ų | 49.9 | 37% | 0.37 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -65.1 | -49.4 | -178.9 | 170.4 | 0 | 0 | 0 | 0 | 110.3 | V349 I350 D355 N356 I357 | V349-V353 HydrophobicContact CG1-CG2 4.2Å; V349-V353 VanDerWaalsContact O-CB 3.3Å; V349-V353 WeakPolarHBondContact O-CB 3.44Å; V349-V353 WeakPolarHBondContact O-CG2 3.19Å; V349-V353 PolarHBondContact O-N 2.63Å; I350-V353 PolarHBondContact O-N 2.75Å; V353-D355 PolarHBondContact O-N 3.03Å; V353-N356 PolarHBondContact O-N 3.05Å; V353-I357 HydrophobicContact CG1-CD1 3.53Å; V353-I357 HydrophobicContact CG1-CG1 4.35Å; V353-I357 WeakPolarHBondContact O-CB 2.85Å; V353-I357 WeakPolarHBondContact O-CG1 3.45Å; V353-I357 PolarHBondContact O-N 3.12Å |
| 354 | L | 95.6 | Very high | 91.9 | Very high | 56 Ų | 56 | 53.9 Ų | 53.9 | 29% | 0.293 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -65.4 | -41.6 | -179 | -68.8 | 178.3 | 0 | 0 | 0 | 112.1 | I305 V308 I350 N356 T358 | I305-L354 HydrophobicContact CD1-CB 4.44Å; I305-L354 HydrophobicContact CG1-CB 4.04Å; I305-L354 HydrophobicContact CG2-CB 4.02Å; V308-L354 HydrophobicContact CG1-CD1 4.18Å; I350-L354 HydrophobicContact CG2-CD1 3.66Å; I350-L354 HydrophobicContact CG2-CG 4.28Å; I350-L354 VanDerWaalsContact O-CB 3.31Å; I350-L354 WeakPolarHBondContact O-CB 3.41Å; I350-L354 VanDerWaalsContact O-CG 3.28Å; I350-L354 WeakPolarHBondContact O-CG 3.46Å; I350-L354 PolarHBondContact O-N 3.46Å; L354-N356 PolarHBondContact O-N 2.92Å; L354-T358 VanDerWaalsContact O-CB 3.29Å; L354-T358 WeakPolarHBondContact O-CB 3.45Å; L354-T358 VanDerWaalsContact O-CG2 3.25Å; L354-T358 WeakPolarHBondContact O-CG2 3.29Å; L354-T358 PolarHBondContact O-N 3.36Å; L354-T358 PolarHBondContact O-OG1 3.1Å |
| 355 | D | 94.6 | Very high | 91.7 | Very high | 0 Ų | 0 | 55.8 Ų | 55.8 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -68.2 | -24.2 | -179.9 | -169.6 | 35.9 | 0 | 0 | 0 | 113.1 | V34 R301 I305 A351 V353 R366 | V34-D355 HydrophobicContact CG1-CB 4.05Å; R301-D355 IonicContact CZ-OD1 3.85Å; R301-D355 IonicContact NH1-OD1 3.08Å; R301-D355 PolarHBondContact NH1-OD1 2.8Å; R301-D355 VanDerWaalsContact NH1-OD1 3.08Å; R301-D355 PolarHBondContact NH2-O 3.26Å; R301-D355 IonicContact NH2-OD1 3.99Å; R301-D355 PolarHBondContact NH2-OD1 3.3Å; I305-D355 HydrophobicContact CG2-CB 4.48Å; A351-D355 WeakPolarHBondContact O-CB 3.08Å; A351-D355 PolarHBondContact O-N 2.89Å; V353-D355 PolarHBondContact O-N 3.03Å; D355-R366 VanDerWaalsContact O-CZ 3.29Å; D355-R366 PolarHBondContact O-NH2 2.94Å; D355-R366 IonicContact OD1-CZ 3.13Å; D355-R366 IonicContact OD1-NE 2.72Å; D355-R366 PolarHBondContact OD1-NE 2.9Å; D355-R366 IonicContact OD1-NH2 3.83Å; D355-R366 IonicContact OD2-CZ 3.72Å; D355-R366 IonicContact OD2-NE 3.77Å; D355-R366 PolarHBondContact OD2-NE 3.45Å; D355-R366 IonicContact OD2-NH2 3.36Å; D355-R366 PolarHBondContact OD2-NH2 3.32Å |
| 356 | N | 92.1 | Very high | 91.5 | Very high | 54 Ų | 54 | 55.2 Ų | 55.2 | 29% | 0.289 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -94 | -27.8 | 177.9 | -72.1 | -68 | 0 | 0 | 0 | 114.2 | Y30 F352 V353 L354 R366 | Y30-N356 PolarHBondContact O-ND2 3.2Å; F352-N356 WeakPolarHBondContact CE2-ND2 3.49Å; F352-N356 WeakPolarHBondContact O-CB 3.41Å; F352-N356 PolarHBondContact O-N 3.32Å; F352-N356 PolarHBondContact O-ND2 2.64Å; V353-N356 PolarHBondContact O-N 3.05Å; L354-N356 PolarHBondContact O-N 2.92Å; N356-R366 PolarHBondContact OD1-NH2 2.97Å |
| 357 | I | 92.8 | Very high | 91.1 | Very high | 132 Ų | 132 | 54.6 Ų | 54.6 | 68% | 0.677 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -85.1 | -37 | 178.1 | -66.1 | 178.6 | 0 | 0 | 0 | 111.7 | V353 G359 | V353-I357 HydrophobicContact CG1-CD1 3.53Å; V353-I357 HydrophobicContact CG1-CG1 4.35Å; V353-I357 WeakPolarHBondContact O-CB 2.85Å; V353-I357 WeakPolarHBondContact O-CG1 3.45Å; V353-I357 PolarHBondContact O-N 3.12Å; I357-G359 PolarHBondContact O-N 3.32Å |
| 358 | T | 89.3 | Confident | 90.6 | Very high | 48 Ų | 48 | 55.3 Ų | 55.3 | 29% | 0.294 | 31% | 0.314 | S | S | . | . | trans | -76.5 | 120.8 | -175.6 | 60.4 | 0 | 0 | 0 | 0 | 111.4 | R301 I305 L354 | R301-T358 PolarHBondContact NE-O 2.95Å; R301-T358 PolarHBondContact NE-OG1 3.21Å; R301-T358 VanDerWaalsContact NE-OG1 3.08Å; R301-T358 PolarHBondContact NH2-O 3.32Å; R301-T358 PolarHBondContact NH2-OG1 3.27Å; I305-T358 WeakPolarHBondContact CD1-OG1 3.42Å; L354-T358 VanDerWaalsContact O-CB 3.29Å; L354-T358 WeakPolarHBondContact O-CB 3.45Å; L354-T358 VanDerWaalsContact O-CG2 3.25Å; L354-T358 WeakPolarHBondContact O-CG2 3.29Å; L354-T358 PolarHBondContact O-N 3.36Å; L354-T358 PolarHBondContact O-OG1 3.1Å | ||
| 359 | G | 86.9 | Confident | 89.3 | Confident | 65 Ų | 65 | 59.2 Ų | 59.2 | 67% | 0.67 | 34% | 0.337 | S | S | * | . | trans | -72.9 | -176.9 | 169.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | R301 I357 | R301-G359 VanDerWaalsContact CD-O 3.31Å; R301-G359 WeakPolarHBondContact CD-O 3.44Å; R301-G359 PolarHBondContact NE-O 3.17Å; I357-G359 PolarHBondContact O-N 3.32Å | ||
| 360 | G | 84 | Confident | 87.4 | Confident | 73 Ų | 73 | 56.6 Ų | 56.6 | 75% | 0.753 | 32% | 0.323 | S | S | * | . | S | Bend | trans | 92.5 | 8.8 | 171.3 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||
| 361 | A | 87.7 | Confident | 85.1 | Confident | 25 Ų | 25 | 62.6 Ų | 62.6 | 21% | 0.207 | 35% | 0.349 | C | S | . | . | trans | -137.3 | 140.8 | 167.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | L299 Q365 R366 | L299-A361 HydrophobicContact CD1-CB 3.81Å; A361-Q365 HydrophobicContact CB-CB 4.31Å; A361-R366 HydrophobicContact CB-CG 4.12Å | ||
| 362 | T | 89.6 | Confident | 82.6 | Confident | 83 Ų | 83 | 67.6 Ų | 67.6 | 51% | 0.509 | 38% | 0.375 | S | S | . | . | trans | -74.6 | 163.3 | 170.9 | 61.6 | 0 | 0 | 0 | 0 | 111.1 | R364 Q365 R366 | T362-R364 VanDerWaalsContact C-N 3.3Å; T362-R364 PolarHBondContact O-N 3.09Å; T362-Q365 PolarHBondContact O-N 3.5Å; T362-Q365 VanDerWaalsContact OG1-CG 3.29Å; T362-Q365 WeakPolarHBondContact OG1-CG 3.32Å; T362-Q365 PolarHBondContact OG1-N 3.31Å; T362-Q365 PolarHBondContact OG1-OE1 3.25Å; T362-R366 PolarHBondContact O-N 2.96Å; T362-R366 VanDerWaalsContact O-N 3.1Å | ||
| 363 | R | 87.7 | Confident | 80.4 | Confident | 137 Ų | 137 | 68.1 Ų | 68.1 | 52% | 0.517 | 38% | 0.381 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.1 | -42.9 | 175.3 | -87.9 | -172.5 | 151.1 | -178.1 | -5.6 | 112.9 | K29 Q365 R366 G367 F368 | K29-R363 PolarHBondContact O-NH2 3.2Å; R363-Q365 VanDerWaalsContact C-N 3.35Å; R363-Q365 PolarHBondContact O-N 3.21Å; R363-R366 PolarHBondContact O-N 3Å; R363-G367 PolarHBondContact O-N 2.89Å; R363-F368 HydrophobicContact CB-CB 4.2Å; R363-F368 HydrophobicContact CB-CD2 4.34Å; R363-F368 HydrophobicContact CG-CD2 4.29Å; R363-F368 WeakPolarHBondContact O-CB 3.49Å; R363-F368 WeakPolarHBondContact O-CD2 3.43Å; R363-F368 PolarHBondContact O-N 2.62Å |
| 364 | R | 86.4 | Confident | 78.2 | Confident | 128 Ų | 128 | 67.3 Ų | 67.3 | 48% | 0.483 | 37% | 0.373 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.3 | -44.1 | 176.3 | -72.8 | -175.3 | 173.4 | 174.2 | -4.8 | 111.7 | T362 R366 G367 S370 D373 | T362-R364 VanDerWaalsContact C-N 3.3Å; T362-R364 PolarHBondContact O-N 3.09Å; R364-R366 VanDerWaalsContact C-N 3.25Å; R364-R366 PolarHBondContact O-N 3.31Å; R364-G367 WeakPolarHBondContact O-CA 3.21Å; R364-G367 PolarHBondContact O-N 3.46Å; R364-S370 PolarHBondContact NE-OG 3.46Å; R364-S370 PolarHBondContact NH2-OG 2.94Å; R364-D373 IonicContact NH2-OD1 3.69Å |
| 365 | Q | 89.9 | Confident | 75.8 | Confident | 58 Ų | 58 | 68.6 Ų | 68.6 | 27% | 0.271 | 38% | 0.381 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.4 | -24.5 | 178.1 | -72.7 | 169.2 | -42.4 | 0 | 0 | 113.9 | D296 L299 N302 A361 T362 R363 | D296-Q365 HydrophobicContact CB-CB 3.95Å; D296-Q365 HydrophobicContact CB-CG 4.04Å; D296-Q365 PolarHBondContact N-O 3.29Å; L299-Q365 HydrophobicContact CD1-CB 3.76Å; L299-Q365 HydrophobicContact CD1-CG 4.09Å; N302-Q365 PolarHBondContact ND2-O 3.15Å; A361-Q365 HydrophobicContact CB-CB 4.31Å; T362-Q365 PolarHBondContact O-N 3.5Å; T362-Q365 VanDerWaalsContact OG1-CG 3.29Å; T362-Q365 WeakPolarHBondContact OG1-CG 3.32Å; T362-Q365 PolarHBondContact OG1-N 3.31Å; T362-Q365 PolarHBondContact OG1-OE1 3.25Å; R363-Q365 VanDerWaalsContact C-N 3.35Å; R363-Q365 PolarHBondContact O-N 3.21Å |
| 366 | R | 88.6 | Confident | 73.2 | Confident | 28 Ų | 28 | 75.3 Ų | 75.3 | 11% | 0.106 | 42% | 0.416 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -78.9 | -4.4 | 171 | -70 | 171.2 | 64.5 | -171.6 | -2.6 | 113.1 | V34 D355 N356 A361 T362 R363 R364 F368 | V34-R366 HydrophobicContact CG2-CB 4.5Å; D355-R366 VanDerWaalsContact O-CZ 3.29Å; D355-R366 PolarHBondContact O-NH2 2.94Å; D355-R366 IonicContact OD1-CZ 3.13Å; D355-R366 IonicContact OD1-NE 2.72Å; D355-R366 PolarHBondContact OD1-NE 2.9Å; D355-R366 IonicContact OD1-NH2 3.83Å; D355-R366 IonicContact OD2-CZ 3.72Å; D355-R366 IonicContact OD2-NE 3.77Å; D355-R366 PolarHBondContact OD2-NE 3.45Å; D355-R366 IonicContact OD2-NH2 3.36Å; D355-R366 PolarHBondContact OD2-NH2 3.32Å; N356-R366 PolarHBondContact OD1-NH2 2.97Å; A361-R366 HydrophobicContact CB-CG 4.12Å; T362-R366 PolarHBondContact O-N 2.96Å; T362-R366 VanDerWaalsContact O-N 3.1Å; R363-R366 PolarHBondContact O-N 3Å; R364-R366 VanDerWaalsContact C-N 3.25Å; R364-R366 PolarHBondContact O-N 3.31Å; R366-F368 HydrophobicContact CB-CD2 3.81Å; R366-F368 HydrophobicContact CB-CE2 3.93Å |
| 367 | G | 85.4 | Confident | 70.9 | Confident | 7 Ų | 7 | 79.7 Ų | 79.7 | 7% | 0.072 | 44% | 0.44 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 85.4 | 17 | -177.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | P33 T294 R363 R364 V369 | P33-G367 WeakPolarHBondContact CG-O 3.37Å; T294-G367 WeakPolarHBondContact O-CA 3.23Å; R363-G367 PolarHBondContact O-N 2.89Å; R364-G367 WeakPolarHBondContact O-CA 3.21Å; R364-G367 PolarHBondContact O-N 3.46Å; G367-V369 PolarHBondContact O-N 3Å |
| 368 | F | 83.8 | Confident | 68.8 | Low | 15 Ų | 15 | 75.5 Ų | 75.5 | 7% | 0.066 | 42% | 0.42 | C | S | . | . | P | Polyproline II helix | trans | -75.8 | 118.5 | 165.6 | -65.6 | -88.9 | 0 | 0 | 0 | 109.1 | K29 I31 R363 R366 S370 | K29-F368 WeakPolarHBondContact O-CE1 3.25Å; I31-F368 WeakPolarHBondContact O-CE1 3.37Å; R363-F368 HydrophobicContact CB-CB 4.2Å; R363-F368 HydrophobicContact CB-CD2 4.34Å; R363-F368 HydrophobicContact CG-CD2 4.29Å; R363-F368 WeakPolarHBondContact O-CB 3.49Å; R363-F368 WeakPolarHBondContact O-CD2 3.43Å; R363-F368 PolarHBondContact O-N 2.62Å; R366-F368 HydrophobicContact CB-CD2 3.81Å; R366-F368 HydrophobicContact CB-CE2 3.93Å; F368-S370 PolarHBondContact O-N 3.07Å |
| 369 | V | 67.1 | Low | 66.7 | Low | 86 Ų | 86 | 80.5 Ų | 80.5 | 52% | 0.521 | 44% | 0.44 | S | S | . | . | P | Polyproline II helix | trans | -59.3 | 131.5 | 167.5 | -174.8 | 0 | 0 | 0 | 0 | 108.3 | G367 D373 | G367-V369 PolarHBondContact O-N 3Å; V369-D373 HydrophobicContact CG1-CB 4.34Å |
| 370 | S | 53.7 | Low | 64.6 | Low | 24 Ų | 24 | 86 Ų | 86 | 17% | 0.168 | 45% | 0.449 | C | S | . | . | P | Polyproline II helix | trans | -90.5 | 148 | -180 | 66.5 | 0 | 0 | 0 | 0 | 111.2 | R364 F368 I372 D373 | R364-S370 PolarHBondContact NE-OG 3.46Å; R364-S370 PolarHBondContact NH2-OG 2.94Å; F368-S370 PolarHBondContact O-N 3.07Å; S370-I372 PolarHBondContact O-N 3.44Å; S370-I372 VanDerWaalsContact O-N 3.12Å; S370-D373 PolarHBondContact N-OD2 2.71Å; S370-D373 PolarHBondContact O-N 2.88Å; S370-D373 PolarHBondContact OG-OD1 3.34Å; S370-D373 PolarHBondContact OG-OD2 3.02Å |
| 371 | E | 48.4 | Very low | 62.6 | Low | 165 Ų | 165 | 89.2 Ų | 89.2 | 77% | 0.771 | 44% | 0.444 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.9 | -30.9 | 177.8 | -70.1 | 168.9 | 177.4 | 0 | 0 | 111.9 | D373 E374 | E371-D373 VanDerWaalsContact C-N 3.33Å; E371-D373 PolarHBondContact O-N 3.2Å; E371-E374 VanDerWaalsContact O-CB 3.28Å; E371-E374 WeakPolarHBondContact O-CB 3.5Å; E371-E374 PolarHBondContact O-N 2.91Å |
| 372 | I | 41.9 | Very low | 60.6 | Low | 105 Ų | 105 | 91 Ų | 91 | 54% | 0.538 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -69.8 | -27.2 | 178.7 | -53 | 170.5 | 0 | 0 | 0 | 112.3 | S370 E374 D375 | S370-I372 PolarHBondContact O-N 3.44Å; S370-I372 VanDerWaalsContact O-N 3.12Å; I372-E374 PolarHBondContact O-N 3.35Å; I372-D375 PolarHBondContact O-N 3.43Å |
| 373 | D | 48 | Very low | 58.8 | Low | 80 Ų | 80 | 89.9 Ų | 89.9 | 43% | 0.428 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -76.7 | -6.5 | 174.6 | -50.3 | -48.2 | 0 | 0 | 0 | 111.5 | R364 V369 S370 E371 | R364-D373 IonicContact NH2-OD1 3.69Å; V369-D373 HydrophobicContact CG1-CB 4.34Å; S370-D373 PolarHBondContact N-OD2 2.71Å; S370-D373 PolarHBondContact O-N 2.88Å; S370-D373 PolarHBondContact OG-OD1 3.34Å; S370-D373 PolarHBondContact OG-OD2 3.02Å; E371-D373 VanDerWaalsContact C-N 3.33Å; E371-D373 PolarHBondContact O-N 3.2Å |
| 374 | E | 48.7 | Very low | 57 | Low | 44 Ų | 44 | 84.3 Ų | 84.3 | 21% | 0.206 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -87.1 | -28.6 | 173.7 | -55 | -172.1 | 156.1 | 0 | 0 | 111.9 | R195 E371 I372 V378 | R195-E374 VanDerWaalsContact CB-OE1 3.23Å; R195-E374 WeakPolarHBondContact CB-OE1 3.15Å; R195-E374 PolarHBondContact N-OE1 3.05Å; E371-E374 VanDerWaalsContact O-CB 3.28Å; E371-E374 WeakPolarHBondContact O-CB 3.5Å; E371-E374 PolarHBondContact O-N 2.91Å; I372-E374 PolarHBondContact O-N 3.35Å; E374-V378 WeakPolarHBondContact O-CB 3.46Å; E374-V378 WeakPolarHBondContact O-CG2 3.4Å; E374-V378 PolarHBondContact O-N 3.32Å |
| 375 | D | 44.6 | Very low | 55.4 | Low | 84 Ų | 84 | 83.8 Ų | 83.8 | 45% | 0.449 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -77.1 | -39.3 | -173.4 | -67.7 | -27.9 | 0 | 0 | 0 | 112.8 | I372 | I372-D375 PolarHBondContact O-N 3.43Å |
| 376 | D | 41.5 | Very low | 54 | Low | 140 Ų | 140 | 85.5 Ų | 85.5 | 75% | 0.749 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -77.5 | -24.4 | -174.1 | -75.5 | -25.2 | 0 | 0 | 0 | 114.4 | ||
| 377 | D | 43.8 | Very low | 53.2 | Low | 146 Ų | 146 | 86.6 Ų | 86.6 | 78% | 0.781 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -111.5 | -19.3 | -176.1 | -82.5 | -27.8 | 0 | 0 | 0 | 114.4 | ||
| 378 | V | 47.5 | Very low | 52.6 | Low | 44 Ų | 44 | 87.7 Ų | 87.7 | 27% | 0.267 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -109.8 | -29.5 | -170.9 | -169.9 | 0 | 0 | 0 | 0 | 113.4 | E374 E380 Q381 A382 | E374-V378 WeakPolarHBondContact O-CB 3.46Å; E374-V378 WeakPolarHBondContact O-CG2 3.4Å; E374-V378 PolarHBondContact O-N 3.32Å; V378-E380 VanDerWaalsContact C-N 3.27Å; V378-E380 PolarHBondContact O-N 2.98Å; V378-Q381 PolarHBondContact O-N 3.21Å; V378-A382 HydrophobicContact CG1-CB 4.4Å; V378-A382 PolarHBondContact O-N 2.96Å |
| 379 | E | 44.7 | Very low | 52.6 | Low | 154 Ų | 154 | 89 Ų | 89 | 72% | 0.72 | 47% | 0.469 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.8 | -29.3 | -178.7 | -81.9 | -160.4 | 135.7 | 0 | 0 | 113.2 | Q381 | E379-Q381 PolarHBondContact O-N 3.26Š|
| 380 | E | 43.1 | Very low | 53.3 | Low | 181 Ų | 181 | 85.5 Ų | 85.5 | 85% | 0.846 | 45% | 0.45 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.2 | -11 | -176.9 | -101.9 | -171.7 | 166.4 | 0 | 0 | 114.6 | V378 | V378-E380 VanDerWaalsContact C-N 3.27Å; V378-E380 PolarHBondContact O-N 2.98Å |
| 381 | Q | 42.6 | Very low | 54.7 | Low | 139 Ų | 139 | 85.7 Ų | 85.7 | 65% | 0.65 | 45% | 0.449 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -138.3 | -8.8 | -172.6 | -69.2 | -175.8 | -1.4 | 0 | 0 | 117.5 | V378 E379 T383 | V378-Q381 PolarHBondContact O-N 3.21Å; E379-Q381 PolarHBondContact O-N 3.26Å; Q381-T383 PolarHBondContact O-N 3.37Å |
| 382 | A | 44.9 | Very low | 56.5 | Low | 64 Ų | 64 | 82 Ų | 82 | 53% | 0.529 | 44% | 0.439 | S | S | . | . | trans | -78.7 | 85.5 | -173.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | V378 | V378-A382 HydrophobicContact CG1-CB 4.4Å; V378-A382 PolarHBondContact O-N 2.96Å | ||
| 383 | T | 53.2 | Low | 58.4 | Low | 59 Ų | 59 | 78.4 Ų | 78.4 | 36% | 0.362 | 42% | 0.423 | S | S | . | . | trans | -64.8 | 155.9 | 159.9 | 60.2 | 0 | 0 | 0 | 0 | 110.2 | Q381 E385 M386 N387 F427 | Q381-T383 PolarHBondContact O-N 3.37Å; T383-E385 PolarHBondContact O-N 3.04Å; T383-M386 WeakPolarHBondContact O-CA 3.32Å; T383-M386 VanDerWaalsContact O-CB 3.28Å; T383-M386 WeakPolarHBondContact O-CB 3.08Å; T383-M386 PolarHBondContact O-N 3.02Å; T383-M386 WeakPolarHBondContact OG1-CG 3.49Å; T383-N387 PolarHBondContact O-N 3.26Å; T383-F427 HydrophobicContact CG2-CE2 4.11Å | ||
| 384 | V | 49.5 | Very low | 60.3 | Low | 20 Ų | 20 | 83.4 Ų | 83.4 | 12% | 0.121 | 44% | 0.441 | C | S | . | . | G | 310 helix | trans | -65.3 | -25.8 | -176 | -167.4 | 0 | 0 | 0 | 0 | 113.1 | M386 N387 I420 K423 L424 | V384-M386 PolarHBondContact O-N 3.08Å; V384-N387 PolarHBondContact O-N 3.39Å; V384-N387 VanDerWaalsContact O-N 3.17Å; V384-I420 HydrophobicContact CG1-CG2 4.03Å; V384-K423 HydrophobicContact CB-CB 4.45Å; V384-K423 HydrophobicContact CG2-CB 3.09Å; V384-K423 HydrophobicContact CG2-CD 4.06Å; V384-K423 HydrophobicContact CG2-CG 4.18Å; V384-L424 HydrophobicContact CB-CD2 3.9Å; V384-L424 HydrophobicContact CB-CG 4.16Å; V384-L424 HydrophobicContact CG1-CD1 4.34Å; V384-L424 HydrophobicContact CG1-CD2 3.59Å; V384-L424 HydrophobicContact CG1-CG 3.52Å |
| 385 | E | 52.9 | Low | 62 | Low | 116 Ų | 116 | 85 Ų | 85 | 54% | 0.542 | 45% | 0.451 | S | S | . | . | G | 310 helix | trans | -62.7 | -23.9 | 169.6 | -71.1 | -171.8 | 165.5 | 0 | 0 | 112 | T383 F427 | T383-E385 PolarHBondContact O-N 3.04Å; E385-F427 HydrophobicContact CG-CD1 4.33Å; E385-F427 HydrophobicContact CG-CE1 3.99Å; E385-F427 WeakPolarHBondContact OE1-CE1 3.43Å |
| 386 | M | 59.5 | Low | 64 | Low | 95 Ų | 95 | 81 Ų | 81 | 47% | 0.468 | 43% | 0.43 | S | S | . | . | G | 310 helix | trans | -89.9 | -4.2 | 176.5 | -62.7 | 178.2 | 75 | 0 | 0 | 113.7 | Q193 T383 V384 G388 | Q193-M386 VanDerWaalsContact CD-O 3.27Å; Q193-M386 PolarHBondContact NE2-O 3Å; Q193-M386 PolarHBondContact OE1-O 3.34Å; T383-M386 WeakPolarHBondContact O-CA 3.32Å; T383-M386 VanDerWaalsContact O-CB 3.28Å; T383-M386 WeakPolarHBondContact O-CB 3.08Å; T383-M386 PolarHBondContact O-N 3.02Å; T383-M386 WeakPolarHBondContact OG1-CG 3.49Å; V384-M386 PolarHBondContact O-N 3.08Å; M386-G388 PolarHBondContact O-N 2.98Å; M386-G388 VanDerWaalsContact O-N 3.15Å |
| 387 | N | 71.7 | Confident | 66.1 | Low | 51 Ų | 51 | 80.1 Ų | 80.1 | 27% | 0.273 | 42% | 0.421 | S | S | . | . | trans | -77.7 | 101.5 | 173.4 | -170.9 | -21.3 | 0 | 0 | 0 | 110.4 | R242 T383 V384 Y389 A390 | R242-N387 PolarHBondContact NH2-O 3.37Å; T383-N387 PolarHBondContact O-N 3.26Å; V384-N387 PolarHBondContact O-N 3.39Å; V384-N387 VanDerWaalsContact O-N 3.17Å; N387-Y389 PolarHBondContact O-N 3.43Å; N387-Y389 VanDerWaalsContact O-N 3.13Å; N387-Y389 VanDerWaalsContact OD1-CB 3.29Å; N387-Y389 WeakPolarHBondContact OD1-CB 3.48Å; N387-Y389 PolarHBondContact OD1-N 3.05Å; N387-A390 HydrophobicContact CB-CB 4.33Å; N387-A390 PolarHBondContact O-N 3.49Å | ||
| 388 | G | 74.2 | Confident | 68.3 | Low | 30 Ų | 30 | 77.9 Ų | 77.9 | 31% | 0.309 | 40% | 0.404 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.8 | -17 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | R242 M386 | R242-G388 PolarHBondContact NH1-O 3.29Å; M386-G388 PolarHBondContact O-N 2.98Å; M386-G388 VanDerWaalsContact O-N 3.15Å |
| 389 | Y | 82.9 | Confident | 70.3 | Confident | 41 Ų | 41 | 77.1 Ų | 77.1 | 16% | 0.161 | 40% | 0.397 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -94.2 | -15.4 | -176.4 | -61 | -45.9 | 0 | 0 | 0 | 114.3 | A188 Q193 S194 P196 P197 N200 N387 | A188-Y389 VanDerWaalsContact CB-OH 3.32Å; A188-Y389 WeakPolarHBondContact CB-OH 3.14Å; Q193-Y389 HydrophobicContact CB-CE2 4.15Å; S194-Y389 VanDerWaalsContact O-CE2 3.23Å; S194-Y389 WeakPolarHBondContact O-CE2 3.18Å; S194-Y389 VanDerWaalsContact O-CZ 3.31Å; S194-Y389 PolarHBondContact O-OH 3.2Å; P196-Y389 HydrophobicContact CB-CE1 4.12Å; P196-Y389 WeakPolarHBondContact CD-OH 3.31Å; P196-Y389 HydrophobicContact CG-CE1 4.28Å; P196-Y389 WeakPolarHBondContact CG-OH 3.37Å; P197-Y389 HydrophobicContact CG-CG 4.46Å; N200-Y389 HydrophobicContact CB-CD1 4.46Å; N200-Y389 WeakPolarHBondContact ND2-CA 3.33Å; N200-Y389 WeakPolarHBondContact ND2-CB 3.41Å; N200-Y389 WeakPolarHBondContact ND2-CD1 3.39Å; N200-Y389 PolarHBondContact ND2-O 2.8Å; N387-Y389 PolarHBondContact O-N 3.43Å; N387-Y389 VanDerWaalsContact O-N 3.13Å; N387-Y389 VanDerWaalsContact OD1-CB 3.29Å; N387-Y389 WeakPolarHBondContact OD1-CB 3.48Å; N387-Y389 PolarHBondContact OD1-N 3.05Å |
| 390 | A | 81.4 | Confident | 72.3 | Confident | 13 Ų | 13 | 72.1 Ų | 72.1 | 11% | 0.107 | 38% | 0.375 | C | S | . | . | P | Polyproline II helix | trans | -65.2 | 137.2 | -179.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | R242 N387 I420 | R242-A390 PolarHBondContact NH1-O 2.77Å; N387-A390 HydrophobicContact CB-CB 4.33Å; N387-A390 PolarHBondContact O-N 3.49Å; A390-I420 HydrophobicContact CB-CG2 4.02Å |
| 391 | L | 84.3 | Confident | 74.5 | Confident | 29 Ų | 29 | 72.7 Ų | 72.7 | 15% | 0.152 | 37% | 0.37 | C | S | . | . | P | Polyproline II helix | trans | -83.1 | 157.9 | 173.4 | -66 | 168 | 0 | 0 | 0 | 110.3 | L395 N396 F399 P412 | L391-L395 HydrophobicContact CD2-CD2 4.18Å; L391-N396 WeakPolarHBondContact CB-OD1 3.49Å; L391-N396 PolarHBondContact O-ND2 2.95Å; L391-N396 VanDerWaalsContact O-ND2 3.1Å; L391-F399 HydrophobicContact CD1-CD2 4.26Å; L391-F399 HydrophobicContact CD1-CE2 3.9Å; L391-P412 HydrophobicContact CD1-CG 4.15Å |
| 392 | P | 85 | Confident | 76.7 | Confident | 86 Ų | 86 | 70.7 Ų | 70.7 | 56% | 0.558 | 36% | 0.357 | S | S | * | . | P | Polyproline II helix | trans | -59.5 | 142.6 | 176.4 | -21.8 | 32.6 | 0 | 0 | 0 | 111.7 | K394 L395 N396 | P392-K394 PolarHBondContact O-N 2.99Å; P392-K394 VanDerWaalsContact O-N 3.09Å; P392-L395 WeakPolarHBondContact O-CA 3.24Å; P392-L395 VanDerWaalsContact O-CB 3.27Å; P392-L395 WeakPolarHBondContact O-CB 3.37Å; P392-L395 PolarHBondContact O-N 3.43Å; P392-N396 PolarHBondContact O-N 2.79Å |
| 393 | S | 83.1 | Confident | 78.5 | Confident | 31 Ų | 31 | 70.2 Ų | 70.2 | 22% | 0.217 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -56.8 | -32.9 | -175.9 | -60 | 0 | 0 | 0 | 0 | 114.6 | L395 N396 Q397 E421 | S393-L395 VanDerWaalsContact C-N 3.26Å; S393-L395 PolarHBondContact O-N 2.9Å; S393-N396 PolarHBondContact O-N 3.45Å; S393-Q397 WeakPolarHBondContact O-CB 3.25Å; S393-Q397 VanDerWaalsContact O-CG 3.29Å; S393-Q397 WeakPolarHBondContact O-CG 3.29Å; S393-Q397 PolarHBondContact O-N 3.28Å; S393-E421 VanDerWaalsContact CA-OE1 3.23Å; S393-E421 WeakPolarHBondContact CA-OE1 3.41Å; S393-E421 VanDerWaalsContact CB-OE1 3.31Å; S393-E421 WeakPolarHBondContact CB-OE1 3.41Å; S393-E421 PolarHBondContact OG-OE1 2.92Å; S393-E421 VanDerWaalsContact OG-OE1 3.05Å |
| 394 | K | 86.6 | Confident | 80.1 | Confident | 185 Ų | 185 | 75.3 Ų | 75.3 | 80% | 0.804 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -61.2 | -37.2 | 174.3 | -65 | -172.6 | -179.6 | -179.7 | 0 | 112 | P392 F398 | P392-K394 PolarHBondContact O-N 2.99Å; P392-K394 VanDerWaalsContact O-N 3.09Å; K394-F398 WeakPolarHBondContact O-CB 3.33Å; K394-F398 PolarHBondContact O-N 3.27Å |
| 395 | L | 85.8 | Confident | 81.8 | Confident | 77 Ų | 77 | 75.5 Ų | 75.5 | 40% | 0.403 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -74.3 | -41.8 | 177.8 | -134.3 | 76.9 | 0 | 0 | 0 | 110.7 | L391 P392 S393 Q397 F398 F399 | L391-L395 HydrophobicContact CD2-CD2 4.18Å; P392-L395 WeakPolarHBondContact O-CA 3.24Å; P392-L395 VanDerWaalsContact O-CB 3.27Å; P392-L395 WeakPolarHBondContact O-CB 3.37Å; P392-L395 PolarHBondContact O-N 3.43Å; S393-L395 VanDerWaalsContact C-N 3.26Å; S393-L395 PolarHBondContact O-N 2.9Å; L395-Q397 PolarHBondContact O-N 3.38Å; L395-F398 WeakPolarHBondContact O-CB 3.14Å; L395-F398 PolarHBondContact O-N 3.04Å; L395-F399 HydrophobicContact CB-CE2 4.28Å; L395-F399 HydrophobicContact CD2-CE2 3.72Å; L395-F399 HydrophobicContact CD2-CZ 4.15Å; L395-F399 HydrophobicContact CG-CD2 4.46Å; L395-F399 HydrophobicContact CG-CE2 3.7Å; L395-F399 HydrophobicContact CG-CZ 4.16Å; L395-F399 WeakPolarHBondContact O-CD2 3.36Å; L395-F399 WeakPolarHBondContact O-CG 3.43Å; L395-F399 PolarHBondContact O-N 3.41Å |
| 396 | N | 86.3 | Confident | 83.2 | Confident | 1 Ų | 1 | 70.8 Ų | 70.8 | 1% | 0.005 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -57.7 | -49.6 | 174.9 | -69.7 | -19.8 | 0 | 0 | 0 | 111.4 | L391 P392 S393 F398 F399 L400 I417 E421 | L391-N396 WeakPolarHBondContact CB-OD1 3.49Å; L391-N396 PolarHBondContact O-ND2 2.95Å; L391-N396 VanDerWaalsContact O-ND2 3.1Å; P392-N396 PolarHBondContact O-N 2.79Å; S393-N396 PolarHBondContact O-N 3.45Å; N396-F398 VanDerWaalsContact C-N 3.27Å; N396-F398 PolarHBondContact O-N 3.02Å; N396-F399 PolarHBondContact O-N 3.4Å; N396-F399 VanDerWaalsContact O-N 3.16Å; N396-L400 WeakPolarHBondContact O-CG 3.26Å; N396-L400 PolarHBondContact O-N 2.67Å; N396-I417 HydrophobicContact CB-CG2 3.63Å; N396-E421 HydrophobicContact CB-CG 3.91Å; N396-E421 WeakPolarHBondContact CB-OE1 3.46Å; N396-E421 PolarHBondContact ND2-OE1 3.48Å |
| 397 | Q | 85.9 | Confident | 84.4 | Confident | 121 Ų | 121 | 75.6 Ų | 75.6 | 57% | 0.565 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -60.6 | -36.4 | 176.6 | -70.5 | 173.5 | 9.2 | 0 | 0 | 112.4 | S393 L395 R401 | S393-Q397 WeakPolarHBondContact O-CB 3.25Å; S393-Q397 VanDerWaalsContact O-CG 3.29Å; S393-Q397 WeakPolarHBondContact O-CG 3.29Å; S393-Q397 PolarHBondContact O-N 3.28Å; L395-Q397 PolarHBondContact O-N 3.38Å; Q397-R401 WeakPolarHBondContact O-CB 3.39Å; Q397-R401 PolarHBondContact O-N 3.37Å |
| 398 | F | 89.2 | Confident | 85.1 | Confident | 99 Ų | 99 | 76.1 Ų | 76.1 | 43% | 0.434 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -64.9 | -44.3 | 174.8 | 178 | -93.8 | 0 | 0 | 0 | 112 | K394 L395 N396 R401 Y402 L405 | K394-F398 WeakPolarHBondContact O-CB 3.33Å; K394-F398 PolarHBondContact O-N 3.27Å; L395-F398 WeakPolarHBondContact O-CB 3.14Å; L395-F398 PolarHBondContact O-N 3.04Å; N396-F398 VanDerWaalsContact C-N 3.27Å; N396-F398 PolarHBondContact O-N 3.02Å; F398-R401 WeakPolarHBondContact O-CB 3.33Å; F398-R401 PolarHBondContact O-N 2.88Å; F398-Y402 HydrophobicContact CD2-CD2 4.11Å; F398-Y402 HydrophobicContact CD2-CE2 4.04Å; F398-Y402 HydrophobicContact CE1-CD2 4.24Å; F398-Y402 AromaticContact CE2-CD2 3.74Å; F398-Y402 HydrophobicContact CE2-CD2 3.74Å; F398-Y402 AromaticContact CE2-CE2 3.52Å; F398-Y402 HydrophobicContact CE2-CE2 3.52Å; F398-Y402 AromaticContact CZ-CD2 3.81Å; F398-Y402 HydrophobicContact CZ-CD2 3.81Å; F398-Y402 AromaticContact CZ-CE2 3.94Å; F398-Y402 HydrophobicContact CZ-CE2 3.94Å; F398-Y402 PolarHBondContact O-N 3.05Å; F398-Y402 VanDerWaalsContact O-N 3.15Å; F398-L405 HydrophobicContact CD1-CD1 4.5Å; F398-L405 HydrophobicContact CE1-CD1 3.8Å |
| 399 | F | 88.8 | Confident | 85.6 | Confident | 27 Ų | 27 | 76.9 Ų | 76.9 | 12% | 0.118 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -69 | -35.9 | 177.2 | -65.6 | -49.9 | 0 | 0 | 0 | 112.9 | L391 L395 N396 R401 Y402 S403 L405 T406 I411 I417 | L391-F399 HydrophobicContact CD1-CD2 4.26Å; L391-F399 HydrophobicContact CD1-CE2 3.9Å; L395-F399 HydrophobicContact CB-CE2 4.28Å; L395-F399 HydrophobicContact CD2-CE2 3.72Å; L395-F399 HydrophobicContact CD2-CZ 4.15Å; L395-F399 HydrophobicContact CG-CD2 4.46Å; L395-F399 HydrophobicContact CG-CE2 3.7Å; L395-F399 HydrophobicContact CG-CZ 4.16Å; L395-F399 WeakPolarHBondContact O-CD2 3.36Å; L395-F399 WeakPolarHBondContact O-CG 3.43Å; L395-F399 PolarHBondContact O-N 3.41Å; N396-F399 PolarHBondContact O-N 3.4Å; N396-F399 VanDerWaalsContact O-N 3.16Å; F399-R401 VanDerWaalsContact C-N 3.3Å; F399-R401 PolarHBondContact O-N 2.93Å; F399-Y402 CarbonylContact O-C 3.49Å; F399-Y402 PolarHBondContact O-N 2.92Å; F399-Y402 VanDerWaalsContact O-O 3.11Å; F399-S403 PolarHBondContact O-N 2.69Å; F399-L405 HydrophobicContact CD1-CB 4.06Å; F399-L405 HydrophobicContact CD1-CD1 3.95Å; F399-L405 HydrophobicContact CE1-CD1 4.2Å; F399-T406 HydrophobicContact CB-CG2 4.2Å; F399-I411 HydrophobicContact CB-CG2 4.46Å; F399-I411 HydrophobicContact CD1-CD1 3.74Å; F399-I411 HydrophobicContact CD1-CG2 4.31Å; F399-I411 HydrophobicContact CD2-CG2 4.17Å; F399-I411 HydrophobicContact CE1-CD1 3.41Å; F399-I411 VanDerWaalsContact CE1-CD1 3.41Å; F399-I411 HydrophobicContact CE1-CG1 4.21Å; F399-I411 HydrophobicContact CG-CG2 4.07Å; F399-I411 HydrophobicContact CZ-CD1 3.92Å; F399-I411 HydrophobicContact CZ-CG1 4.25Å; F399-I417 HydrophobicContact CB-CD1 4.08Å |
| 400 | L | 87.3 | Confident | 85.8 | Confident | 49 Ų | 49 | 75.5 Ų | 75.5 | 26% | 0.257 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -66.2 | -33.5 | 172.7 | -67.4 | 177.6 | 0 | 0 | 0 | 112.1 | N396 Y402 E414 I417 R418 | N396-L400 WeakPolarHBondContact O-CG 3.26Å; N396-L400 PolarHBondContact O-N 2.67Å; L400-Y402 VanDerWaalsContact C-N 3.32Å; L400-E414 HydrophobicContact CD2-CG 3.66Å; L400-I417 HydrophobicContact CD1-CG2 3.98Å; L400-I417 HydrophobicContact CD2-CB 4.16Å; L400-I417 HydrophobicContact CD2-CG2 3.89Å; L400-I417 HydrophobicContact CG-CG2 3.77Å; L400-R418 HydrophobicContact CD1-CG 4.34Å; L400-R418 HydrophobicContact CD2-CG 3.86Å |
| 401 | R | 90.5 | Very high | 86 | Confident | 193 Ų | 193 | 75.9 Ų | 75.9 | 73% | 0.728 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -67.4 | -33.2 | 174.3 | -176.8 | 174.9 | -179.3 | 172.4 | 1.3 | 112.5 | Q397 F398 F399 | Q397-R401 WeakPolarHBondContact O-CB 3.39Å; Q397-R401 PolarHBondContact O-N 3.37Å; F398-R401 WeakPolarHBondContact O-CB 3.33Å; F398-R401 PolarHBondContact O-N 2.88Å; F399-R401 VanDerWaalsContact C-N 3.3Å; F399-R401 PolarHBondContact O-N 2.93Å |
| 402 | Y | 88.8 | Confident | 86 | Confident | 97 Ų | 97 | 74.9 Ų | 74.9 | 38% | 0.38 | 35% | 0.349 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -118.3 | 69.1 | 178.3 | -64.1 | -71.6 | 0 | 0 | 0 | 110.2 | F398 F399 L400 W404 L405 | F398-Y402 HydrophobicContact CD2-CD2 4.11Å; F398-Y402 HydrophobicContact CD2-CE2 4.04Å; F398-Y402 HydrophobicContact CE1-CD2 4.24Å; F398-Y402 AromaticContact CE2-CD2 3.74Å; F398-Y402 HydrophobicContact CE2-CD2 3.74Å; F398-Y402 AromaticContact CE2-CE2 3.52Å; F398-Y402 HydrophobicContact CE2-CE2 3.52Å; F398-Y402 AromaticContact CZ-CD2 3.81Å; F398-Y402 HydrophobicContact CZ-CD2 3.81Å; F398-Y402 AromaticContact CZ-CE2 3.94Å; F398-Y402 HydrophobicContact CZ-CE2 3.94Å; F398-Y402 PolarHBondContact O-N 3.05Å; F398-Y402 VanDerWaalsContact O-N 3.15Å; F399-Y402 CarbonylContact O-C 3.49Å; F399-Y402 PolarHBondContact O-N 2.92Å; F399-Y402 VanDerWaalsContact O-O 3.11Å; L400-Y402 VanDerWaalsContact C-N 3.32Å; Y402-W404 AromaticContact CD1-NE1 3.93Å; Y402-W404 PolarHBondContact O-N 3Å; Y402-L405 WeakPolarHBondContact O-CB 3.17Å; Y402-L405 PolarHBondContact O-N 3.4Å |
| 403 | S | 81.2 | Confident | 86 | Confident | 54 Ų | 54 | 72.9 Ų | 72.9 | 38% | 0.378 | 34% | 0.338 | S | S | . | . | G | 310 helix | trans | -56.3 | -25.3 | -172.9 | 56.6 | 0 | 0 | 0 | 0 | 114.3 | F399 L405 T406 | F399-S403 PolarHBondContact O-N 2.69Å; S403-L405 PolarHBondContact O-N 3.36Å; S403-L405 VanDerWaalsContact O-N 3.16Å; S403-T406 PolarHBondContact O-N 2.9Å; S403-T406 PolarHBondContact O-OG1 3.17Å |
| 404 | W | 87.4 | Confident | 86.1 | Confident | 167 Ų | 167 | 74.2 Ų | 74.2 | 63% | 0.633 | 34% | 0.34 | S | S | * | . | G | 310 helix | trans | -58.3 | -26.6 | 173.2 | 70.9 | -92.5 | 0 | 0 | 0 | 113.2 | Y402 Y407 | Y402-W404 AromaticContact CD1-NE1 3.93Å; Y402-W404 PolarHBondContact O-N 3Å; W404-Y407 WeakPolarHBondContact O-CD2 3.3Å; W404-Y407 PolarHBondContact O-N 3.24Å |
| 405 | L | 85.3 | Confident | 86 | Confident | 24 Ų | 24 | 75 Ų | 75 | 13% | 0.126 | 34% | 0.338 | C | S | . | . | G | 310 helix | trans | -70.6 | -29.1 | 175.3 | -70 | 173.7 | 0 | 0 | 0 | 112.7 | F398 F399 Y402 S403 Y407 L408 I411 | F398-L405 HydrophobicContact CD1-CD1 4.5Å; F398-L405 HydrophobicContact CE1-CD1 3.8Å; F399-L405 HydrophobicContact CD1-CB 4.06Å; F399-L405 HydrophobicContact CD1-CD1 3.95Å; F399-L405 HydrophobicContact CE1-CD1 4.2Å; Y402-L405 WeakPolarHBondContact O-CB 3.17Å; Y402-L405 PolarHBondContact O-N 3.4Å; S403-L405 PolarHBondContact O-N 3.36Å; S403-L405 VanDerWaalsContact O-N 3.16Å; L405-Y407 PolarHBondContact O-N 2.98Å; L405-Y407 VanDerWaalsContact O-N 3.17Å; L405-L408 HydrophobicContact CD2-CD1 3.95Å; L405-L408 VanDerWaalsContact O-CB 3.28Å; L405-L408 WeakPolarHBondContact O-CB 3.43Å; L405-L408 PolarHBondContact O-N 2.82Å; L405-I411 HydrophobicContact CB-CD1 3.93Å; L405-I411 VanDerWaalsContact O-CD1 3.28Å; L405-I411 WeakPolarHBondContact O-CD1 3.37Å |
| 406 | T | 83.1 | Confident | 85.8 | Confident | 17 Ų | 17 | 75.2 Ų | 75.2 | 10% | 0.104 | 34% | 0.337 | C | S | . | . | G | 310 helix | trans | -70.4 | -7.9 | 178.7 | 65.3 | 0 | 0 | 0 | 0 | 113.6 | F399 S403 L408 I411 E414 I417 | F399-T406 HydrophobicContact CB-CG2 4.2Å; S403-T406 PolarHBondContact O-N 2.9Å; S403-T406 PolarHBondContact O-OG1 3.17Å; T406-L408 VanDerWaalsContact C-N 3.29Å; T406-I411 HydrophobicContact CG2-CG2 4.17Å; T406-E414 HydrophobicContact CG2-CB 4.47Å; T406-I417 HydrophobicContact CG2-CD1 3.9Å |
| 407 | Y | 83.3 | Confident | 85.6 | Confident | 195 Ų | 195 | 75.2 Ų | 75.2 | 77% | 0.765 | 34% | 0.337 | S | S | * | . | G | 310 helix | trans | -78.8 | -14.1 | 168.7 | -67.3 | -87.3 | 0 | 0 | 0 | 112.7 | W404 L405 | W404-Y407 WeakPolarHBondContact O-CD2 3.3Å; W404-Y407 PolarHBondContact O-N 3.24Å; L405-Y407 PolarHBondContact O-N 2.98Å; L405-Y407 VanDerWaalsContact O-N 3.17Å |
| 408 | L | 86.4 | Confident | 85.5 | Confident | 63 Ų | 63 | 75.7 Ų | 75.7 | 33% | 0.33 | 33% | 0.334 | S | S | . | . | S | Bend | trans | -70 | 129.8 | 176 | -68.2 | 174.1 | 0 | 0 | 0 | 109.7 | L405 T406 V410 I411 | L405-L408 HydrophobicContact CD2-CD1 3.95Å; L405-L408 VanDerWaalsContact O-CB 3.28Å; L405-L408 WeakPolarHBondContact O-CB 3.43Å; L405-L408 PolarHBondContact O-N 2.82Å; T406-L408 VanDerWaalsContact C-N 3.29Å; L408-V410 PolarHBondContact O-N 3.16Å; L408-I411 HydrophobicContact CB-CD1 4.3Å; L408-I411 HydrophobicContact CD1-CD1 4.16Å; L408-I411 PolarHBondContact O-N 2.99Å |
| 409 | P | 85.1 | Confident | 85.2 | Confident | 45 Ų | 45 | 76 Ų | 76 | 29% | 0.292 | 34% | 0.337 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.6 | -8.9 | -179.7 | -27.4 | 34.5 | 0 | 0 | 0 | 116.5 | F20 S199 N202 | F20-P409 VanDerWaalsContact O-CD 3.28Å; F20-P409 WeakPolarHBondContact O-CD 3.37Å; F20-P409 WeakPolarHBondContact O-CG 3.42Å; S199-P409 VanDerWaalsContact CA-O 3.3Å; S199-P409 WeakPolarHBondContact CA-O 3.48Å; N202-P409 WeakPolarHBondContact CB-O 3.46Å; N202-P409 PolarHBondContact ND2-O 3.08Å |
| 410 | V | 86.7 | Confident | 84.8 | Confident | 13 Ų | 13 | 76 Ų | 76 | 8% | 0.079 | 34% | 0.337 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -90.7 | -21.1 | -179.6 | 171 | 0 | 0 | 0 | 0 | 111.8 | G19 F20 N202 R203 V206 L408 | G19-V410 WeakPolarHBondContact O-CG2 3.19Å; F20-V410 HydrophobicContact CD1-CG2 3.79Å; F20-V410 HydrophobicContact CE1-CG2 4.19Å; F20-V410 HydrophobicContact CG-CG2 4.44Å; N202-V410 HydrophobicContact CB-CG2 4.22Å; R203-V410 HydrophobicContact CB-CG1 3.7Å; R203-V410 HydrophobicContact CG-CG1 3.74Å; R203-V410 PolarHBondContact NH1-O 3.17Å; V206-V410 HydrophobicContact CG2-CG2 3.82Å; L408-V410 PolarHBondContact O-N 3.16Å |
| 411 | I | 86.3 | Confident | 84.5 | Confident | 20 Ų | 20 | 75.3 Ų | 75.3 | 10% | 0.103 | 33% | 0.333 | C | S | . | . | S | Bend | trans | -103 | 140 | -175.6 | -63.4 | 172.4 | 0 | 0 | 0 | 108.1 | F399 L405 T406 L408 I417 | F399-I411 HydrophobicContact CB-CG2 4.46Å; F399-I411 HydrophobicContact CD1-CD1 3.74Å; F399-I411 HydrophobicContact CD1-CG2 4.31Å; F399-I411 HydrophobicContact CD2-CG2 4.17Å; F399-I411 HydrophobicContact CE1-CD1 3.41Å; F399-I411 VanDerWaalsContact CE1-CD1 3.41Å; F399-I411 HydrophobicContact CE1-CG1 4.21Å; F399-I411 HydrophobicContact CG-CG2 4.07Å; F399-I411 HydrophobicContact CZ-CD1 3.92Å; F399-I411 HydrophobicContact CZ-CG1 4.25Å; L405-I411 HydrophobicContact CB-CD1 3.93Å; L405-I411 VanDerWaalsContact O-CD1 3.28Å; L405-I411 WeakPolarHBondContact O-CD1 3.37Å; T406-I411 HydrophobicContact CG2-CG2 4.17Å; L408-I411 HydrophobicContact CB-CD1 4.3Å; L408-I411 HydrophobicContact CD1-CD1 4.16Å; L408-I411 PolarHBondContact O-N 2.99Å; I411-I417 HydrophobicContact CG2-CD1 4.18Å |
| 412 | P | 83.8 | Confident | 84 | Confident | 8 Ų | 8 | 72 Ų | 72 | 5% | 0.052 | 33% | 0.325 | C | S | . | . | P | Polyproline II helix | trans | -60.9 | 157 | 174.1 | -18.4 | 31 | 0 | 0 | 0 | 111.6 | L391 E416 I417 | L391-P412 HydrophobicContact CD1-CG 4.15Å; P412-E416 HydrophobicContact CB-CB 4.28Å; P412-E416 WeakPolarHBondContact CB-OE2 3.42Å; P412-I417 HydrophobicContact CB-CD1 4.43Å; P412-I417 HydrophobicContact CB-CG1 3.94Å; P412-I417 HydrophobicContact CG-CG1 4.45Å |
| 413 | S | 85.1 | Confident | 83.4 | Confident | 45 Ų | 45 | 73.5 Ų | 73.5 | 32% | 0.315 | 33% | 0.334 | S | S | . | . | P | Polyproline II helix | trans | -64.7 | 152.8 | 179.9 | 70.4 | 0 | 0 | 0 | 0 | 111.4 | R415 E416 I417 | S413-R415 PolarHBondContact O-N 3.26Å; S413-R415 VanDerWaalsContact O-N 3.16Å; S413-E416 PolarHBondContact N-OE2 3.24Å; S413-E416 WeakPolarHBondContact O-CB 3.33Å; S413-E416 PolarHBondContact O-N 3.38Å; S413-E416 VanDerWaalsContact O-N 3.11Å; S413-E416 VanDerWaalsContact OG-CG 3.26Å; S413-E416 WeakPolarHBondContact OG-CG 3.41Å; S413-E416 PolarHBondContact OG-N 3.49Å; S413-E416 PolarHBondContact OG-OE1 3.24Å; S413-I417 WeakPolarHBondContact O-CG1 3.28Å; S413-I417 PolarHBondContact O-N 3.08Å |
| 414 | E | 85 | Confident | 83 | Confident | 59 Ų | 59 | 72.2 Ų | 72.2 | 28% | 0.276 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -55.6 | -36.7 | 179.7 | -166.8 | -173.6 | 158.3 | 0 | 0 | 112.1 | L400 T406 I417 R418 | L400-E414 HydrophobicContact CD2-CG 3.66Å; T406-E414 HydrophobicContact CG2-CB 4.47Å; E414-I417 PolarHBondContact O-N 3.05Å; E414-R418 WeakPolarHBondContact O-CG 3.41Å; E414-R418 PolarHBondContact O-N 3.08Å; E414-R418 IonicContact OE1-CZ 3.39Å; E414-R418 VanDerWaalsContact OE1-CZ 3.26Å; E414-R418 IonicContact OE1-NE 2.76Å; E414-R418 PolarHBondContact OE1-NE 3.5Å; E414-R418 IonicContact OE1-NH2 3.21Å; E414-R418 PolarHBondContact OE1-NH2 2.92Å |
| 415 | R | 84.6 | Confident | 82.2 | Confident | 202 Ų | 202 | 68.1 Ų | 68.1 | 76% | 0.762 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -63.3 | -50.7 | 176.3 | -66.2 | -177.1 | -178.1 | 177 | -0.5 | 111.5 | S413 I417 R418 E419 | S413-R415 PolarHBondContact O-N 3.26Å; S413-R415 VanDerWaalsContact O-N 3.16Å; R415-I417 VanDerWaalsContact C-N 3.3Å; R415-I417 PolarHBondContact O-N 3.47Å; R415-R418 PolarHBondContact O-N 3.05Å; R415-E419 WeakPolarHBondContact O-CG 3.47Å; R415-E419 PolarHBondContact O-N 3.01Å |
| 416 | E | 81.3 | Confident | 81.5 | Confident | 81 Ų | 81 | 71.9 Ų | 71.9 | 38% | 0.379 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -57.2 | -43.1 | 176.3 | -76.5 | 157.9 | -133.3 | 0 | 0 | 111.7 | P412 S413 E419 I420 | P412-E416 HydrophobicContact CB-CB 4.28Å; P412-E416 WeakPolarHBondContact CB-OE2 3.42Å; S413-E416 PolarHBondContact N-OE2 3.24Å; S413-E416 WeakPolarHBondContact O-CB 3.33Å; S413-E416 PolarHBondContact O-N 3.38Å; S413-E416 VanDerWaalsContact O-N 3.11Å; S413-E416 VanDerWaalsContact OG-CG 3.26Å; S413-E416 WeakPolarHBondContact OG-CG 3.41Å; S413-E416 PolarHBondContact OG-N 3.49Å; S413-E416 PolarHBondContact OG-OE1 3.24Å; E416-E419 PolarHBondContact O-N 2.91Å; E416-I420 WeakPolarHBondContact O-CB 3.26Å; E416-I420 WeakPolarHBondContact O-CD1 3.33Å; E416-I420 WeakPolarHBondContact O-CG1 3.47Å; E416-I420 PolarHBondContact O-N 3.19Å |
| 417 | I | 83.6 | Confident | 80.6 | Confident | 0 Ų | 0 | 73.8 Ų | 73.8 | 0% | 0 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -64.2 | -43.4 | 179.4 | -62.6 | 173.8 | 0 | 0 | 0 | 110.8 | N396 F399 L400 T406 I411 P412 S413 E414 R415 I420 E421 | N396-I417 HydrophobicContact CB-CG2 3.63Å; F399-I417 HydrophobicContact CB-CD1 4.08Å; L400-I417 HydrophobicContact CD1-CG2 3.98Å; L400-I417 HydrophobicContact CD2-CB 4.16Å; L400-I417 HydrophobicContact CD2-CG2 3.89Å; L400-I417 HydrophobicContact CG-CG2 3.77Å; T406-I417 HydrophobicContact CG2-CD1 3.9Å; I411-I417 HydrophobicContact CG2-CD1 4.18Å; P412-I417 HydrophobicContact CB-CD1 4.43Å; P412-I417 HydrophobicContact CB-CG1 3.94Å; P412-I417 HydrophobicContact CG-CG1 4.45Å; S413-I417 WeakPolarHBondContact O-CG1 3.28Å; S413-I417 PolarHBondContact O-N 3.08Å; E414-I417 PolarHBondContact O-N 3.05Å; R415-I417 VanDerWaalsContact C-N 3.3Å; R415-I417 PolarHBondContact O-N 3.47Å; I417-I420 PolarHBondContact O-N 3.26Å; I417-E421 WeakPolarHBondContact O-CG 3.34Å; I417-E421 PolarHBondContact O-N 3.36Å |
| 418 | R | 83.6 | Confident | 79.8 | Confident | 132 Ų | 132 | 70.3 Ų | 70.3 | 50% | 0.498 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -64.1 | -44.7 | 177.4 | -73.7 | 175.9 | -178.9 | -115.6 | 5.4 | 111.6 | L400 E414 R415 I420 E421 E422 | L400-R418 HydrophobicContact CD1-CG 4.34Å; L400-R418 HydrophobicContact CD2-CG 3.86Å; E414-R418 WeakPolarHBondContact O-CG 3.41Å; E414-R418 PolarHBondContact O-N 3.08Å; E414-R418 IonicContact OE1-CZ 3.39Å; E414-R418 VanDerWaalsContact OE1-CZ 3.26Å; E414-R418 IonicContact OE1-NE 2.76Å; E414-R418 PolarHBondContact OE1-NE 3.5Å; E414-R418 IonicContact OE1-NH2 3.21Å; E414-R418 PolarHBondContact OE1-NH2 2.92Å; R415-R418 PolarHBondContact O-N 3.05Å; R418-I420 VanDerWaalsContact C-N 3.34Å; R418-I420 PolarHBondContact O-N 3.47Å; R418-E421 PolarHBondContact O-N 3.42Å; R418-E422 WeakPolarHBondContact O-CB 3.09Å; R418-E422 WeakPolarHBondContact O-CG 3.3Å; R418-E422 PolarHBondContact O-N 3.39Å |
| 419 | E | 82.4 | Confident | 78.8 | Confident | 106 Ų | 106 | 74.6 Ų | 74.6 | 50% | 0.495 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -60.2 | -42.6 | 176.2 | -74.3 | 173.4 | -162.3 | 0 | 0 | 112 | R415 E416 K423 | R415-E419 WeakPolarHBondContact O-CG 3.47Å; R415-E419 PolarHBondContact O-N 3.01Å; E416-E419 PolarHBondContact O-N 2.91Å; E419-K423 WeakPolarHBondContact O-CB 3.27Å; E419-K423 VanDerWaalsContact O-CG 3.26Å; E419-K423 WeakPolarHBondContact O-CG 3.3Å; E419-K423 PolarHBondContact O-N 2.92Å |
| 420 | I | 80.6 | Confident | 77.9 | Confident | 26 Ų | 26 | 76.8 Ų | 76.8 | 13% | 0.133 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -62.7 | -46.8 | 176.1 | -69.7 | 165.4 | 0 | 0 | 0 | 110.6 | V384 A390 E416 I417 R418 K423 L424 | V384-I420 HydrophobicContact CG1-CG2 4.03Å; A390-I420 HydrophobicContact CB-CG2 4.02Å; E416-I420 WeakPolarHBondContact O-CB 3.26Å; E416-I420 WeakPolarHBondContact O-CD1 3.33Å; E416-I420 WeakPolarHBondContact O-CG1 3.47Å; E416-I420 PolarHBondContact O-N 3.19Å; I417-I420 PolarHBondContact O-N 3.26Å; R418-I420 VanDerWaalsContact C-N 3.34Å; R418-I420 PolarHBondContact O-N 3.47Å; I420-K423 PolarHBondContact O-N 3.45Å; I420-L424 HydrophobicContact CG2-CD1 4.03Å; I420-L424 WeakPolarHBondContact O-CB 3.23Å; I420-L424 VanDerWaalsContact O-CG 3.32Å; I420-L424 WeakPolarHBondContact O-CG 3.35Å; I420-L424 PolarHBondContact O-N 3.35Å |
| 421 | E | 80.8 | Confident | 76.9 | Confident | 35 Ų | 35 | 81.4 Ų | 81.4 | 16% | 0.164 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -67.7 | -38.6 | -179.8 | -74.9 | -66.6 | 135.4 | 0 | 0 | 112.9 | S393 N396 I417 R418 L424 C425 | S393-E421 VanDerWaalsContact CA-OE1 3.23Å; S393-E421 WeakPolarHBondContact CA-OE1 3.41Å; S393-E421 VanDerWaalsContact CB-OE1 3.31Å; S393-E421 WeakPolarHBondContact CB-OE1 3.41Å; S393-E421 PolarHBondContact OG-OE1 2.92Å; S393-E421 VanDerWaalsContact OG-OE1 3.05Å; N396-E421 HydrophobicContact CB-CG 3.91Å; N396-E421 WeakPolarHBondContact CB-OE1 3.46Å; N396-E421 PolarHBondContact ND2-OE1 3.48Å; I417-E421 WeakPolarHBondContact O-CG 3.34Å; I417-E421 PolarHBondContact O-N 3.36Å; R418-E421 PolarHBondContact O-N 3.42Å; E421-L424 PolarHBondContact O-N 2.71Å; E421-C425 WeakPolarHBondContact O-CB 3.42Å; E421-C425 PolarHBondContact O-N 3.09Å |
| 422 | E | 80.6 | Confident | 75.8 | Confident | 122 Ų | 122 | 85.1 Ų | 85.1 | 57% | 0.57 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -61.5 | -47.9 | 174.5 | -78.6 | 177.9 | -170.1 | 0 | 0 | 111.2 | R418 L424 C425 N426 | R418-E422 WeakPolarHBondContact O-CB 3.09Å; R418-E422 WeakPolarHBondContact O-CG 3.3Å; R418-E422 PolarHBondContact O-N 3.39Å; E422-L424 VanDerWaalsContact C-N 3.33Å; E422-L424 PolarHBondContact O-N 3.16Å; E422-C425 PolarHBondContact O-N 3.45Å; E422-N426 PolarHBondContact O-N 3.04Å |
| 423 | K | 76 | Confident | 74.7 | Confident | 129 Ų | 129 | 87.2 Ų | 87.2 | 56% | 0.561 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -64.9 | -36.5 | 176.9 | -64.4 | 175.9 | 175.5 | -177.9 | 0 | 111.5 | V384 E419 I420 F427 | V384-K423 HydrophobicContact CB-CB 4.45Å; V384-K423 HydrophobicContact CG2-CB 3.09Å; V384-K423 HydrophobicContact CG2-CD 4.06Å; V384-K423 HydrophobicContact CG2-CG 4.18Å; E419-K423 WeakPolarHBondContact O-CB 3.27Å; E419-K423 VanDerWaalsContact O-CG 3.26Å; E419-K423 WeakPolarHBondContact O-CG 3.3Å; E419-K423 PolarHBondContact O-N 2.92Å; I420-K423 PolarHBondContact O-N 3.45Å; K423-F427 WeakPolarHBondContact O-CB 3.38Å; K423-F427 PolarHBondContact O-N 3Å |
| 424 | L | 72.9 | Confident | 73.6 | Confident | 28 Ų | 28 | 91 Ų | 91 | 15% | 0.147 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -63.2 | -39.4 | 173.3 | -79.3 | 170 | 0 | 0 | 0 | 112.4 | V384 I420 E421 E422 K428 | V384-L424 HydrophobicContact CB-CD2 3.9Å; V384-L424 HydrophobicContact CB-CG 4.16Å; V384-L424 HydrophobicContact CG1-CD1 4.34Å; V384-L424 HydrophobicContact CG1-CD2 3.59Å; V384-L424 HydrophobicContact CG1-CG 3.52Å; I420-L424 HydrophobicContact CG2-CD1 4.03Å; I420-L424 WeakPolarHBondContact O-CB 3.23Å; I420-L424 VanDerWaalsContact O-CG 3.32Å; I420-L424 WeakPolarHBondContact O-CG 3.35Å; I420-L424 PolarHBondContact O-N 3.35Å; E421-L424 PolarHBondContact O-N 2.71Å; E422-L424 VanDerWaalsContact C-N 3.33Å; E422-L424 PolarHBondContact O-N 3.16Å; L424-K428 WeakPolarHBondContact O-CG 3.22Å; L424-K428 PolarHBondContact O-N 3.39Å; L424-K428 VanDerWaalsContact O-N 3.08Å |
| 425 | C | 70.4 | Confident | 72.2 | Confident | 81 Ų | 81 | 90.8 Ų | 90.8 | 55% | 0.547 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -67.4 | -47.5 | 179.2 | -163 | 0 | 0 | 0 | 0 | 111 | E421 E422 F427 K428 F429 | E421-C425 WeakPolarHBondContact O-CB 3.42Å; E421-C425 PolarHBondContact O-N 3.09Å; E422-C425 PolarHBondContact O-N 3.45Å; C425-F427 VanDerWaalsContact C-N 3.31Å; C425-F427 PolarHBondContact O-N 2.95Å; C425-K428 PolarHBondContact O-N 3.19Å; C425-F429 PolarHBondContact O-N 3.29Å |
| 426 | N | 69.6 | Low | 70.9 | Confident | 103 Ų | 103 | 85.9 Ų | 85.9 | 55% | 0.551 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -59.1 | -42.4 | 176.4 | -72 | -15.9 | 0 | 0 | 0 | 111.6 | E422 F429 I430 | E422-N426 PolarHBondContact O-N 3.04Å; N426-F429 WeakPolarHBondContact O-CB 3.44Å; N426-F429 PolarHBondContact O-N 3.3Å; N426-I430 WeakPolarHBondContact O-CG1 3.25Å; N426-I430 PolarHBondContact O-N 2.83Å |
| 427 | F | 65.2 | Low | 69.5 | Low | 56 Ų | 56 | 88.5 Ų | 88.5 | 25% | 0.246 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -63.5 | -45.2 | 176.9 | -173.9 | -96.4 | 0 | 0 | 0 | 112.9 | T383 E385 K423 C425 F429 I430 K431 | T383-F427 HydrophobicContact CG2-CE2 4.11Å; E385-F427 HydrophobicContact CG-CD1 4.33Å; E385-F427 HydrophobicContact CG-CE1 3.99Å; E385-F427 WeakPolarHBondContact OE1-CE1 3.43Å; K423-F427 WeakPolarHBondContact O-CB 3.38Å; K423-F427 PolarHBondContact O-N 3Å; C425-F427 VanDerWaalsContact C-N 3.31Å; C425-F427 PolarHBondContact O-N 2.95Å; F427-F429 VanDerWaalsContact C-N 3.26Å; F427-F429 PolarHBondContact O-N 3.42Å; F427-I430 PolarHBondContact O-N 3.44Å; F427-K431 HydrophobicContact CE1-CD 4.23Å; F427-K431 WeakPolarHBondContact O-CB 3.34Å; F427-K431 PolarHBondContact O-N 3.36Å |
| 428 | K | 66.8 | Low | 67.9 | Low | 122 Ų | 122 | 91.7 Ų | 91.7 | 53% | 0.53 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -61.1 | -36.6 | 174.9 | -76.7 | 176.8 | -178.6 | 171.5 | 0 | 112 | L424 C425 N432 | L424-K428 WeakPolarHBondContact O-CG 3.22Å; L424-K428 PolarHBondContact O-N 3.39Å; L424-K428 VanDerWaalsContact O-N 3.08Å; C425-K428 PolarHBondContact O-N 3.19Å; K428-N432 VanDerWaalsContact O-CB 3.3Å; K428-N432 WeakPolarHBondContact O-CB 3.47Å; K428-N432 PolarHBondContact O-N 3.21Å; K428-N432 PolarHBondContact O-ND2 3.19Å |
| 429 | F | 65.3 | Low | 66.4 | Low | 154 Ų | 154 | 90.7 Ų | 90.7 | 68% | 0.675 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -64.1 | -46.9 | 176.9 | -157.7 | -86.9 | 0 | 0 | 0 | 111.4 | C425 N426 F427 N432 S433 | C425-F429 PolarHBondContact O-N 3.29Å; N426-F429 WeakPolarHBondContact O-CB 3.44Å; N426-F429 PolarHBondContact O-N 3.3Å; F427-F429 VanDerWaalsContact C-N 3.26Å; F427-F429 PolarHBondContact O-N 3.42Å; F429-N432 PolarHBondContact O-N 3.07Å; F429-S433 PolarHBondContact O-N 2.95Å; F429-S433 PolarHBondContact O-OG 3.12Å |
| 430 | I | 66 | Low | 64.8 | Low | 90 Ų | 90 | 93.8 Ų | 93.8 | 46% | 0.462 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -61.1 | -49.2 | 177.5 | -66.2 | 163.8 | 0 | 0 | 0 | 111.2 | N426 F427 N432 S433 E434 | N426-I430 WeakPolarHBondContact O-CG1 3.25Å; N426-I430 PolarHBondContact O-N 2.83Å; F427-I430 PolarHBondContact O-N 3.44Å; I430-N432 VanDerWaalsContact C-N 3.29Å; I430-N432 PolarHBondContact O-N 2.59Å; I430-S433 VanDerWaalsContact CA-OG 3.3Å; I430-S433 WeakPolarHBondContact CA-OG 3.38Å; I430-S433 PolarHBondContact O-N 3.46Å; I430-S433 VanDerWaalsContact O-N 3.09Å; I430-S433 PolarHBondContact O-OG 3.1Å; I430-E434 PolarHBondContact O-N 3.17Å |
| 431 | K | 64.8 | Low | 63.2 | Low | 111 Ų | 111 | 101.6 Ų | 101.6 | 48% | 0.483 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.9 | -39 | 179.1 | -168.2 | 173.3 | -173.9 | 168.5 | 0 | 112.1 | F427 S435 | F427-K431 HydrophobicContact CE1-CD 4.23Å; F427-K431 WeakPolarHBondContact O-CB 3.34Å; F427-K431 PolarHBondContact O-N 3.36Å; K431-S435 WeakPolarHBondContact O-CB 3.28Å; K431-S435 PolarHBondContact O-N 3.39Å |
| 432 | N | 63.7 | Low | 61.3 | Low | 97 Ų | 97 | 108.7 Ų | 108.7 | 52% | 0.519 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -68 | -40.4 | 174.6 | -74.4 | -13.5 | 0 | 0 | 0 | 111.4 | K428 F429 I430 S435 I436 | K428-N432 VanDerWaalsContact O-CB 3.3Å; K428-N432 WeakPolarHBondContact O-CB 3.47Å; K428-N432 PolarHBondContact O-N 3.21Å; K428-N432 PolarHBondContact O-ND2 3.19Å; F429-N432 PolarHBondContact O-N 3.07Å; I430-N432 VanDerWaalsContact C-N 3.29Å; I430-N432 PolarHBondContact O-N 2.59Å; N432-S435 WeakPolarHBondContact CA-OG 3.3Å; N432-S435 PolarHBondContact O-N 3.47Å; N432-S435 PolarHBondContact O-OG 2.95Å; N432-I436 WeakPolarHBondContact O-CD1 2.98Å; N432-I436 WeakPolarHBondContact O-CG1 3.31Å; N432-I436 PolarHBondContact O-N 3.37Å |
| 433 | S | 59.7 | Low | 60.4 | Low | 52 Ų | 52 | 108 Ų | 108 | 36% | 0.364 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -64.7 | -40 | 175.6 | 50.7 | 0 | 0 | 0 | 0 | 113.5 | F429 I430 I436 E437 | F429-S433 PolarHBondContact O-N 2.95Å; F429-S433 PolarHBondContact O-OG 3.12Å; I430-S433 VanDerWaalsContact CA-OG 3.3Å; I430-S433 WeakPolarHBondContact CA-OG 3.38Å; I430-S433 PolarHBondContact O-N 3.46Å; I430-S433 VanDerWaalsContact O-N 3.09Å; I430-S433 PolarHBondContact O-OG 3.1Å; S433-I436 PolarHBondContact O-N 2.97Å; S433-I436 VanDerWaalsContact O-N 3.16Å; S433-E437 PolarHBondContact O-N 3.39Å |
| 434 | E | 62.1 | Low | 59.6 | Low | 125 Ų | 125 | 106.9 Ų | 106.9 | 58% | 0.584 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -67.3 | -35.7 | 175.3 | -71.2 | 179.9 | 164.2 | 0 | 0 | 112 | I430 I436 E437 S438 | I430-E434 PolarHBondContact O-N 3.17Å; E434-I436 VanDerWaalsContact C-N 3.28Å; E434-I436 PolarHBondContact O-N 3Å; E434-E437 PolarHBondContact O-N 2.96Å; E434-S438 WeakPolarHBondContact O-CB 3.29Å; E434-S438 PolarHBondContact O-N 3.34Å; E434-S438 PolarHBondContact O-OG 3.45Å |
| 435 | S | 56.6 | Low | 58.8 | Low | 55 Ų | 55 | 111.3 Ų | 111.3 | 39% | 0.385 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -66.4 | -30.9 | 172.6 | 78 | 0 | 0 | 0 | 0 | 112.4 | K431 N432 S438 V439 | K431-S435 WeakPolarHBondContact O-CB 3.28Å; K431-S435 PolarHBondContact O-N 3.39Å; N432-S435 WeakPolarHBondContact CA-OG 3.3Å; N432-S435 PolarHBondContact O-N 3.47Å; N432-S435 PolarHBondContact O-OG 2.95Å; S435-S438 WeakPolarHBondContact CA-OG 3.19Å; S435-S438 PolarHBondContact O-OG 3.29Å; S435-S438 VanDerWaalsContact O-OG 3.05Å; S435-V439 WeakPolarHBondContact O-CG2 3.27Å; S435-V439 PolarHBondContact O-N 3.01Å |
| 436 | I | 56.3 | Low | 58.1 | Low | 98 Ų | 98 | 113.1 Ų | 113.1 | 50% | 0.503 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -79 | -36.8 | 178 | -67.7 | 162 | 0 | 0 | 0 | 110.9 | N432 S433 E434 V439 K440 | N432-I436 WeakPolarHBondContact O-CD1 2.98Å; N432-I436 WeakPolarHBondContact O-CG1 3.31Å; N432-I436 PolarHBondContact O-N 3.37Å; S433-I436 PolarHBondContact O-N 2.97Å; S433-I436 VanDerWaalsContact O-N 3.16Å; E434-I436 VanDerWaalsContact C-N 3.28Å; E434-I436 PolarHBondContact O-N 3Å; I436-V439 PolarHBondContact O-N 3.1Å; I436-K440 PolarHBondContact O-N 3.49Å |
| 437 | E | 53.1 | Low | 57.4 | Low | 136 Ų | 136 | 113.7 Ų | 113.7 | 64% | 0.636 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -70.1 | -34.9 | 174.5 | -82 | -170 | 158.1 | 0 | 0 | 113.4 | S433 E434 V439 K440 K441 | S433-E437 PolarHBondContact O-N 3.39Å; E434-E437 PolarHBondContact O-N 2.96Å; E437-V439 VanDerWaalsContact C-N 3.34Å; E437-K440 PolarHBondContact O-N 2.76Å; E437-K441 PolarHBondContact O-N 2.88Å |
| 438 | S | 49.7 | Very low | 56.9 | Low | 68 Ų | 68 | 117.5 Ų | 117.5 | 48% | 0.476 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -69.2 | -30.9 | 174.1 | 48.8 | 0 | 0 | 0 | 0 | 112.7 | E434 S435 K441 | E434-S438 WeakPolarHBondContact O-CB 3.29Å; E434-S438 PolarHBondContact O-N 3.34Å; E434-S438 PolarHBondContact O-OG 3.45Å; S435-S438 WeakPolarHBondContact CA-OG 3.19Å; S435-S438 PolarHBondContact O-OG 3.29Å; S435-S438 VanDerWaalsContact O-OG 3.05Å; S438-K441 PolarHBondContact O-N 2.92Å |
| 439 | V | 51.2 | Low | 56.2 | Low | 110 Ų | 110 | 117.2 Ų | 117.2 | 67% | 0.667 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -74.3 | -23.6 | 172.2 | 173.1 | 0 | 0 | 0 | 0 | 112.5 | S435 I436 E437 | S435-V439 WeakPolarHBondContact O-CG2 3.27Å; S435-V439 PolarHBondContact O-N 3.01Å; I436-V439 PolarHBondContact O-N 3.1Å; E437-V439 VanDerWaalsContact C-N 3.34Å |
| 440 | K | 49.5 | Very low | 55.5 | Low | 171 Ų | 171 | 114.4 Ų | 114.4 | 74% | 0.743 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.6 | -7.1 | 173.8 | -78.2 | -178.3 | 176.3 | 179.2 | 0 | 114.4 | I436 E437 | I436-K440 PolarHBondContact O-N 3.49Å; E437-K440 PolarHBondContact O-N 2.76Å |
| 441 | K | 48.1 | Very low | 54.6 | Low | 191 Ų | 191 | 116.4 Ų | 116.4 | 83% | 0.83 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.5 | 7.7 | 177.9 | -83.9 | -174.7 | 177.6 | 173.8 | 0 | 114 | E437 S438 | E437-K441 PolarHBondContact O-N 2.88Å; S438-K441 PolarHBondContact O-N 2.92Å |
| 442 | V | 40.8 | Very low | 53.7 | Low | 183 Ų | 183 | 116.9 Ų | 116.9 | 100% | 1.109 | 62% | 0.619 | S | S | * | * | trans | -112.1 | 0 | 168.6 | -176 | 0 | 0 | 0 | 0 | 107.6 |
Retrieved 442 of 442 residues in 196.8 ms
(Link to these results)