| 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 | 49.5 | Very low | 58.7 | Low | 178 Ų | 178 | 94.3 Ų | 94.3 | 88% | 0.877 | 50% | 0.499 | S | S | * | . | 0 | -49.6 | 0 | -77.3 | -167 | 93.3 | 0 | 0 | 113.1 | T3 T4 L5 | M1-T3 VanDerWaalsContact C-N 3.34Å; M1-T3 PolarHBondContact O-N 3.21Å; M1-T4 WeakPolarHBondContact CA-OG1 3.42Å; M1-T4 PolarHBondContact O-N 2.89Å; M1-T4 PolarHBondContact O-OG1 3.09Å; M1-L5 HydrophobicContact CE-CD1 4.44Å; M1-L5 PolarHBondContact O-N 3.32Å | |||
| 2 | Y | 46.5 | Very low | 60.1 | Low | 110 Ų | 110 | 94 Ų | 94 | 43% | 0.431 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -56.5 | -46.1 | 178.9 | 179.9 | -106.9 | 0 | 0 | 0 | 113 | T4 L5 G6 A10 V11 T14 | Y2-T4 VanDerWaalsContact C-N 3.27Å; Y2-T4 PolarHBondContact O-N 3.2Å; Y2-L5 PolarHBondContact O-N 3.49Å; Y2-G6 PolarHBondContact O-N 3.05Å; Y2-G6 VanDerWaalsContact O-N 3.08Å; Y2-A10 PolarHBondContact OH-O 3.28Å; Y2-V11 HydrophobicContact CD1-CG2 4.31Å; Y2-V11 HydrophobicContact CE1-CB 4.19Å; Y2-V11 HydrophobicContact CE1-CG1 4.32Å; Y2-V11 HydrophobicContact CE1-CG2 3.63Å; Y2-V11 VanDerWaalsContact OH-CA 3.3Å; Y2-V11 WeakPolarHBondContact OH-CA 3.4Å; Y2-V11 PolarHBondContact OH-N 3.18Å; Y2-T14 WeakPolarHBondContact OH-CG2 3.5Å; Y2-T14 PolarHBondContact OH-OG1 3.49Å |
| 3 | T | 52.9 | Low | 61.6 | Low | 44 Ų | 44 | 101.6 Ų | 101.6 | 27% | 0.27 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -59.2 | -32.5 | 177 | -34.9 | 0 | 0 | 0 | 0 | 114.4 | M1 S180 N184 | M1-T3 VanDerWaalsContact C-N 3.34Å; M1-T3 PolarHBondContact O-N 3.21Å; T3-S180 WeakPolarHBondContact CB-OG 3.45Å; T3-S180 WeakPolarHBondContact CG2-OG 3.48Å; T3-S180 PolarHBondContact OG1-OG 2.89Å; T3-N184 WeakPolarHBondContact CG2-ND2 3.21Å; T3-N184 WeakPolarHBondContact CG2-OD1 3.49Å |
| 4 | T | 54.2 | Low | 62.9 | Low | 75 Ų | 75 | 97.9 Ų | 97.9 | 46% | 0.46 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -88.5 | -16.1 | -174 | 47.9 | 0 | 0 | 0 | 0 | 113.5 | M1 Y2 | M1-T4 WeakPolarHBondContact CA-OG1 3.42Å; M1-T4 PolarHBondContact O-N 2.89Å; M1-T4 PolarHBondContact O-OG1 3.09Å; Y2-T4 VanDerWaalsContact C-N 3.27Å; Y2-T4 PolarHBondContact O-N 3.2Å |
| 5 | L | 50.8 | Low | 64.1 | Low | 138 Ų | 138 | 93.4 Ų | 93.4 | 72% | 0.723 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -116.1 | -34.1 | -172.3 | -69.7 | 167.9 | 0 | 0 | 0 | 113.6 | M1 Y2 | M1-L5 HydrophobicContact CE-CD1 4.44Å; M1-L5 PolarHBondContact O-N 3.32Å; Y2-L5 PolarHBondContact O-N 3.49Å |
| 6 | G | 57.9 | Low | 65.4 | Low | 35 Ų | 35 | 92.1 Ų | 92.1 | 36% | 0.361 | 48% | 0.475 | S | S | . | . | S | Bend | trans | -84.7 | -19.5 | -172.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | Y2 A10 | Y2-G6 PolarHBondContact O-N 3.05Å; Y2-G6 VanDerWaalsContact O-N 3.08Å; G6-A10 WeakPolarHBondContact O-CB 3.35Å |
| 7 | G | 64.5 | Low | 66.6 | Low | 39 Ų | 39 | 94.8 Ų | 94.8 | 40% | 0.402 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | 67.5 | 162.1 | -172 | 0 | 0 | 0 | 0 | 0 | 113.4 | R9 A10 V11 | G7-R9 PolarHBondContact O-N 3.11Å; G7-R9 VanDerWaalsContact O-N 3.15Å; G7-A10 PolarHBondContact O-N 3.42Å; G7-V11 WeakPolarHBondContact O-CG2 3.42Å; G7-V11 PolarHBondContact O-N 3.41Å |
| 8 | M | 63.8 | Low | 67.7 | Low | 140 Ų | 140 | 90.5 Ų | 90.5 | 69% | 0.69 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -59.1 | -31.2 | -172.3 | -169 | -178.3 | -71.2 | 0 | 0 | 113.6 | I12 | M8-I12 HydrophobicContact CG-CD1 4.13Å; M8-I12 WeakPolarHBondContact O-CD1 3.31Å; M8-I12 VanDerWaalsContact O-CG1 3.24Å; M8-I12 WeakPolarHBondContact O-CG1 3.45Å; M8-I12 PolarHBondContact O-N 2.96Å; M8-I12 VanDerWaalsContact O-N 3.16Å |
| 9 | R | 67.6 | Low | 68.7 | Low | 214 Ų | 214 | 89.6 Ų | 89.6 | 81% | 0.808 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -70.1 | -39.4 | -179.9 | -71.6 | -173.7 | 178.9 | -177.3 | 1 | 113.7 | G7 V11 I12 W13 | G7-R9 PolarHBondContact O-N 3.11Å; G7-R9 VanDerWaalsContact O-N 3.15Å; R9-V11 VanDerWaalsContact C-N 3.33Å; R9-I12 PolarHBondContact O-N 3.46Å; R9-W13 PolarHBondContact O-N 3.22Å |
| 10 | A | 69.8 | Low | 69.8 | Low | 38 Ų | 38 | 89.7 Ų | 89.7 | 31% | 0.314 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -67.2 | -40.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | Y2 G6 G7 I12 W13 T14 | Y2-A10 PolarHBondContact OH-O 3.28Å; G6-A10 WeakPolarHBondContact O-CB 3.35Å; G7-A10 PolarHBondContact O-N 3.42Å; A10-I12 VanDerWaalsContact C-N 3.33Å; A10-I12 PolarHBondContact O-N 3.23Å; A10-W13 PolarHBondContact O-N 2.74Å; A10-T14 PolarHBondContact O-N 3.27Å; A10-T14 PolarHBondContact O-OG1 3.47Å |
| 11 | V | 68.4 | Low | 70.7 | Confident | 26 Ų | 26 | 86.2 Ų | 86.2 | 16% | 0.158 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -57.7 | -46.2 | 175.5 | -178.3 | 0 | 0 | 0 | 0 | 110.9 | Y2 G7 R9 W13 T14 D15 | Y2-V11 HydrophobicContact CD1-CG2 4.31Å; Y2-V11 HydrophobicContact CE1-CB 4.19Å; Y2-V11 HydrophobicContact CE1-CG1 4.32Å; Y2-V11 HydrophobicContact CE1-CG2 3.63Å; Y2-V11 VanDerWaalsContact OH-CA 3.3Å; Y2-V11 WeakPolarHBondContact OH-CA 3.4Å; Y2-V11 PolarHBondContact OH-N 3.18Å; G7-V11 WeakPolarHBondContact O-CG2 3.42Å; G7-V11 PolarHBondContact O-N 3.41Å; R9-V11 VanDerWaalsContact C-N 3.33Å; V11-W13 VanDerWaalsContact C-N 3.34Å; V11-W13 PolarHBondContact O-N 2.96Å; V11-T14 PolarHBondContact O-N 2.99Å; V11-T14 PolarHBondContact O-OG1 2.98Å; V11-D15 PolarHBondContact O-N 3.01Å |
| 12 | I | 75.8 | Confident | 72.7 | Confident | 91 Ų | 91 | 79.7 Ų | 79.7 | 47% | 0.467 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -61.2 | -43.4 | 178.8 | -68 | 162.8 | 0 | 0 | 0 | 111.2 | M8 R9 A10 D15 V16 | M8-I12 HydrophobicContact CG-CD1 4.13Å; M8-I12 WeakPolarHBondContact O-CD1 3.31Å; M8-I12 VanDerWaalsContact O-CG1 3.24Å; M8-I12 WeakPolarHBondContact O-CG1 3.45Å; M8-I12 PolarHBondContact O-N 2.96Å; M8-I12 VanDerWaalsContact O-N 3.16Å; R9-I12 PolarHBondContact O-N 3.46Å; A10-I12 VanDerWaalsContact C-N 3.33Å; A10-I12 PolarHBondContact O-N 3.23Å; I12-D15 PolarHBondContact O-N 3.41Å; I12-V16 WeakPolarHBondContact O-CG2 3.38Å; I12-V16 PolarHBondContact O-N 3.26Å |
| 13 | W | 78.8 | Confident | 74.8 | Confident | 193 Ų | 193 | 76.7 Ų | 76.7 | 73% | 0.731 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -67.2 | -37.1 | 179.7 | -88 | 106.3 | 0 | 0 | 0 | 113.1 | R9 A10 V11 D15 V16 F17 | R9-W13 PolarHBondContact O-N 3.22Å; A10-W13 PolarHBondContact O-N 2.74Å; V11-W13 VanDerWaalsContact C-N 3.34Å; V11-W13 PolarHBondContact O-N 2.96Å; W13-D15 VanDerWaalsContact C-N 3.35Å; W13-V16 PolarHBondContact O-N 2.91Å; W13-F17 PolarHBondContact O-N 3.29Å; W13-F17 VanDerWaalsContact O-N 3.07Å |
| 14 | T | 80 | Confident | 76.7 | Confident | 50 Ų | 50 | 77.6 Ų | 77.6 | 31% | 0.307 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -67.2 | -37.8 | 173.9 | 52.9 | 0 | 0 | 0 | 0 | 112 | Y2 A10 V11 V16 F17 Q18 | Y2-T14 WeakPolarHBondContact OH-CG2 3.5Å; Y2-T14 PolarHBondContact OH-OG1 3.49Å; A10-T14 PolarHBondContact O-N 3.27Å; A10-T14 PolarHBondContact O-OG1 3.47Å; V11-T14 PolarHBondContact O-N 2.99Å; V11-T14 PolarHBondContact O-OG1 2.98Å; T14-V16 VanDerWaalsContact C-N 3.34Å; T14-V16 PolarHBondContact O-N 3.41Å; T14-F17 PolarHBondContact O-N 3.08Å; T14-Q18 VanDerWaalsContact O-CB 3.25Å; T14-Q18 WeakPolarHBondContact O-CB 3.47Å; T14-Q18 PolarHBondContact O-N 2.71Å |
| 15 | D | 81.2 | Confident | 78.6 | Confident | 30 Ų | 30 | 74.3 Ų | 74.3 | 16% | 0.16 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -62.6 | -42.8 | 176.3 | -69.9 | -12.6 | 0 | 0 | 0 | 111.1 | V11 I12 W13 Q18 I19 S177 | V11-D15 PolarHBondContact O-N 3.01Å; I12-D15 PolarHBondContact O-N 3.41Å; W13-D15 VanDerWaalsContact C-N 3.35Å; D15-Q18 PolarHBondContact O-N 3.43Å; D15-I19 WeakPolarHBondContact O-CG1 3.34Å; D15-I19 PolarHBondContact O-N 3.47Å; D15-S177 WeakPolarHBondContact OD1-CB 3.35Å; D15-S177 PolarHBondContact OD1-OG 3.34Å; D15-S177 PolarHBondContact OD2-OG 2.92Å |
| 16 | V | 84.4 | Confident | 80.7 | Confident | 72 Ų | 72 | 68.6 Ų | 68.6 | 44% | 0.436 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -61.2 | -49 | 176.3 | 171.5 | 0 | 0 | 0 | 0 | 111.1 | I12 W13 T14 Q18 I19 V20 | I12-V16 WeakPolarHBondContact O-CG2 3.38Å; I12-V16 PolarHBondContact O-N 3.26Å; W13-V16 PolarHBondContact O-N 2.91Å; T14-V16 VanDerWaalsContact C-N 3.34Å; T14-V16 PolarHBondContact O-N 3.41Å; V16-Q18 VanDerWaalsContact C-N 3.29Å; V16-Q18 PolarHBondContact O-N 3.13Å; V16-I19 PolarHBondContact O-N 2.86Å; V16-V20 PolarHBondContact O-N 3.44Å |
| 17 | F | 85.9 | Confident | 82.5 | Confident | 138 Ų | 138 | 70.8 Ų | 70.8 | 61% | 0.605 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -59.1 | -43.6 | 177.3 | 177 | -103.1 | 0 | 0 | 0 | 111.5 | W13 T14 I19 V20 V21 | W13-F17 PolarHBondContact O-N 3.29Å; W13-F17 VanDerWaalsContact O-N 3.07Å; T14-F17 PolarHBondContact O-N 3.08Å; F17-I19 PolarHBondContact O-N 2.92Å; F17-V20 PolarHBondContact O-N 3.26Å; F17-V21 HydrophobicContact CD1-CG2 4.18Å; F17-V21 HydrophobicContact CD2-CG2 4.44Å; F17-V21 HydrophobicContact CE1-CG2 3.69Å; F17-V21 HydrophobicContact CE2-CG2 3.98Å; F17-V21 HydrophobicContact CZ-CG2 3.58Å; F17-V21 WeakPolarHBondContact O-CG2 3.44Å; F17-V21 PolarHBondContact O-N 3.04Å |
| 18 | Q | 86.8 | Confident | 83.9 | Confident | 18 Ų | 18 | 70.2 Ų | 70.2 | 8% | 0.084 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -63.4 | -38.9 | -179.4 | -171.4 | -160.4 | -68.7 | 0 | 0 | 112.8 | T14 D15 V16 V20 V21 M22 S173 | T14-Q18 VanDerWaalsContact O-CB 3.25Å; T14-Q18 WeakPolarHBondContact O-CB 3.47Å; T14-Q18 PolarHBondContact O-N 2.71Å; D15-Q18 PolarHBondContact O-N 3.43Å; V16-Q18 VanDerWaalsContact C-N 3.29Å; V16-Q18 PolarHBondContact O-N 3.13Å; Q18-V20 VanDerWaalsContact C-N 3.32Å; Q18-V20 PolarHBondContact O-N 3.22Å; Q18-V21 PolarHBondContact O-N 3.32Å; Q18-M22 VanDerWaalsContact O-CB 3.24Å; Q18-M22 WeakPolarHBondContact O-CB 3.42Å; Q18-M22 PolarHBondContact O-N 2.92Å; Q18-S173 VanDerWaalsContact OE1-CB 3.31Å; Q18-S173 PolarHBondContact OE1-O 3.43Å; Q18-S173 PolarHBondContact OE1-OG 3.39Å |
| 19 | I | 86.9 | Confident | 85.4 | Confident | 73 Ų | 73 | 63.6 Ų | 63.6 | 37% | 0.374 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -60.2 | -44.3 | 175.5 | -70.6 | 165 | 0 | 0 | 0 | 110.6 | D15 V16 F17 M22 L23 I116 | D15-I19 WeakPolarHBondContact O-CG1 3.34Å; D15-I19 PolarHBondContact O-N 3.47Å; V16-I19 PolarHBondContact O-N 2.86Å; F17-I19 PolarHBondContact O-N 2.92Å; I19-M22 PolarHBondContact O-N 3.12Å; I19-L23 HydrophobicContact CG2-CD1 3.98Å; I19-L23 WeakPolarHBondContact O-CB 3.47Å; I19-L23 WeakPolarHBondContact O-CG 3.48Å; I19-L23 PolarHBondContact O-N 3.17Å; I19-I116 HydrophobicContact CG2-CD1 4.48Å |
| 20 | V | 90.1 | Very high | 86.8 | Confident | 92 Ų | 92 | 57.3 Ų | 57.3 | 56% | 0.558 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -61.9 | -48.2 | 179 | 175.3 | 0 | 0 | 0 | 0 | 110.8 | V16 F17 Q18 M22 L23 S24 | V16-V20 PolarHBondContact O-N 3.44Å; F17-V20 PolarHBondContact O-N 3.26Å; Q18-V20 VanDerWaalsContact C-N 3.32Å; Q18-V20 PolarHBondContact O-N 3.22Å; V20-M22 PolarHBondContact O-N 3.36Å; V20-L23 PolarHBondContact O-N 2.79Å; V20-S24 WeakPolarHBondContact O-CB 3.35Å; V20-S24 PolarHBondContact O-N 3.04Å; V20-S24 PolarHBondContact O-OG 2.73Å |
| 21 | V | 90.1 | Very high | 88 | Confident | 17 Ų | 17 | 59.7 Ų | 59.7 | 10% | 0.103 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -65.5 | -41.3 | -179.9 | -176.1 | 0 | 0 | 0 | 0 | 111 | F17 Q18 S24 G25 L166 C170 | F17-V21 HydrophobicContact CD1-CG2 4.18Å; F17-V21 HydrophobicContact CD2-CG2 4.44Å; F17-V21 HydrophobicContact CE1-CG2 3.69Å; F17-V21 HydrophobicContact CE2-CG2 3.98Å; F17-V21 HydrophobicContact CZ-CG2 3.58Å; F17-V21 WeakPolarHBondContact O-CG2 3.44Å; F17-V21 PolarHBondContact O-N 3.04Å; Q18-V21 PolarHBondContact O-N 3.32Å; V21-S24 WeakPolarHBondContact CA-OG 3.36Å; V21-S24 PolarHBondContact O-N 3.15Å; V21-S24 PolarHBondContact O-OG 3.29Å; V21-G25 PolarHBondContact O-N 2.93Å; V21-L166 HydrophobicContact CG1-CD1 4.16Å; V21-L166 HydrophobicContact CG1-CD2 4.03Å; V21-L166 HydrophobicContact CG1-CG 3.94Å; V21-C170 VanDerWaalsContact CB-SG 3.59Å; V21-C170 HydrophobicContact CG1-CB 4.38Å; V21-C170 WeakPolarHBondContact CG1-SG 3.29Å |
| 22 | M | 89.8 | Confident | 89.3 | Confident | 40 Ų | 40 | 60.8 Ų | 60.8 | 20% | 0.197 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -63 | -44.8 | 179 | -173.7 | 173.1 | 66.2 | 0 | 0 | 112.3 | Q18 I19 V20 G25 F26 I116 | Q18-M22 VanDerWaalsContact O-CB 3.24Å; Q18-M22 WeakPolarHBondContact O-CB 3.42Å; Q18-M22 PolarHBondContact O-N 2.92Å; I19-M22 PolarHBondContact O-N 3.12Å; V20-M22 PolarHBondContact O-N 3.36Å; M22-G25 PolarHBondContact O-N 3.47Å; M22-F26 HydrophobicContact CG-CD2 4.16Å; M22-F26 HydrophobicContact CG-CE2 3.64Å; M22-F26 HydrophobicContact CG-CZ 4.31Å; M22-F26 WeakPolarHBondContact O-CD2 3.29Å; M22-F26 PolarHBondContact O-N 2.94Å; M22-F26 HydrophobicContact SD-CE2 4.23Å; M22-I116 HydrophobicContact CE-CB 4.31Å; M22-I116 HydrophobicContact CE-CD1 3.42Å; M22-I116 VanDerWaalsContact CE-CD1 3.42Å; M22-I116 HydrophobicContact CE-CG1 3.7Å; M22-I116 HydrophobicContact CE-CG2 3.61Å |
| 23 | L | 91.9 | Very high | 90.2 | Very high | 48 Ų | 48 | 56.4 Ų | 56.4 | 25% | 0.251 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -63 | -42.8 | 175.1 | -74.1 | 172.9 | 0 | 0 | 0 | 111.7 | I19 V20 G25 F26 V27 I116 | I19-L23 HydrophobicContact CG2-CD1 3.98Å; I19-L23 WeakPolarHBondContact O-CB 3.47Å; I19-L23 WeakPolarHBondContact O-CG 3.48Å; I19-L23 PolarHBondContact O-N 3.17Å; V20-L23 PolarHBondContact O-N 2.79Å; L23-G25 PolarHBondContact O-N 3.36Å; L23-F26 PolarHBondContact O-N 3.41Å; L23-V27 WeakPolarHBondContact O-CG2 3.33Å; L23-V27 PolarHBondContact O-N 2.99Å; L23-I116 HydrophobicContact CD2-CG1 3.92Å; L23-I116 HydrophobicContact CG-CG1 4.42Å |
| 24 | S | 93 | Very high | 91 | Very high | 63 Ų | 63 | 47.7 Ų | 47.7 | 44% | 0.441 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -61.2 | -36.7 | 175 | 76.8 | 0 | 0 | 0 | 0 | 112.1 | V20 V21 V27 A28 | V20-S24 WeakPolarHBondContact O-CB 3.35Å; V20-S24 PolarHBondContact O-N 3.04Å; V20-S24 PolarHBondContact O-OG 2.73Å; V21-S24 WeakPolarHBondContact CA-OG 3.36Å; V21-S24 PolarHBondContact O-N 3.15Å; V21-S24 PolarHBondContact O-OG 3.29Å; S24-V27 PolarHBondContact O-N 3.37Å; S24-A28 WeakPolarHBondContact O-CB 3.39Å; S24-A28 PolarHBondContact O-N 3.26Å |
| 25 | G | 93.3 | Very high | 91.7 | Very high | 5 Ų | 5 | 50.6 Ų | 50.6 | 5% | 0.052 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -63.6 | -48.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112 | V21 M22 L23 V27 A28 I29 | V21-G25 PolarHBondContact O-N 2.93Å; M22-G25 PolarHBondContact O-N 3.47Å; L23-G25 PolarHBondContact O-N 3.36Å; G25-V27 VanDerWaalsContact C-N 3.35Å; G25-V27 PolarHBondContact O-N 3.13Å; G25-A28 PolarHBondContact O-N 3.19Å; G25-I29 WeakPolarHBondContact O-CB 3.4Å; G25-I29 WeakPolarHBondContact O-CD1 3.32Å; G25-I29 WeakPolarHBondContact O-CG1 3.42Å; G25-I29 PolarHBondContact O-N 2.98Å |
| 26 | F | 94.4 | Very high | 92.4 | Very high | 18 Ų | 18 | 53 Ų | 53 | 8% | 0.079 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -61.4 | -41.4 | 175.6 | -71.5 | -49.9 | 0 | 0 | 0 | 112.7 | M22 L23 A28 I29 F30 I116 A120 C123 F167 | M22-F26 HydrophobicContact CG-CD2 4.16Å; M22-F26 HydrophobicContact CG-CE2 3.64Å; M22-F26 HydrophobicContact CG-CZ 4.31Å; M22-F26 WeakPolarHBondContact O-CD2 3.29Å; M22-F26 PolarHBondContact O-N 2.94Å; M22-F26 HydrophobicContact SD-CE2 4.23Å; L23-F26 PolarHBondContact O-N 3.41Å; F26-A28 PolarHBondContact O-N 3.32Å; F26-I29 PolarHBondContact O-N 2.98Å; F26-F30 VanDerWaalsContact O-CB 3.3Å; F26-F30 WeakPolarHBondContact O-CB 3.33Å; F26-F30 PolarHBondContact O-N 2.98Å; F26-I116 HydrophobicContact CE2-CG2 4.24Å; F26-A120 HydrophobicContact CE1-CB 4.02Å; F26-A120 HydrophobicContact CE2-CB 4.39Å; F26-A120 HydrophobicContact CZ-CB 3.83Å; F26-C123 HydrophobicContact CD1-CB 4.41Å; F26-C123 PolarHBondContact O-SG 3.37Å; F26-C123 VanDerWaalsContact O-SG 3.39Å; F26-F167 HydrophobicContact CE1-CE2 4.41Å |
| 27 | V | 95.3 | Very high | 92.8 | Very high | 81 Ų | 81 | 50.7 Ų | 50.7 | 49% | 0.491 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -61.3 | -45.3 | 175.9 | 171.7 | 0 | 0 | 0 | 0 | 111 | L23 S24 G25 F30 I31 | L23-V27 WeakPolarHBondContact O-CG2 3.33Å; L23-V27 PolarHBondContact O-N 2.99Å; S24-V27 PolarHBondContact O-N 3.37Å; G25-V27 VanDerWaalsContact C-N 3.35Å; G25-V27 PolarHBondContact O-N 3.13Å; V27-F30 PolarHBondContact O-N 2.91Å; V27-I31 HydrophobicContact CG1-CD1 3.75Å; V27-I31 HydrophobicContact CG1-CG1 4.48Å; V27-I31 VanDerWaalsContact O-CG1 3.28Å; V27-I31 WeakPolarHBondContact O-CG1 3.36Å; V27-I31 PolarHBondContact O-N 2.95Å |
| 28 | A | 95.1 | Very high | 93.2 | Very high | 28 Ų | 28 | 47.1 Ų | 47.1 | 23% | 0.231 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -64.5 | -43 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | S24 G25 F26 F30 I31 Q32 F157 F163 | S24-A28 WeakPolarHBondContact O-CB 3.39Å; S24-A28 PolarHBondContact O-N 3.26Å; G25-A28 PolarHBondContact O-N 3.19Å; F26-A28 PolarHBondContact O-N 3.32Å; A28-F30 VanDerWaalsContact C-N 3.34Å; A28-F30 PolarHBondContact O-N 2.63Å; A28-I31 PolarHBondContact O-N 3.41Å; A28-Q32 WeakPolarHBondContact O-CB 3.5Å; A28-Q32 PolarHBondContact O-N 3.3Å; A28-F157 HydrophobicContact CB-CZ 4.1Å; A28-F163 HydrophobicContact CB-CE2 3.51Å; A28-F163 HydrophobicContact CB-CZ 3.53Å |
| 29 | I | 95.4 | Very high | 93.5 | Very high | 0 Ų | 0 | 47.1 Ų | 47.1 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -59.7 | -45.8 | 174.8 | -69 | 163.3 | 0 | 0 | 0 | 110.5 | G25 F26 G33 C123 F152 V153 I156 F157 F163 F167 | G25-I29 WeakPolarHBondContact O-CB 3.4Å; G25-I29 WeakPolarHBondContact O-CD1 3.32Å; G25-I29 WeakPolarHBondContact O-CG1 3.42Å; G25-I29 PolarHBondContact O-N 2.98Å; F26-I29 PolarHBondContact O-N 2.98Å; I29-G33 WeakPolarHBondContact O-CA 3.34Å; I29-G33 PolarHBondContact O-N 2.84Å; I29-C123 HydrophobicContact CG2-CB 4.08Å; I29-F152 HydrophobicContact CG2-CD1 4.07Å; I29-F152 HydrophobicContact CG2-CE1 3.67Å; I29-V153 HydrophobicContact CD1-CG2 3.45Å; I29-V153 VanDerWaalsContact CD1-CG2 3.45Å; I29-V153 HydrophobicContact CG1-CG2 3.91Å; I29-I156 HydrophobicContact CG2-CD1 4.1Å; I29-F157 HydrophobicContact CG1-CE2 3.99Å; I29-F163 HydrophobicContact CG1-CE1 4.19Å; I29-F163 HydrophobicContact CG1-CZ 4.39Å; I29-F167 HydrophobicContact CD1-CD2 3.81Å; I29-F167 HydrophobicContact CD1-CE2 3.44Å; I29-F167 VanDerWaalsContact CD1-CE2 3.44Å; I29-F167 HydrophobicContact CD1-CZ 3.92Å |
| 30 | F | 95.8 | Very high | 93.9 | Very high | 83 Ų | 83 | 48 Ų | 48 | 36% | 0.364 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -59.9 | -49.1 | 178.3 | 178.2 | -95.9 | 0 | 0 | 0 | 111.5 | F26 V27 A28 T34 V126 | F26-F30 VanDerWaalsContact O-CB 3.3Å; F26-F30 WeakPolarHBondContact O-CB 3.33Å; F26-F30 PolarHBondContact O-N 2.98Å; V27-F30 PolarHBondContact O-N 2.91Å; A28-F30 VanDerWaalsContact C-N 3.34Å; A28-F30 PolarHBondContact O-N 2.63Å; F30-T34 WeakPolarHBondContact O-CB 3.28Å; F30-T34 PolarHBondContact O-N 2.93Å; F30-T34 PolarHBondContact O-OG1 3.19Å; F30-V126 HydrophobicContact CD2-CG2 3.75Å; F30-V126 HydrophobicContact CE2-CG2 3.96Å |
| 31 | I | 95.6 | Very high | 94.1 | Very high | 88 Ų | 88 | 47.2 Ų | 47.2 | 45% | 0.451 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -63 | -54.4 | -179.8 | -66.9 | 166.4 | 0 | 0 | 0 | 110.5 | V27 A28 T34 I35 | V27-I31 HydrophobicContact CG1-CD1 3.75Å; V27-I31 HydrophobicContact CG1-CG1 4.48Å; V27-I31 VanDerWaalsContact O-CG1 3.28Å; V27-I31 WeakPolarHBondContact O-CG1 3.36Å; V27-I31 PolarHBondContact O-N 2.95Å; A28-I31 PolarHBondContact O-N 3.41Å; I31-T34 PolarHBondContact O-N 3.43Å; I31-I35 HydrophobicContact CG2-CD1 3.8Å; I31-I35 VanDerWaalsContact O-CG1 3.29Å; I31-I35 WeakPolarHBondContact O-CG1 3.19Å; I31-I35 PolarHBondContact O-N 3.09Å |
| 32 | Q | 95.3 | Very high | 94.2 | Very high | 48 Ų | 48 | 50.4 Ų | 50.4 | 22% | 0.224 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -64.4 | -46.6 | -175.4 | -177.4 | 62.3 | 13.4 | 0 | 0 | 111.6 | A28 T34 I35 L36 I156 F157 | A28-Q32 WeakPolarHBondContact O-CB 3.5Å; A28-Q32 PolarHBondContact O-N 3.3Å; Q32-T34 VanDerWaalsContact C-N 3.33Å; Q32-T34 PolarHBondContact O-N 3.02Å; Q32-I35 PolarHBondContact O-N 2.86Å; Q32-L36 HydrophobicContact CG-CD1 4.37Å; Q32-L36 WeakPolarHBondContact O-CG 3.26Å; Q32-L36 PolarHBondContact O-N 3.25Å; Q32-L36 VanDerWaalsContact O-N 3.07Å; Q32-I156 HydrophobicContact CG-CB 4.21Å; Q32-I156 HydrophobicContact CG-CG1 4.29Å; Q32-I156 PolarHBondContact NE2-O 2.99Å; Q32-F157 HydrophobicContact CB-CE1 4.01Å; Q32-F157 HydrophobicContact CB-CE2 4.33Å; Q32-F157 HydrophobicContact CB-CZ 3.68Å; Q32-F157 HydrophobicContact CG-CD1 4.46Å; Q32-F157 HydrophobicContact CG-CE1 4.02Å; Q32-F157 HydrophobicContact CG-CZ 4.04Å |
| 33 | G | 95 | Very high | 94.5 | Very high | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -62.2 | -40.8 | 178 | 0 | 0 | 0 | 0 | 0 | 112.2 | I29 I35 L36 V37 V126 | I29-G33 WeakPolarHBondContact O-CA 3.34Å; I29-G33 PolarHBondContact O-N 2.84Å; G33-I35 PolarHBondContact O-N 3.15Å; G33-L36 PolarHBondContact O-N 2.6Å; G33-V37 WeakPolarHBondContact O-CG2 3.25Å; G33-V37 PolarHBondContact O-N 3.41Å; G33-V37 VanDerWaalsContact O-N 3.1Å; G33-V126 VanDerWaalsContact C-CG1 3.41Å |
| 34 | T | 95.8 | Very high | 94.6 | Very high | 10 Ų | 10 | 51.8 Ų | 51.8 | 6% | 0.061 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -65.2 | -39.7 | 177.6 | -61.2 | 0 | 0 | 0 | 0 | 112 | F30 I31 Q32 L36 V37 G38 G39 P40 V43 | F30-T34 WeakPolarHBondContact O-CB 3.28Å; F30-T34 PolarHBondContact O-N 2.93Å; F30-T34 PolarHBondContact O-OG1 3.19Å; I31-T34 PolarHBondContact O-N 3.43Å; Q32-T34 VanDerWaalsContact C-N 3.33Å; Q32-T34 PolarHBondContact O-N 3.02Å; T34-L36 VanDerWaalsContact C-N 3.35Å; T34-V37 PolarHBondContact O-N 3.36Å; T34-G38 PolarHBondContact O-N 2.91Å; T34-G39 WeakPolarHBondContact O-CA 3.44Å; T34-G39 PolarHBondContact O-N 3.3Å; T34-P40 VanDerWaalsContact CG2-CA 3.48Å; T34-P40 HydrophobicContact CG2-CB 3.87Å; T34-P40 HydrophobicContact CG2-CG 4.33Å; T34-V43 HydrophobicContact CG2-CG2 4.24Å |
| 35 | I | 95.6 | Very high | 94.6 | Very high | 111 Ų | 111 | 53.8 Ų | 53.8 | 57% | 0.569 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -62 | -44.5 | 175.7 | -70.1 | 166.2 | 0 | 0 | 0 | 110.5 | I31 Q32 G33 V37 G38 | I31-I35 HydrophobicContact CG2-CD1 3.8Å; I31-I35 VanDerWaalsContact O-CG1 3.29Å; I31-I35 WeakPolarHBondContact O-CG1 3.19Å; I31-I35 PolarHBondContact O-N 3.09Å; Q32-I35 PolarHBondContact O-N 2.86Å; G33-I35 PolarHBondContact O-N 3.15Å; I35-V37 VanDerWaalsContact C-N 3.32Å; I35-V37 PolarHBondContact O-N 3.03Å; I35-G38 PolarHBondContact O-N 3.41Å; I35-G38 VanDerWaalsContact O-N 3.1Å |
| 36 | L | 94.3 | Very high | 94.6 | Very high | 80 Ų | 80 | 54.8 Ų | 54.8 | 42% | 0.419 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -65.5 | -32.3 | -179.3 | -69.3 | 174.3 | 0 | 0 | 0 | 113.4 | Q32 G33 T34 G38 Y130 I156 | Q32-L36 HydrophobicContact CG-CD1 4.37Å; Q32-L36 WeakPolarHBondContact O-CG 3.26Å; Q32-L36 PolarHBondContact O-N 3.25Å; Q32-L36 VanDerWaalsContact O-N 3.07Å; G33-L36 PolarHBondContact O-N 2.6Å; T34-L36 VanDerWaalsContact C-N 3.35Å; L36-G38 VanDerWaalsContact C-N 3.27Å; L36-G38 PolarHBondContact O-N 3.44Å; L36-Y130 HydrophobicContact CB-CD2 4.12Å; L36-Y130 HydrophobicContact CB-CE2 3.94Å; L36-Y130 HydrophobicContact CD1-CE2 4.11Å; L36-I156 HydrophobicContact CD1-CB 3.6Å; L36-I156 HydrophobicContact CD1-CG2 3.6Å |
| 37 | V | 93.9 | Very high | 94.5 | Very high | 24 Ų | 24 | 54 Ų | 54 | 15% | 0.145 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -74.6 | -17.4 | 175.4 | 176 | 0 | 0 | 0 | 0 | 112.3 | G33 T34 I35 Q42 V43 I46 A129 Y130 | G33-V37 WeakPolarHBondContact O-CG2 3.25Å; G33-V37 PolarHBondContact O-N 3.41Å; G33-V37 VanDerWaalsContact O-N 3.1Å; T34-V37 PolarHBondContact O-N 3.36Å; I35-V37 VanDerWaalsContact C-N 3.32Å; I35-V37 PolarHBondContact O-N 3.03Å; V37-Q42 HydrophobicContact CG1-CB 4.3Å; V37-Q42 HydrophobicContact CG1-CG 4.17Å; V37-V43 HydrophobicContact CB-CG2 3.76Å; V37-V43 HydrophobicContact CG1-CG2 3.62Å; V37-V43 HydrophobicContact CG2-CG2 4.18Å; V37-I46 HydrophobicContact CG1-CD1 3.88Å; V37-A129 HydrophobicContact CG1-CB 4.15Å; V37-A129 HydrophobicContact CG2-CB 4.3Å; V37-Y130 HydrophobicContact CG2-CD2 4.2Å |
| 38 | G | 93.7 | Very high | 94.2 | Very high | 63 Ų | 63 | 53.3 Ų | 53.3 | 65% | 0.649 | 32% | 0.316 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 104 | 14 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | T34 I35 L36 | T34-G38 PolarHBondContact O-N 2.91Å; I35-G38 PolarHBondContact O-N 3.41Å; I35-G38 VanDerWaalsContact O-N 3.1Å; L36-G38 VanDerWaalsContact C-N 3.27Å; L36-G38 PolarHBondContact O-N 3.44Å |
| 39 | G | 94.3 | Very high | 94 | Very high | 17 Ų | 17 | 57.9 Ų | 57.9 | 18% | 0.175 | 34% | 0.336 | C | S | . | . | trans | 118.3 | 167.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | T34 A41 Q42 V43 | T34-G39 WeakPolarHBondContact O-CA 3.44Å; T34-G39 PolarHBondContact O-N 3.3Å; G39-A41 VanDerWaalsContact C-N 3.33Å; G39-A41 PolarHBondContact O-N 2.83Å; G39-Q42 PolarHBondContact O-N 2.92Å; G39-V43 PolarHBondContact O-N 3.43Å | ||
| 40 | P | 93.5 | Very high | 93.6 | Very high | 91 Ų | 91 | 59 Ų | 59 | 59% | 0.591 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -67.5 | -31.2 | -172.6 | 24.8 | -33.5 | 0 | 0 | 0 | 113.2 | T34 V43 L44 | T34-P40 VanDerWaalsContact CG2-CA 3.48Å; T34-P40 HydrophobicContact CG2-CB 3.87Å; T34-P40 HydrophobicContact CG2-CG 4.33Å; P40-V43 PolarHBondContact O-N 3.35Å; P40-L44 PolarHBondContact O-N 3.36Å |
| 41 | A | 94.4 | Very high | 93.2 | Very high | 76 Ų | 76 | 58.4 Ų | 58.4 | 63% | 0.628 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -64.3 | -43.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | G39 L44 E45 | G39-A41 VanDerWaalsContact C-N 3.33Å; G39-A41 PolarHBondContact O-N 2.83Å; A41-L44 PolarHBondContact O-N 3.46Å; A41-E45 WeakPolarHBondContact O-CB 3.27Å; A41-E45 PolarHBondContact O-N 2.93Å |
| 42 | Q | 93.9 | Very high | 92.7 | Very high | 85 Ų | 85 | 58.6 Ų | 58.6 | 40% | 0.397 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -63.8 | -42.4 | 177.8 | -163.1 | 72.7 | 37.6 | 0 | 0 | 111.4 | V37 G39 L44 E45 I46 | V37-Q42 HydrophobicContact CG1-CB 4.3Å; V37-Q42 HydrophobicContact CG1-CG 4.17Å; G39-Q42 PolarHBondContact O-N 2.92Å; Q42-L44 VanDerWaalsContact C-N 3.32Å; Q42-L44 PolarHBondContact O-N 3.35Å; Q42-E45 PolarHBondContact O-N 3.21Å; Q42-I46 HydrophobicContact CG-CD1 3.92Å; Q42-I46 WeakPolarHBondContact O-CB 3.37Å; Q42-I46 WeakPolarHBondContact O-CD1 3.32Å; Q42-I46 VanDerWaalsContact O-CG1 3.26Å; Q42-I46 WeakPolarHBondContact O-CG1 3.27Å; Q42-I46 PolarHBondContact O-N 3.14Å |
| 43 | V | 94.9 | Very high | 92.3 | Very high | 10 Ų | 10 | 58.6 Ų | 58.6 | 6% | 0.061 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -57.5 | -47.1 | 174.7 | 172.3 | 0 | 0 | 0 | 0 | 110.8 | T34 V37 G39 P40 A47 I125 V126 A129 | T34-V43 HydrophobicContact CG2-CG2 4.24Å; V37-V43 HydrophobicContact CB-CG2 3.76Å; V37-V43 HydrophobicContact CG1-CG2 3.62Å; V37-V43 HydrophobicContact CG2-CG2 4.18Å; G39-V43 PolarHBondContact O-N 3.43Å; P40-V43 PolarHBondContact O-N 3.35Å; V43-A47 VanDerWaalsContact O-CB 3.23Å; V43-A47 WeakPolarHBondContact O-CB 2.94Å; V43-A47 PolarHBondContact O-N 3.46Å; V43-I125 HydrophobicContact CG1-CG2 4.08Å; V43-V126 HydrophobicContact CG1-CG2 4.06Å; V43-A129 HydrophobicContact CB-CB 4.28Å; V43-A129 HydrophobicContact CG1-CB 3.98Å; V43-A129 HydrophobicContact CG2-CB 4.27Å |
| 44 | L | 93.9 | Very high | 91.7 | Very high | 106 Ų | 106 | 63.4 Ų | 63.4 | 56% | 0.555 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -66.6 | -41.6 | -178.5 | -168.5 | 73.3 | 0 | 0 | 0 | 111.8 | P40 A41 Q42 A47 S48 L53 | P40-L44 PolarHBondContact O-N 3.36Å; A41-L44 PolarHBondContact O-N 3.46Å; Q42-L44 VanDerWaalsContact C-N 3.32Å; Q42-L44 PolarHBondContact O-N 3.35Å; L44-A47 PolarHBondContact O-N 3.3Å; L44-S48 VanDerWaalsContact O-CB 3.26Å; L44-S48 WeakPolarHBondContact O-CB 3.43Å; L44-S48 PolarHBondContact O-N 2.86Å; L44-L53 HydrophobicContact CD1-CD1 3.45Å; L44-L53 VanDerWaalsContact CD1-CD1 3.45Å; L44-L53 HydrophobicContact CG-CD1 4.29Å |
| 45 | E | 94.2 | Very high | 91 | Very high | 105 Ų | 105 | 71 Ų | 71 | 49% | 0.491 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -62.1 | -48.8 | 177 | -174.3 | -179.5 | 176.8 | 0 | 0 | 111.4 | A41 Q42 A47 S48 N49 | A41-E45 WeakPolarHBondContact O-CB 3.27Å; A41-E45 PolarHBondContact O-N 2.93Å; Q42-E45 PolarHBondContact O-N 3.21Å; E45-A47 VanDerWaalsContact C-N 3.34Å; E45-A47 PolarHBondContact O-N 2.94Å; E45-S48 PolarHBondContact O-N 3.2Å; E45-N49 WeakPolarHBondContact O-CB 3.27Å; E45-N49 PolarHBondContact O-N 3.17Å |
| 46 | I | 92.3 | Very high | 90.4 | Very high | 27 Ų | 27 | 71.7 Ų | 71.7 | 14% | 0.138 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -61.3 | -44.4 | 177.3 | -68.2 | 164.7 | 0 | 0 | 0 | 110.7 | V37 Q42 N49 G50 F128 A129 N132 | V37-I46 HydrophobicContact CG1-CD1 3.88Å; Q42-I46 HydrophobicContact CG-CD1 3.92Å; Q42-I46 WeakPolarHBondContact O-CB 3.37Å; Q42-I46 WeakPolarHBondContact O-CD1 3.32Å; Q42-I46 VanDerWaalsContact O-CG1 3.26Å; Q42-I46 WeakPolarHBondContact O-CG1 3.27Å; Q42-I46 PolarHBondContact O-N 3.14Å; I46-N49 PolarHBondContact O-N 3.43Å; I46-G50 PolarHBondContact O-N 3.31Å; I46-F128 HydrophobicContact CG2-CE1 4.18Å; I46-A129 HydrophobicContact CB-CB 4.19Å; I46-A129 HydrophobicContact CD1-CB 4.43Å; I46-A129 HydrophobicContact CG2-CB 4.02Å; I46-N132 HydrophobicContact CG2-CB 3.84Å; I46-N132 VanDerWaalsContact CG2-ND2 3.3Å; I46-N132 WeakPolarHBondContact CG2-ND2 3.39Å |
| 47 | A | 92 | Very high | 90 | Very high | 0 Ų | 0 | 70.1 Ų | 70.1 | 0% | 0 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -66 | -37.8 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | V43 L44 E45 S51 R52 L53 I125 | V43-A47 VanDerWaalsContact O-CB 3.23Å; V43-A47 WeakPolarHBondContact O-CB 2.94Å; V43-A47 PolarHBondContact O-N 3.46Å; L44-A47 PolarHBondContact O-N 3.3Å; E45-A47 VanDerWaalsContact C-N 3.34Å; E45-A47 PolarHBondContact O-N 2.94Å; A47-S51 PolarHBondContact O-N 2.95Å; A47-R52 PolarHBondContact O-N 3.34Å; A47-L53 HydrophobicContact CB-CD1 3.94Å; A47-L53 HydrophobicContact CB-CG 3.99Å; A47-I125 HydrophobicContact CB-CG2 3.62Å |
| 48 | S | 90.6 | Very high | 89.7 | Confident | 68 Ų | 68 | 74.1 Ų | 74.1 | 48% | 0.476 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -67.3 | -46.9 | 175.3 | -172.1 | 0 | 0 | 0 | 0 | 111.3 | L44 E45 G50 S51 | L44-S48 VanDerWaalsContact O-CB 3.26Å; L44-S48 WeakPolarHBondContact O-CB 3.43Å; L44-S48 PolarHBondContact O-N 2.86Å; E45-S48 PolarHBondContact O-N 3.2Å; S48-G50 VanDerWaalsContact C-N 3.27Å; S48-G50 PolarHBondContact O-N 2.96Å; S48-S51 PolarHBondContact O-N 3.17Å |
| 49 | N | 90.6 | Very high | 89.3 | Confident | 124 Ų | 124 | 74.2 Ų | 74.2 | 66% | 0.663 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -64.8 | -32 | 177.9 | -73.2 | -11.3 | 0 | 0 | 0 | 112.3 | E45 I46 S51 | E45-N49 WeakPolarHBondContact O-CB 3.27Å; E45-N49 PolarHBondContact O-N 3.17Å; I46-N49 PolarHBondContact O-N 3.43Å; N49-S51 PolarHBondContact O-N 3.43Å |
| 50 | G | 85.9 | Confident | 89 | Confident | 24 Ų | 24 | 78.7 Ų | 78.7 | 25% | 0.247 | 43% | 0.43 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -78.9 | 6.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | I46 S48 R52 | I46-G50 PolarHBondContact O-N 3.31Å; S48-G50 VanDerWaalsContact C-N 3.27Å; S48-G50 PolarHBondContact O-N 2.96Å; G50-R52 PolarHBondContact O-N 3.22Å; G50-R52 VanDerWaalsContact O-N 3.08Å |
| 51 | S | 86.9 | Confident | 88.6 | Confident | 69 Ų | 69 | 76 Ų | 76 | 48% | 0.483 | 41% | 0.41 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 54.5 | 25 | -176.5 | -59.9 | 0 | 0 | 0 | 0 | 114.2 | A47 S48 N49 L53 L300 | A47-S51 PolarHBondContact O-N 2.95Å; S48-S51 PolarHBondContact O-N 3.17Å; N49-S51 PolarHBondContact O-N 3.43Å; S51-L53 VanDerWaalsContact C-N 3.34Å; S51-L300 WeakPolarHBondContact O-CD1 3.3Å |
| 52 | R | 85.9 | Confident | 87.9 | Confident | 93 Ų | 93 | 77.4 Ų | 77.4 | 35% | 0.351 | 41% | 0.413 | S | S | . | . | trans | -81.7 | -15.9 | -179.9 | -62 | -69.3 | 172.9 | 177.3 | -4.1 | 112.6 | A47 G50 F128 L300 P301 | A47-R52 PolarHBondContact O-N 3.34Å; G50-R52 PolarHBondContact O-N 3.22Å; G50-R52 VanDerWaalsContact O-N 3.08Å; R52-F128 HydrophobicContact CB-CD1 4.42Å; R52-F128 HydrophobicContact CB-CE1 4.46Å; R52-F128 HydrophobicContact CG-CD1 3.63Å; R52-F128 HydrophobicContact CG-CD2 4.06Å; R52-F128 HydrophobicContact CG-CE1 3.49Å; R52-F128 VanDerWaalsContact CG-CE1 3.49Å; R52-F128 HydrophobicContact CG-CE2 3.94Å; R52-F128 HydrophobicContact CG-CG 3.91Å; R52-F128 HydrophobicContact CG-CZ 3.65Å; R52-L300 HydrophobicContact CG-CD1 4.47Å; R52-L300 PolarHBondContact NH2-O 3Å; R52-L300 VanDerWaalsContact NH2-O 3.11Å; R52-P301 PolarHBondContact NH2-O 2.94Å | ||
| 53 | L | 86 | Confident | 87.4 | Confident | 48 Ų | 48 | 78.7 Ų | 78.7 | 25% | 0.251 | 41% | 0.414 | S | S | . | . | trans | -103.6 | 70.4 | 176.3 | -60.4 | 176.2 | 0 | 0 | 0 | 110.4 | L44 A47 S51 F55 I125 | L44-L53 HydrophobicContact CD1-CD1 3.45Å; L44-L53 VanDerWaalsContact CD1-CD1 3.45Å; L44-L53 HydrophobicContact CG-CD1 4.29Å; A47-L53 HydrophobicContact CB-CD1 3.94Å; A47-L53 HydrophobicContact CB-CG 3.99Å; S51-L53 VanDerWaalsContact C-N 3.34Å; L53-F55 HydrophobicContact CB-CE2 4.44Å; L53-I125 HydrophobicContact CD2-CD1 3.74Å; L53-I125 HydrophobicContact CD2-CG1 4.35Å | ||
| 54 | N | 83.4 | Confident | 86.7 | Confident | 101 Ų | 101 | 80.7 Ų | 80.7 | 54% | 0.54 | 42% | 0.423 | S | S | . | . | trans | -112.3 | 107.1 | 176.1 | -168.1 | -12.6 | 0 | 0 | 0 | 110.7 | N56 | N54-N56 PolarHBondContact OD1-N 3.29Š| ||
| 55 | F | 81.3 | Confident | 85.9 | Confident | 169 Ų | 169 | 80 Ų | 80 | 74% | 0.741 | 41% | 0.412 | S | S | * | . | trans | -98 | -10.7 | 177.1 | -62.1 | -77.3 | 0 | 0 | 0 | 113.1 | L53 | L53-F55 HydrophobicContact CB-CE2 4.44Š| ||
| 56 | N | 83.1 | Confident | 85.4 | Confident | 125 Ų | 125 | 81 Ų | 81 | 67% | 0.668 | 41% | 0.413 | S | S | * | . | trans | -115.7 | 32.4 | -165.5 | -65.3 | -21.9 | 0 | 0 | 0 | 112.8 | N54 F58 | N54-N56 PolarHBondContact OD1-N 3.29Å; N56-F58 HydrophobicContact CB-CE2 4.21Å; N56-F58 WeakPolarHBondContact O-CD2 3.44Å; N56-F58 PolarHBondContact O-N 3.43Å | ||
| 57 | D | 84.6 | Confident | 85.3 | Confident | 47 Ų | 47 | 80.1 Ų | 80.1 | 25% | 0.251 | 41% | 0.409 | S | S | . | . | trans | -87.1 | 91.5 | 173 | -162.7 | -22 | 0 | 0 | 0 | 110.6 | D59 F68 | D57-D59 VanDerWaalsContact C-N 3.34Å; D57-D59 VanDerWaalsContact OD1-CB 3.3Å; D57-D59 WeakPolarHBondContact OD1-CB 3.39Å; D57-D59 PolarHBondContact OD1-N 2.83Å; D57-F68 WeakPolarHBondContact O-CB 3.49Å; D57-F68 PolarHBondContact O-N 2.87Å | ||
| 58 | F | 87.6 | Confident | 85.1 | Confident | 108 Ų | 108 | 84.2 Ų | 84.2 | 47% | 0.474 | 43% | 0.427 | S | S | . | . | trans | -94.7 | 18 | 179.4 | -69.1 | -84.2 | 0 | 0 | 0 | 113.5 | N56 F68 W69 | N56-F58 HydrophobicContact CB-CE2 4.21Å; N56-F58 WeakPolarHBondContact O-CD2 3.44Å; N56-F58 PolarHBondContact O-N 3.43Å; F58-F68 HydrophobicContact CD1-CB 3.66Å; F58-F68 AromaticContact CD1-CD1 3.69Å; F58-F68 HydrophobicContact CD1-CD1 3.69Å; F58-F68 HydrophobicContact CD1-CD2 4.25Å; F58-F68 HydrophobicContact CD1-CE1 4.42Å; F58-F68 AromaticContact CD1-CG 3.59Å; F58-F68 HydrophobicContact CD1-CG 3.59Å; F58-F68 HydrophobicContact CE1-CB 3.85Å; F58-F68 AromaticContact CE1-CD1 3.63Å; F58-F68 HydrophobicContact CE1-CD1 3.63Å; F58-F68 AromaticContact CE1-CD2 3.56Å; F58-F68 HydrophobicContact CE1-CD2 3.56Å; F58-F68 HydrophobicContact CE1-CE1 4.04Å; F58-F68 AromaticContact CE1-CE2 3.97Å; F58-F68 HydrophobicContact CE1-CE2 3.97Å; F58-F68 AromaticContact CE1-CG 3.37Å; F58-F68 HydrophobicContact CE1-CG 3.37Å; F58-F68 HydrophobicContact CE1-CZ 4.2Å; F58-F68 HydrophobicContact CG-CB 4.32Å; F58-F68 HydrophobicContact CZ-CD2 4.13Å; F58-F68 HydrophobicContact CZ-CG 4.29Å; F58-W69 PolarHBondContact O-NE1 3.01Å | ||
| 59 | D | 87.1 | Confident | 85 | Confident | 65 Ų | 65 | 86.9 Ų | 86.9 | 35% | 0.348 | 43% | 0.426 | S | S | . | . | trans | -62.6 | 139.7 | 178.5 | -157.6 | -32.9 | 0 | 0 | 0 | 111.3 | D57 D61 K64 T67 | D57-D59 VanDerWaalsContact C-N 3.34Å; D57-D59 VanDerWaalsContact OD1-CB 3.3Å; D57-D59 WeakPolarHBondContact OD1-CB 3.39Å; D57-D59 PolarHBondContact OD1-N 2.83Å; D59-D61 WeakPolarHBondContact OD1-CB 3.1Å; D59-D61 PolarHBondContact OD1-N 3.27Å; D59-K64 HydrophobicContact CB-CD 3.76Å; D59-K64 VanDerWaalsContact OD2-CE 3.25Å; D59-K64 WeakPolarHBondContact OD2-CE 3.24Å; D59-K64 IonicContact OD2-NZ 3.5Å; D59-K64 PolarHBondContact OD2-NZ 2.81Å; D59-T67 HydrophobicContact CB-CG2 4.39Å; D59-T67 WeakPolarHBondContact O-CB 3.06Å; D59-T67 WeakPolarHBondContact O-CG2 3.18Å; D59-T67 PolarHBondContact O-OG1 3.38Å | ||
| 60 | V | 86.4 | Confident | 84.9 | Confident | 112 Ų | 112 | 83.1 Ų | 83.1 | 68% | 0.679 | 41% | 0.409 | S | S | * | . | trans | -95.4 | -5.7 | -177.7 | -172.2 | 0 | 0 | 0 | 0 | 110.9 | P62 | V60-P62 WeakPolarHBondContact O-CD 3.47Å; V60-P62 VanDerWaalsContact O-N 3.08Å | ||
| 61 | D | 85.8 | Confident | 85 | Confident | 33 Ų | 33 | 87 Ų | 87 | 18% | 0.176 | 42% | 0.424 | C | S | . | . | trans | -58.1 | 112.8 | 176.1 | -169.4 | -19.4 | 0 | 0 | 0 | 110.8 | D59 R63 K64 | D59-D61 WeakPolarHBondContact OD1-CB 3.1Å; D59-D61 PolarHBondContact OD1-N 3.27Å; D61-R63 PolarHBondContact O-N 3.01Å; D61-R63 VanDerWaalsContact O-N 3.12Å; D61-R63 VanDerWaalsContact OD1-CB 3.24Å; D61-R63 WeakPolarHBondContact OD1-CB 3.4Å; D61-R63 WeakPolarHBondContact OD1-CG 3.47Å; D61-R63 IonicContact OD1-CZ 3.4Å; D61-R63 PolarHBondContact OD1-N 2.96Å; D61-R63 IonicContact OD1-NE 3.22Å; D61-R63 PolarHBondContact OD1-NE 3.2Å; D61-R63 IonicContact OD1-NH2 2.73Å; D61-R63 IonicContact OD2-CZ 3.64Å; D61-R63 IonicContact OD2-NE 2.67Å; D61-R63 PolarHBondContact OD2-NE 2.91Å; D61-R63 IonicContact OD2-NH2 3.82Å; D61-R63 PolarHBondContact OD2-NH2 3.37Å; D61-K64 HydrophobicContact CB-CD 4.39Å; D61-K64 HydrophobicContact CB-CG 4.33Å; D61-K64 WeakPolarHBondContact O-CB 3.43Å; D61-K64 PolarHBondContact O-N 3.26Å; D61-K64 VanDerWaalsContact O-N 3.13Å | ||
| 62 | P | 80.3 | Confident | 85.1 | Confident | 106 Ų | 106 | 85.5 Ų | 85.5 | 69% | 0.688 | 41% | 0.413 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.1 | -9 | -177.5 | 30.7 | -36.8 | 0 | 0 | 0 | 113.1 | V60 Y346 | V60-P62 WeakPolarHBondContact O-CD 3.47Å; V60-P62 VanDerWaalsContact O-N 3.08Å; P62-Y346 HydrophobicContact CG-CE1 4.26Å |
| 63 | R | 82.3 | Confident | 85.3 | Confident | 112 Ų | 112 | 84.8 Ų | 84.8 | 42% | 0.423 | 42% | 0.419 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.9 | -19.6 | 175.9 | -57.8 | 171.9 | -64.5 | 179.7 | 4.9 | 112.2 | D61 R65 P292 T296 | D61-R63 PolarHBondContact O-N 3.01Å; D61-R63 VanDerWaalsContact O-N 3.12Å; D61-R63 VanDerWaalsContact OD1-CB 3.24Å; D61-R63 WeakPolarHBondContact OD1-CB 3.4Å; D61-R63 WeakPolarHBondContact OD1-CG 3.47Å; D61-R63 IonicContact OD1-CZ 3.4Å; D61-R63 PolarHBondContact OD1-N 2.96Å; D61-R63 IonicContact OD1-NE 3.22Å; D61-R63 PolarHBondContact OD1-NE 3.2Å; D61-R63 IonicContact OD1-NH2 2.73Å; D61-R63 IonicContact OD2-CZ 3.64Å; D61-R63 IonicContact OD2-NE 2.67Å; D61-R63 PolarHBondContact OD2-NE 2.91Å; D61-R63 IonicContact OD2-NH2 3.82Å; D61-R63 PolarHBondContact OD2-NH2 3.37Å; R63-R65 PolarHBondContact O-N 3.2Å; R63-P292 HydrophobicContact CB-CB 4.26Å; R63-P292 HydrophobicContact CB-CG 4.05Å; R63-T296 HydrophobicContact CB-CG2 3.79Å |
| 64 | K | 81.3 | Confident | 85.3 | Confident | 53 Ų | 53 | 84.1 Ų | 84.1 | 23% | 0.23 | 42% | 0.424 | C | S | . | . | S | Bend | trans | -71.4 | 125.8 | 172 | -79.6 | -178.9 | 168.3 | -171 | 0 | 109.3 | D59 D61 T67 T296 | D59-K64 HydrophobicContact CB-CD 3.76Å; D59-K64 VanDerWaalsContact OD2-CE 3.25Å; D59-K64 WeakPolarHBondContact OD2-CE 3.24Å; D59-K64 IonicContact OD2-NZ 3.5Å; D59-K64 PolarHBondContact OD2-NZ 2.81Å; D61-K64 HydrophobicContact CB-CD 4.39Å; D61-K64 HydrophobicContact CB-CG 4.33Å; D61-K64 WeakPolarHBondContact O-CB 3.43Å; D61-K64 PolarHBondContact O-N 3.26Å; D61-K64 VanDerWaalsContact O-N 3.13Å; K64-T67 HydrophobicContact CB-CG2 3.57Å; K64-T67 HydrophobicContact CD-CG2 4.18Å; K64-T296 WeakPolarHBondContact CG-O 3.36Å |
| 65 | R | 76.6 | Confident | 85.5 | Confident | 90 Ų | 90 | 80.1 Ų | 80.1 | 34% | 0.34 | 41% | 0.406 | S | S | . | . | S | Bend | trans | -66.2 | -46 | -171.4 | -175.4 | 176.6 | 174.9 | 147.3 | 1.5 | 112.6 | R63 S70 Q238 | R63-R65 PolarHBondContact O-N 3.2Å; R65-S70 PolarHBondContact O-OG 3.1Å; R65-S70 VanDerWaalsContact O-OG 3.12Å; R65-Q238 VanDerWaalsContact CZ-CD 3.48Å; R65-Q238 VanDerWaalsContact NH1-CD 3.3Å |
| 66 | Y | 84 | Confident | 86 | Confident | 128 Ų | 128 | 75.7 Ų | 75.7 | 50% | 0.502 | 40% | 0.397 | S | S | . | . | S | Bend | trans | -126.4 | 106 | -176.2 | -59.2 | -56.7 | 0 | 0 | 0 | 109.6 | L71 | Y66-L71 HydrophobicContact CD1-CD2 3.91Š|
| 67 | T | 88.9 | Confident | 86.3 | Confident | 8 Ų | 8 | 74.5 Ų | 74.5 | 5% | 0.049 | 39% | 0.388 | C | S | . | . | trans | -129.2 | 167.8 | 171.5 | 66.8 | 0 | 0 | 0 | 0 | 108.7 | D59 K64 W69 S70 L71 | D59-T67 HydrophobicContact CB-CG2 4.39Å; D59-T67 WeakPolarHBondContact O-CB 3.06Å; D59-T67 WeakPolarHBondContact O-CG2 3.18Å; D59-T67 PolarHBondContact O-OG1 3.38Å; K64-T67 HydrophobicContact CB-CG2 3.57Å; K64-T67 HydrophobicContact CD-CG2 4.18Å; T67-W69 PolarHBondContact O-N 3Å; T67-W69 PolarHBondContact OG1-N 3.29Å; T67-S70 PolarHBondContact N-OG 2.86Å; T67-S70 PolarHBondContact O-N 3.32Å; T67-S70 PolarHBondContact O-OG 2.84Å; T67-S70 PolarHBondContact OG1-N 3.35Å; T67-L71 WeakPolarHBondContact O-CB 3.3Å; T67-L71 WeakPolarHBondContact O-CG 3.37Å; T67-L71 PolarHBondContact O-N 3.3Å | ||
| 68 | F | 89.3 | Confident | 86.5 | Confident | 86 Ų | 86 | 73.9 Ų | 73.9 | 38% | 0.377 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -50.7 | -41.8 | 172.3 | 175.3 | -94.8 | 0 | 0 | 0 | 111.4 | D57 F58 S72 | D57-F68 WeakPolarHBondContact O-CB 3.49Å; D57-F68 PolarHBondContact O-N 2.87Å; F58-F68 HydrophobicContact CD1-CB 3.66Å; F58-F68 AromaticContact CD1-CD1 3.69Å; F58-F68 HydrophobicContact CD1-CD1 3.69Å; F58-F68 HydrophobicContact CD1-CD2 4.25Å; F58-F68 HydrophobicContact CD1-CE1 4.42Å; F58-F68 AromaticContact CD1-CG 3.59Å; F58-F68 HydrophobicContact CD1-CG 3.59Å; F58-F68 HydrophobicContact CE1-CB 3.85Å; F58-F68 AromaticContact CE1-CD1 3.63Å; F58-F68 HydrophobicContact CE1-CD1 3.63Å; F58-F68 AromaticContact CE1-CD2 3.56Å; F58-F68 HydrophobicContact CE1-CD2 3.56Å; F58-F68 HydrophobicContact CE1-CE1 4.04Å; F58-F68 AromaticContact CE1-CE2 3.97Å; F58-F68 HydrophobicContact CE1-CE2 3.97Å; F58-F68 AromaticContact CE1-CG 3.37Å; F58-F68 HydrophobicContact CE1-CG 3.37Å; F58-F68 HydrophobicContact CE1-CZ 4.2Å; F58-F68 HydrophobicContact CG-CB 4.32Å; F58-F68 HydrophobicContact CZ-CD2 4.13Å; F58-F68 HydrophobicContact CZ-CG 4.29Å; F68-S72 WeakPolarHBondContact O-CB 3.27Å; F68-S72 PolarHBondContact O-N 2.8Å; F68-S72 PolarHBondContact O-OG 2.97Å |
| 69 | W | 88.9 | Confident | 86.5 | Confident | 124 Ų | 124 | 73.8 Ų | 73.8 | 47% | 0.47 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -71.2 | -44.9 | -178.2 | -61.5 | 109.8 | 0 | 0 | 0 | 112.9 | F58 T67 L71 V73 G74 | F58-W69 PolarHBondContact O-NE1 3.01Å; T67-W69 PolarHBondContact O-N 3Å; T67-W69 PolarHBondContact OG1-N 3.29Å; W69-L71 VanDerWaalsContact C-N 3.32Å; W69-L71 PolarHBondContact O-N 2.81Å; W69-V73 HydrophobicContact CE3-CG2 3.99Å; W69-V73 WeakPolarHBondContact O-CB 3.27Å; W69-V73 PolarHBondContact O-N 3.36Å; W69-G74 PolarHBondContact O-N 3.45Å |
| 70 | S | 87.4 | Confident | 86.8 | Confident | 44 Ų | 44 | 74.9 Ų | 74.9 | 31% | 0.308 | 39% | 0.388 | S | S | . | . | I | π-helix | trans | -66.3 | -37.9 | 179.8 | 74.2 | 0 | 0 | 0 | 0 | 111.4 | R65 T67 G74 G75 | R65-S70 PolarHBondContact O-OG 3.1Å; R65-S70 VanDerWaalsContact O-OG 3.12Å; T67-S70 PolarHBondContact N-OG 2.86Å; T67-S70 PolarHBondContact O-N 3.32Å; T67-S70 PolarHBondContact O-OG 2.84Å; T67-S70 PolarHBondContact OG1-N 3.35Å; S70-G74 CarbonylContact O-C 3.26Å; S70-G74 WeakPolarHBondContact O-CA 3.37Å; S70-G74 PolarHBondContact O-N 3.03Å; S70-G75 PolarHBondContact O-N 3.17Å; S70-G75 VanDerWaalsContact O-N 3.1Å |
| 71 | L | 87.9 | Confident | 87 | Confident | 106 Ų | 106 | 70 Ų | 70 | 56% | 0.555 | 36% | 0.359 | S | S | * | . | I | π-helix | trans | -75.2 | -43.3 | 178.2 | -66.2 | 176.2 | 0 | 0 | 0 | 113 | Y66 T67 W69 G75 | Y66-L71 HydrophobicContact CD1-CD2 3.91Å; T67-L71 WeakPolarHBondContact O-CB 3.3Å; T67-L71 WeakPolarHBondContact O-CG 3.37Å; T67-L71 PolarHBondContact O-N 3.3Å; W69-L71 VanDerWaalsContact C-N 3.32Å; W69-L71 PolarHBondContact O-N 2.81Å; L71-G75 VanDerWaalsContact O-CA 3.23Å; L71-G75 WeakPolarHBondContact O-CA 3.36Å; L71-G75 PolarHBondContact O-N 2.96Å |
| 72 | S | 89.3 | Confident | 87.1 | Confident | 37 Ų | 37 | 71.3 Ų | 71.3 | 26% | 0.259 | 37% | 0.365 | S | S | . | . | I | π-helix | trans | -76.9 | -60 | -178.9 | 62.3 | 0 | 0 | 0 | 0 | 111.8 | F68 S76 | F68-S72 WeakPolarHBondContact O-CB 3.27Å; F68-S72 PolarHBondContact O-N 2.8Å; F68-S72 PolarHBondContact O-OG 2.97Å; S72-S76 WeakPolarHBondContact O-CB 3.4Å; S72-S76 PolarHBondContact O-N 2.9Å; S72-S76 PolarHBondContact O-OG 3.22Å |
| 73 | V | 89.2 | Confident | 87.6 | Confident | 78 Ų | 78 | 68.3 Ų | 68.3 | 47% | 0.473 | 34% | 0.34 | S | S | . | . | I | π-helix | trans | -74.3 | -52.4 | -175.4 | -178.2 | 0 | 0 | 0 | 0 | 110.3 | W69 S76 M77 | W69-V73 HydrophobicContact CE3-CG2 3.99Å; W69-V73 WeakPolarHBondContact O-CB 3.27Å; W69-V73 PolarHBondContact O-N 3.36Å; V73-S76 PolarHBondContact O-N 3.07Å; V73-M77 WeakPolarHBondContact O-CG 3.07Å; V73-M77 PolarHBondContact O-N 3.4Å |
| 74 | G | 87.6 | Confident | 87.9 | Confident | 34 Ų | 34 | 65.1 Ų | 65.1 | 35% | 0.351 | 34% | 0.342 | S | S | . | . | I | π-helix | trans | -62.7 | -46.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | W69 S70 S76 M77 V78 | W69-G74 PolarHBondContact O-N 3.45Å; S70-G74 CarbonylContact O-C 3.26Å; S70-G74 WeakPolarHBondContact O-CA 3.37Å; S70-G74 PolarHBondContact O-N 3.03Å; G74-S76 PolarHBondContact O-N 3.01Å; G74-M77 PolarHBondContact O-N 3.22Å; G74-V78 WeakPolarHBondContact O-CG2 3.46Å; G74-V78 PolarHBondContact O-N 3.49Å |
| 75 | G | 87.9 | Confident | 88.2 | Confident | 17 Ų | 17 | 63.8 Ų | 63.8 | 18% | 0.175 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -60.4 | -42.8 | 175 | 0 | 0 | 0 | 0 | 0 | 112.9 | S70 L71 M77 V78 W79 | S70-G75 PolarHBondContact O-N 3.17Å; S70-G75 VanDerWaalsContact O-N 3.1Å; L71-G75 VanDerWaalsContact O-CA 3.23Å; L71-G75 WeakPolarHBondContact O-CA 3.36Å; L71-G75 PolarHBondContact O-N 2.96Å; G75-M77 PolarHBondContact O-N 3.45Å; G75-V78 WeakPolarHBondContact O-CB 3.33Å; G75-V78 PolarHBondContact O-N 3.31Å; G75-W79 PolarHBondContact O-N 2.96Å |
| 76 | S | 89.9 | Confident | 88.8 | Confident | 76 Ų | 76 | 62 Ų | 62 | 53% | 0.531 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -61 | -42.7 | 176.9 | -65.5 | 0 | 0 | 0 | 0 | 112.2 | S72 V73 G74 W79 L80 | S72-S76 WeakPolarHBondContact O-CB 3.4Å; S72-S76 PolarHBondContact O-N 2.9Å; S72-S76 PolarHBondContact O-OG 3.22Å; V73-S76 PolarHBondContact O-N 3.07Å; G74-S76 PolarHBondContact O-N 3.01Å; S76-W79 PolarHBondContact O-N 3.31Å; S76-L80 WeakPolarHBondContact O-CB 3.15Å; S76-L80 PolarHBondContact O-N 3.4Å |
| 77 | M | 90 | Very high | 89 | Confident | 101 Ų | 101 | 59.2 Ų | 59.2 | 50% | 0.498 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -65.1 | -41.5 | 176.9 | -68.9 | -63.8 | 179.3 | 0 | 0 | 112 | V73 G74 G75 L80 S81 L252 | V73-M77 WeakPolarHBondContact O-CG 3.07Å; V73-M77 PolarHBondContact O-N 3.4Å; G74-M77 PolarHBondContact O-N 3.22Å; G75-M77 PolarHBondContact O-N 3.45Å; M77-L80 PolarHBondContact O-N 3.16Å; M77-S81 WeakPolarHBondContact O-CB 3.25Å; M77-S81 PolarHBondContact O-N 3.44Å; M77-L252 HydrophobicContact SD-CD2 4.13Å |
| 78 | V | 88.3 | Confident | 88.9 | Confident | 34 Ų | 34 | 59 Ų | 59 | 21% | 0.206 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -58.1 | -51.9 | 174.3 | 157.8 | 0 | 0 | 0 | 0 | 111.1 | G74 G75 S81 M82 F241 M244 | G74-V78 WeakPolarHBondContact O-CG2 3.46Å; G74-V78 PolarHBondContact O-N 3.49Å; G75-V78 WeakPolarHBondContact O-CB 3.33Å; G75-V78 PolarHBondContact O-N 3.31Å; V78-S81 PolarHBondContact O-N 2.8Å; V78-M82 WeakPolarHBondContact O-CG 3.42Å; V78-M82 PolarHBondContact O-N 3.35Å; V78-F241 HydrophobicContact CG1-CE1 4.3Å; V78-M244 HydrophobicContact CB-CE 4.2Å; V78-M244 HydrophobicContact CG1-CE 3.26Å; V78-M244 HydrophobicContact CG1-SD 4.45Å; V78-M244 HydrophobicContact CG2-CE 4Å |
| 79 | W | 89.3 | Confident | 88.8 | Confident | 105 Ų | 105 | 56.8 Ų | 56.8 | 40% | 0.398 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -67.4 | -39.3 | -178.9 | -71.4 | 117.9 | 0 | 0 | 0 | 112.1 | G75 S76 S81 M82 Y83 L113 | G75-W79 PolarHBondContact O-N 2.96Å; S76-W79 PolarHBondContact O-N 3.31Å; W79-S81 VanDerWaalsContact C-N 3.31Å; W79-S81 PolarHBondContact O-N 2.93Å; W79-M82 HydrophobicContact CE3-CB 4.5Å; W79-M82 PolarHBondContact O-N 3.46Å; W79-Y83 HydrophobicContact CD2-CE2 4.49Å; W79-Y83 HydrophobicContact CE3-CD2 4.22Å; W79-Y83 AromaticContact CE3-CE2 3.57Å; W79-Y83 HydrophobicContact CE3-CE2 3.57Å; W79-Y83 HydrophobicContact CZ3-CE2 4.11Å; W79-Y83 VanDerWaalsContact O-CD2 3.27Å; W79-Y83 WeakPolarHBondContact O-CD2 3.31Å; W79-Y83 PolarHBondContact O-N 3.22Å; W79-L113 HydrophobicContact CE3-CD2 4.04Å; W79-L113 HydrophobicContact CH2-CD1 4.02Å; W79-L113 HydrophobicContact CH2-CD2 3.42Å; W79-L113 VanDerWaalsContact CH2-CD2 3.42Å; W79-L113 HydrophobicContact CH2-CG 4.25Å; W79-L113 HydrophobicContact CZ2-CD2 3.98Å; W79-L113 HydrophobicContact CZ3-CD2 3.44Å; W79-L113 VanDerWaalsContact CZ3-CD2 3.44Å |
| 80 | L | 91.7 | Very high | 88.8 | Confident | 89 Ų | 89 | 52.8 Ų | 52.8 | 47% | 0.466 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -60.2 | -42.6 | 175.1 | -177.9 | 61.1 | 0 | 0 | 0 | 111.1 | S76 M77 G84 L252 | S76-L80 WeakPolarHBondContact O-CB 3.15Å; S76-L80 PolarHBondContact O-N 3.4Å; M77-L80 PolarHBondContact O-N 3.16Å; L80-G84 WeakPolarHBondContact O-CA 3.46Å; L80-G84 PolarHBondContact O-N 3.48Å; L80-L252 HydrophobicContact CB-CD2 4.44Å; L80-L252 HydrophobicContact CD2-CD1 4.18Å; L80-L252 HydrophobicContact CD2-CD2 4.28Å; L80-L252 HydrophobicContact CG-CD1 4.02Å; L80-L252 HydrophobicContact CG-CD2 4.38Å |
| 81 | S | 91.3 | Very high | 88.7 | Confident | 9 Ų | 9 | 53.1 Ų | 53.1 | 6% | 0.063 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -66.1 | -41.5 | 175.4 | -165.7 | 0 | 0 | 0 | 0 | 112.4 | M77 V78 W79 Y83 V85 N86 S248 | M77-S81 WeakPolarHBondContact O-CB 3.25Å; M77-S81 PolarHBondContact O-N 3.44Å; V78-S81 PolarHBondContact O-N 2.8Å; W79-S81 VanDerWaalsContact C-N 3.31Å; W79-S81 PolarHBondContact O-N 2.93Å; S81-Y83 VanDerWaalsContact C-N 3.34Å; S81-Y83 PolarHBondContact O-N 3.25Å; S81-V85 PolarHBondContact O-N 3.46Å; S81-V85 VanDerWaalsContact O-N 3.17Å; S81-N86 PolarHBondContact O-N 3.3Å; S81-N86 VanDerWaalsContact O-N 3.17Å; S81-S248 VanDerWaalsContact OG-CB 3.27Å; S81-S248 WeakPolarHBondContact OG-CB 3.48Å; S81-S248 PolarHBondContact OG-O 2.87Å |
| 82 | M | 88.5 | Confident | 88.5 | Confident | 61 Ų | 61 | 53 Ų | 53 | 30% | 0.3 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -63.6 | -37.3 | 179.5 | -78.2 | -62.1 | -134.7 | 0 | 0 | 112.8 | V78 W79 N86 Q89 M244 | V78-M82 WeakPolarHBondContact O-CG 3.42Å; V78-M82 PolarHBondContact O-N 3.35Å; W79-M82 HydrophobicContact CE3-CB 4.5Å; W79-M82 PolarHBondContact O-N 3.46Å; M82-N86 WeakPolarHBondContact O-CB 3.29Å; M82-Q89 VanDerWaalsContact O-CG 3.25Å; M82-Q89 WeakPolarHBondContact O-CG 3.34Å; M82-M244 HydrophobicContact CE-CE 4.38Å; M82-M244 HydrophobicContact CE-CG 4.5Å; M82-M244 HydrophobicContact CE-SD 3.07Å; M82-M244 WeakPolarHBondContact CE-SD 3.49Å; M82-M244 HydrophobicContact CG-SD 3.9Å; M82-M244 HydrophobicContact SD-SD 3.6Å; M82-M244 VanDerWaalsContact SD-SD 3.6Å |
| 83 | Y | 90.1 | Very high | 88.5 | Confident | 43 Ų | 43 | 53.1 Ų | 53.1 | 17% | 0.169 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -94.8 | -34.2 | -178 | -73.9 | -66.5 | 0 | 0 | 0 | 113.8 | W79 S81 Q89 Y93 L106 N109 L113 | W79-Y83 HydrophobicContact CD2-CE2 4.49Å; W79-Y83 HydrophobicContact CE3-CD2 4.22Å; W79-Y83 AromaticContact CE3-CE2 3.57Å; W79-Y83 HydrophobicContact CE3-CE2 3.57Å; W79-Y83 HydrophobicContact CZ3-CE2 4.11Å; W79-Y83 VanDerWaalsContact O-CD2 3.27Å; W79-Y83 WeakPolarHBondContact O-CD2 3.31Å; W79-Y83 PolarHBondContact O-N 3.22Å; S81-Y83 VanDerWaalsContact C-N 3.34Å; S81-Y83 PolarHBondContact O-N 3.25Å; Y83-Q89 HydrophobicContact CD1-CG 4.46Å; Y83-Y93 VanDerWaalsContact CD1-OH 3.28Å; Y83-Y93 WeakPolarHBondContact CD1-OH 3.43Å; Y83-L106 HydrophobicContact CD1-CD2 4Å; Y83-N109 WeakPolarHBondContact CE1-ND2 3.21Å; Y83-N109 VanDerWaalsContact CZ-ND2 3.3Å; Y83-N109 PolarHBondContact OH-ND2 3.31Å; Y83-L113 WeakPolarHBondContact OH-CD2 3.07Å |
| 84 | G | 88.7 | Confident | 88.4 | Confident | 45 Ų | 45 | 55.3 Ų | 55.3 | 46% | 0.464 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -84.8 | -31.1 | -174.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | L80 | L80-G84 WeakPolarHBondContact O-CA 3.46Å; L80-G84 PolarHBondContact O-N 3.48Å |
| 85 | V | 88.2 | Confident | 88.3 | Confident | 24 Ų | 24 | 57.6 Ų | 57.6 | 15% | 0.145 | 31% | 0.309 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -128.7 | -20.3 | -165.6 | -152.5 | 0 | 0 | 0 | 0 | 113.5 | S81 Q87 V251 L252 F255 | S81-V85 PolarHBondContact O-N 3.46Å; S81-V85 VanDerWaalsContact O-N 3.17Å; V85-Q87 PolarHBondContact O-N 2.91Å; V85-V251 HydrophobicContact CG1-CG1 3.72Å; V85-L252 HydrophobicContact CG2-CD1 3.7Å; V85-F255 HydrophobicContact CG1-CB 4.46Å; V85-F255 HydrophobicContact CG1-CD1 3.92Å; V85-F255 HydrophobicContact CG1-CD2 3.29Å; V85-F255 HydrophobicContact CG1-CE1 3.89Å; V85-F255 HydrophobicContact CG1-CE2 3.24Å; V85-F255 HydrophobicContact CG1-CG 3.62Å; V85-F255 HydrophobicContact CG1-CZ 3.55Å; V85-F255 HydrophobicContact CG2-CB 4.4Å; V85-F255 HydrophobicContact CG2-CG 4.32Å |
| 86 | N | 89.4 | Confident | 88.3 | Confident | 54 Ų | 54 | 58.8 Ų | 58.8 | 29% | 0.289 | 31% | 0.314 | S | S | . | . | trans | -68.7 | 121.3 | 178.6 | -170.7 | -34.7 | 0 | 0 | 0 | 111.1 | S81 M82 A88 Q89 V90 | S81-N86 PolarHBondContact O-N 3.3Å; S81-N86 VanDerWaalsContact O-N 3.17Å; M82-N86 WeakPolarHBondContact O-CB 3.29Å; N86-A88 VanDerWaalsContact C-N 3.26Å; N86-A88 PolarHBondContact O-N 3.03Å; N86-A88 WeakPolarHBondContact OD1-CB 3.23Å; N86-A88 PolarHBondContact OD1-N 3.08Å; N86-Q89 HydrophobicContact CB-CB 4.49Å; N86-Q89 HydrophobicContact CB-CG 4.45Å; N86-Q89 PolarHBondContact O-N 3.25Å; N86-V90 WeakPolarHBondContact O-CG2 3.3Å; N86-V90 PolarHBondContact O-N 2.93Å | ||
| 87 | Q | 88.4 | Confident | 88.3 | Confident | 68 Ų | 68 | 67.3 Ų | 67.3 | 32% | 0.318 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -55.8 | -39.1 | -178.7 | -177.1 | 73.7 | -27 | 0 | 0 | 113.6 | V85 Q89 V90 Q91 A185 V189 | V85-Q87 PolarHBondContact O-N 2.91Å; Q87-Q89 PolarHBondContact O-N 3.17Å; Q87-V90 PolarHBondContact O-N 3.16Å; Q87-Q91 HydrophobicContact CG-CG 4.13Å; Q87-Q91 WeakPolarHBondContact O-CB 3.1Å; Q87-Q91 VanDerWaalsContact O-CG 3.27Å; Q87-Q91 WeakPolarHBondContact O-CG 3.28Å; Q87-Q91 PolarHBondContact O-N 3.12Å; Q87-A185 HydrophobicContact CB-CB 4.4Å; Q87-A185 HydrophobicContact CG-CB 4.25Å; Q87-V189 HydrophobicContact CB-CG2 4Å; Q87-V189 HydrophobicContact CG-CG2 3.52Å |
| 88 | A | 85.6 | Confident | 88.5 | Confident | 5 Ų | 5 | 65.4 Ų | 65.4 | 4% | 0.041 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -57.8 | -34.6 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | N86 T181 A185 | N86-A88 VanDerWaalsContact C-N 3.26Å; N86-A88 PolarHBondContact O-N 3.03Å; N86-A88 WeakPolarHBondContact OD1-CB 3.23Å; N86-A88 PolarHBondContact OD1-N 3.08Å; A88-T181 HydrophobicContact CB-CG2 3.87Å; A88-A185 HydrophobicContact CB-CB 3.9Å |
| 89 | Q | 88.1 | Confident | 88.7 | Confident | 38 Ų | 38 | 70.9 Ų | 70.9 | 18% | 0.178 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -84.3 | -47.8 | 179.3 | -68.2 | -51.7 | -24.9 | 0 | 0 | 111.4 | M82 Y83 N86 Q87 Q91 R92 Y93 | M82-Q89 VanDerWaalsContact O-CG 3.25Å; M82-Q89 WeakPolarHBondContact O-CG 3.34Å; Y83-Q89 HydrophobicContact CD1-CG 4.46Å; N86-Q89 HydrophobicContact CB-CB 4.49Å; N86-Q89 HydrophobicContact CB-CG 4.45Å; N86-Q89 PolarHBondContact O-N 3.25Å; Q87-Q89 PolarHBondContact O-N 3.17Å; Q89-Q91 PolarHBondContact O-N 3.42Å; Q89-R92 WeakPolarHBondContact O-CB 3.38Å; Q89-R92 PolarHBondContact O-N 3.4Å; Q89-Y93 HydrophobicContact CB-CE2 3.78Å; Q89-Y93 WeakPolarHBondContact CB-OH 3.37Å; Q89-Y93 VanDerWaalsContact O-CD2 3.25Å; Q89-Y93 WeakPolarHBondContact O-CD2 3.34Å; Q89-Y93 WeakPolarHBondContact O-CE2 3.3Å; Q89-Y93 PolarHBondContact O-N 2.61Å; Q89-Y93 PolarHBondContact OE1-OH 3.23Å |
| 90 | V | 88.7 | Confident | 89 | Confident | 41 Ų | 41 | 73.3 Ų | 73.3 | 25% | 0.248 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -53.7 | -41.9 | 178.1 | 174 | 0 | 0 | 0 | 0 | 111.4 | N86 Q87 R92 Y93 I94 | N86-V90 WeakPolarHBondContact O-CG2 3.3Å; N86-V90 PolarHBondContact O-N 2.93Å; Q87-V90 PolarHBondContact O-N 3.16Å; V90-R92 VanDerWaalsContact C-N 3.25Å; V90-R92 PolarHBondContact O-N 3.44Å; V90-Y93 PolarHBondContact O-N 2.87Å; V90-Y93 VanDerWaalsContact O-N 3.13Å; V90-I94 HydrophobicContact CG1-CG2 4.3Å; V90-I94 PolarHBondContact O-N 3.34Å; V90-I94 VanDerWaalsContact O-N 3.08Å |
| 91 | Q | 84.5 | Confident | 89.1 | Confident | 51 Ų | 51 | 71 Ų | 71 | 24% | 0.238 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -58.5 | -33.8 | 176.9 | -76.9 | -179.4 | -1.9 | 0 | 0 | 113.7 | Q87 Q89 I94 S95 | Q87-Q91 HydrophobicContact CG-CG 4.13Å; Q87-Q91 WeakPolarHBondContact O-CB 3.1Å; Q87-Q91 VanDerWaalsContact O-CG 3.27Å; Q87-Q91 WeakPolarHBondContact O-CG 3.28Å; Q87-Q91 PolarHBondContact O-N 3.12Å; Q89-Q91 PolarHBondContact O-N 3.42Å; Q91-I94 WeakPolarHBondContact O-CG1 3.16Å; Q91-S95 WeakPolarHBondContact O-CB 3.41Å; Q91-S95 PolarHBondContact O-N 3.06Å; Q91-S95 PolarHBondContact O-OG 2.92Å |
| 92 | R | 84.8 | Confident | 89.2 | Confident | 104 Ų | 104 | 71.2 Ų | 71.2 | 39% | 0.392 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -71.3 | -36.3 | 178.8 | -66.2 | 173.4 | 175.9 | -163.3 | -4.9 | 111.2 | Q89 V90 C96 T181 | Q89-R92 WeakPolarHBondContact O-CB 3.38Å; Q89-R92 PolarHBondContact O-N 3.4Å; V90-R92 VanDerWaalsContact C-N 3.25Å; V90-R92 PolarHBondContact O-N 3.44Å; R92-C96 PolarHBondContact O-SG 3.46Å; R92-C96 VanDerWaalsContact O-SG 3.41Å; R92-T181 PolarHBondContact NH2-OG1 3.2Å; R92-T181 VanDerWaalsContact NH2-OG1 3.1Å |
| 93 | Y | 88.1 | Confident | 89.4 | Confident | 38 Ų | 38 | 73.3 Ų | 73.3 | 15% | 0.149 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -75.9 | -41.3 | -178.5 | -45.8 | -38.8 | 0 | 0 | 0 | 112.1 | Y83 Q89 V90 S95 C96 L106 | Y83-Y93 VanDerWaalsContact CD1-OH 3.28Å; Y83-Y93 WeakPolarHBondContact CD1-OH 3.43Å; Q89-Y93 HydrophobicContact CB-CE2 3.78Å; Q89-Y93 WeakPolarHBondContact CB-OH 3.37Å; Q89-Y93 VanDerWaalsContact O-CD2 3.25Å; Q89-Y93 WeakPolarHBondContact O-CD2 3.34Å; Q89-Y93 WeakPolarHBondContact O-CE2 3.3Å; Q89-Y93 PolarHBondContact O-N 2.61Å; Q89-Y93 PolarHBondContact OE1-OH 3.23Å; V90-Y93 PolarHBondContact O-N 2.87Å; V90-Y93 VanDerWaalsContact O-N 3.13Å; Y93-S95 PolarHBondContact O-N 3.25Å; Y93-C96 VanDerWaalsContact O-CB 3.29Å; Y93-C96 WeakPolarHBondContact O-CB 3.46Å; Y93-C96 PolarHBondContact O-N 3.41Å; Y93-C96 VanDerWaalsContact O-N 3.13Å; Y93-L106 HydrophobicContact CD1-CD1 4.3Å; Y93-L106 HydrophobicContact CD1-CD2 4.08Å; Y93-L106 HydrophobicContact CD1-CG 3.85Å; Y93-L106 HydrophobicContact CD2-CD1 4.45Å; Y93-L106 HydrophobicContact CD2-CD2 4.46Å; Y93-L106 HydrophobicContact CE1-CD1 4.38Å; Y93-L106 HydrophobicContact CE1-CD2 3.35Å; Y93-L106 HydrophobicContact CE1-CG 3.6Å; Y93-L106 HydrophobicContact CE2-CD1 4.48Å; Y93-L106 HydrophobicContact CE2-CD2 3.76Å; Y93-L106 HydrophobicContact CE2-CG 4.37Å; Y93-L106 HydrophobicContact CG-CD1 4.39Å; Y93-L106 HydrophobicContact CG-CG 4.42Å; Y93-L106 VanDerWaalsContact OH-CD2 3.26Å; Y93-L106 WeakPolarHBondContact OH-CD2 3.45Å |
| 94 | I | 87.6 | Confident | 89.6 | Confident | 125 Ų | 125 | 79.3 Ų | 79.3 | 64% | 0.641 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -68.7 | -20 | 176.5 | 66.9 | 179 | 0 | 0 | 0 | 113 | V90 Q91 C96 | V90-I94 HydrophobicContact CG1-CG2 4.3Å; V90-I94 PolarHBondContact O-N 3.34Å; V90-I94 VanDerWaalsContact O-N 3.08Å; Q91-I94 WeakPolarHBondContact O-CG1 3.16Å; I94-C96 VanDerWaalsContact C-N 3.28Å |
| 95 | S | 84.5 | Confident | 89.7 | Confident | 82 Ų | 82 | 79.3 Ų | 79.3 | 57% | 0.573 | 39% | 0.391 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.7 | -8.8 | 175.7 | -61.3 | 0 | 0 | 0 | 0 | 113 | Q91 Y93 | Q91-S95 WeakPolarHBondContact O-CB 3.41Å; Q91-S95 PolarHBondContact O-N 3.06Å; Q91-S95 PolarHBondContact O-OG 2.92Å; Y93-S95 PolarHBondContact O-N 3.25Å |
| 96 | C | 88 | Confident | 89.9 | Confident | 41 Ų | 41 | 81 Ų | 81 | 28% | 0.277 | 40% | 0.398 | S | S | . | . | S | Bend | trans | -73.7 | 148.5 | 176.5 | -68.9 | 0 | 0 | 0 | 0 | 111 | R92 Y93 I94 S98 A101 A102 | R92-C96 PolarHBondContact O-SG 3.46Å; R92-C96 VanDerWaalsContact O-SG 3.41Å; Y93-C96 VanDerWaalsContact O-CB 3.29Å; Y93-C96 WeakPolarHBondContact O-CB 3.46Å; Y93-C96 PolarHBondContact O-N 3.41Å; Y93-C96 VanDerWaalsContact O-N 3.13Å; I94-C96 VanDerWaalsContact C-N 3.28Å; C96-S98 PolarHBondContact O-N 2.88Å; C96-A101 HydrophobicContact CB-CB 4.36Å; C96-A102 HydrophobicContact CB-CB 3.93Å |
| 97 | R | 89.7 | Confident | 90.1 | Very high | 255 Ų | 255 | 83.9 Ų | 83.9 | 96% | 0.962 | 41% | 0.409 | S | S | * | . | S | Bend | trans | -66.1 | -24.6 | -177.9 | -69.9 | -176.4 | 174 | 177.5 | -2.7 | 114.2 | ||
| 98 | S | 94.8 | Very high | 90.3 | Very high | 62 Ų | 62 | 85.1 Ų | 85.1 | 43% | 0.434 | 42% | 0.42 | S | S | . | . | S | Bend | trans | -152.1 | 158.1 | -179.2 | 68 | 0 | 0 | 0 | 0 | 110.5 | C96 K100 A101 A102 | C96-S98 PolarHBondContact O-N 2.88Å; S98-K100 VanDerWaalsContact C-N 3.31Å; S98-K100 PolarHBondContact O-N 3.48Å; S98-A101 WeakPolarHBondContact O-CB 3.21Å; S98-A101 PolarHBondContact O-N 3.46Å; S98-A101 VanDerWaalsContact O-N 3.11Å; S98-A101 WeakPolarHBondContact OG-CB 3.42Å; S98-A101 PolarHBondContact OG-N 3.43Å; S98-A102 PolarHBondContact O-N 2.9Å |
| 99 | E | 93.4 | Very high | 90.5 | Very high | 149 Ų | 149 | 87.6 Ų | 87.6 | 70% | 0.696 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -58.3 | -43.3 | 175.6 | -171.7 | -173.3 | 157.9 | 0 | 0 | 111.7 | A101 A102 Q103 | E99-A101 VanDerWaalsContact C-N 3.28Å; E99-A101 PolarHBondContact O-N 2.86Å; E99-A102 WeakPolarHBondContact O-CB 3.48Å; E99-A102 PolarHBondContact O-N 3.43Å; E99-A102 VanDerWaalsContact O-N 3.09Å; E99-Q103 WeakPolarHBondContact O-CG 3.17Å; E99-Q103 PolarHBondContact O-N 3.07Å; E99-Q103 PolarHBondContact OE1-NE2 3.37Å |
| 100 | K | 94.8 | Very high | 90.6 | Very high | 156 Ų | 156 | 90 Ų | 90 | 68% | 0.678 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -58.8 | -39.7 | 175.4 | -69.1 | -173.5 | 178.8 | -179.6 | 0 | 112 | S98 Q103 W104 | S98-K100 VanDerWaalsContact C-N 3.31Å; S98-K100 PolarHBondContact O-N 3.48Å; K100-Q103 PolarHBondContact O-N 3.28Å; K100-W104 PolarHBondContact O-N 3Å |
| 101 | A | 93.8 | Very high | 90.9 | Very high | 41 Ų | 41 | 91.9 Ų | 91.9 | 34% | 0.339 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -66.4 | -38.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | C96 S98 E99 W104 A105 | C96-A101 HydrophobicContact CB-CB 4.36Å; S98-A101 WeakPolarHBondContact O-CB 3.21Å; S98-A101 PolarHBondContact O-N 3.46Å; S98-A101 VanDerWaalsContact O-N 3.11Å; S98-A101 WeakPolarHBondContact OG-CB 3.42Å; S98-A101 PolarHBondContact OG-N 3.43Å; E99-A101 VanDerWaalsContact C-N 3.28Å; E99-A101 PolarHBondContact O-N 2.86Å; A101-W104 PolarHBondContact O-N 3.43Å; A101-A105 WeakPolarHBondContact O-CB 3.23Å; A101-A105 PolarHBondContact O-N 2.68Å |
| 102 | A | 92.9 | Very high | 91.2 | Very high | 12 Ų | 12 | 90.6 Ų | 90.6 | 10% | 0.099 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -64.4 | -43.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | C96 S98 E99 W104 A105 L106 | C96-A102 HydrophobicContact CB-CB 3.93Å; S98-A102 PolarHBondContact O-N 2.9Å; E99-A102 WeakPolarHBondContact O-CB 3.48Å; E99-A102 PolarHBondContact O-N 3.43Å; E99-A102 VanDerWaalsContact O-N 3.09Å; A102-W104 PolarHBondContact O-N 3.45Å; A102-A105 PolarHBondContact O-N 2.78Å; A102-L106 WeakPolarHBondContact O-CB 3.4Å; A102-L106 PolarHBondContact O-N 2.68Å |
| 103 | Q | 93.8 | Very high | 91.5 | Very high | 106 Ų | 106 | 87.5 Ų | 87.5 | 50% | 0.495 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -60.3 | -44.6 | 175.6 | -70.6 | 172.3 | -7.4 | 0 | 0 | 111.7 | E99 K100 L106 F107 | E99-Q103 WeakPolarHBondContact O-CG 3.17Å; E99-Q103 PolarHBondContact O-N 3.07Å; E99-Q103 PolarHBondContact OE1-NE2 3.37Å; K100-Q103 PolarHBondContact O-N 3.28Å; Q103-L106 WeakPolarHBondContact O-CB 3.21Å; Q103-L106 PolarHBondContact O-N 2.99Å; Q103-F107 PolarHBondContact O-N 3.32Å |
| 104 | W | 94.4 | Very high | 91.6 | Very high | 169 Ų | 169 | 89 Ų | 89 | 64% | 0.64 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -65.2 | -40.9 | 175 | -85.1 | 109.7 | 0 | 0 | 0 | 112.6 | K100 A101 A102 L106 F107 V108 | K100-W104 PolarHBondContact O-N 3Å; A101-W104 PolarHBondContact O-N 3.43Å; A102-W104 PolarHBondContact O-N 3.45Å; W104-L106 VanDerWaalsContact C-N 3.33Å; W104-L106 PolarHBondContact O-N 2.68Å; W104-F107 HydrophobicContact CE3-CD1 4.06Å; W104-F107 AromaticContact CZ3-CD1 3.87Å; W104-F107 HydrophobicContact CZ3-CD1 3.87Å; W104-F107 HydrophobicContact CZ3-CE1 4.19Å; W104-F107 PolarHBondContact O-N 3.49Å; W104-V108 WeakPolarHBondContact O-CG2 3.48Å; W104-V108 PolarHBondContact O-N 2.91Å |
| 105 | A | 91 | Very high | 91.9 | Very high | 45 Ų | 45 | 87.4 Ų | 87.4 | 37% | 0.372 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -61.2 | -42.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | A101 A102 N109 | A101-A105 WeakPolarHBondContact O-CB 3.23Å; A101-A105 PolarHBondContact O-N 2.68Å; A102-A105 PolarHBondContact O-N 2.78Å; A105-N109 VanDerWaalsContact O-CB 3.27Å; A105-N109 WeakPolarHBondContact O-CB 3.44Å; A105-N109 PolarHBondContact O-N 2.91Å |
| 106 | L | 91.8 | Very high | 92.3 | Very high | 58 Ų | 58 | 85.2 Ų | 85.2 | 30% | 0.304 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -59.5 | -46.9 | 173.3 | -84.9 | 169 | 0 | 0 | 0 | 112.2 | Y83 Y93 A102 Q103 W104 N109 Q110 | Y83-L106 HydrophobicContact CD1-CD2 4Å; Y93-L106 HydrophobicContact CD1-CD1 4.3Å; Y93-L106 HydrophobicContact CD1-CD2 4.08Å; Y93-L106 HydrophobicContact CD1-CG 3.85Å; Y93-L106 HydrophobicContact CD2-CD1 4.45Å; Y93-L106 HydrophobicContact CD2-CD2 4.46Å; Y93-L106 HydrophobicContact CE1-CD1 4.38Å; Y93-L106 HydrophobicContact CE1-CD2 3.35Å; Y93-L106 HydrophobicContact CE1-CG 3.6Å; Y93-L106 HydrophobicContact CE2-CD1 4.48Å; Y93-L106 HydrophobicContact CE2-CD2 3.76Å; Y93-L106 HydrophobicContact CE2-CG 4.37Å; Y93-L106 HydrophobicContact CG-CD1 4.39Å; Y93-L106 HydrophobicContact CG-CG 4.42Å; Y93-L106 VanDerWaalsContact OH-CD2 3.26Å; Y93-L106 WeakPolarHBondContact OH-CD2 3.45Å; A102-L106 WeakPolarHBondContact O-CB 3.4Å; A102-L106 PolarHBondContact O-N 2.68Å; Q103-L106 WeakPolarHBondContact O-CB 3.21Å; Q103-L106 PolarHBondContact O-N 2.99Å; W104-L106 VanDerWaalsContact C-N 3.33Å; W104-L106 PolarHBondContact O-N 2.68Å; L106-N109 WeakPolarHBondContact O-CB 3.37Å; L106-N109 PolarHBondContact O-N 2.96Å; L106-Q110 PolarHBondContact O-N 2.99Å |
| 107 | F | 93.1 | Very high | 92.4 | Very high | 116 Ų | 116 | 87 Ų | 87 | 51% | 0.509 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -63.2 | -47 | -180 | -178.7 | -106.2 | 0 | 0 | 0 | 112.4 | Q103 W104 N109 Q110 I111 | Q103-F107 PolarHBondContact O-N 3.32Å; W104-F107 HydrophobicContact CE3-CD1 4.06Å; W104-F107 AromaticContact CZ3-CD1 3.87Å; W104-F107 HydrophobicContact CZ3-CD1 3.87Å; W104-F107 HydrophobicContact CZ3-CE1 4.19Å; W104-F107 PolarHBondContact O-N 3.49Å; F107-N109 VanDerWaalsContact C-N 3.29Å; F107-N109 PolarHBondContact O-N 2.95Å; F107-Q110 PolarHBondContact O-N 2.94Å; F107-Q110 VanDerWaalsContact O-N 3.15Å; F107-I111 HydrophobicContact CD1-CD1 3.81Å; F107-I111 HydrophobicContact CE1-CD1 3.29Å; F107-I111 HydrophobicContact CE1-CG1 4.33Å; F107-I111 HydrophobicContact CE2-CD1 4.36Å; F107-I111 HydrophobicContact CZ-CD1 3.61Å; F107-I111 HydrophobicContact CZ-CG1 4.32Å; F107-I111 PolarHBondContact O-N 3.24Å |
| 108 | V | 92.1 | Very high | 92.6 | Very high | 93 Ų | 93 | 77.8 Ų | 77.8 | 56% | 0.564 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -60.7 | -41.7 | 176.2 | 172 | 0 | 0 | 0 | 0 | 110.9 | W104 Q110 I111 G112 | W104-V108 WeakPolarHBondContact O-CG2 3.48Å; W104-V108 PolarHBondContact O-N 2.91Å; V108-Q110 VanDerWaalsContact C-N 3.34Å; V108-Q110 PolarHBondContact O-N 3.31Å; V108-I111 PolarHBondContact O-N 3.45Å; V108-G112 PolarHBondContact O-N 3.41Å |
| 109 | N | 90.4 | Very high | 92.5 | Very high | 58 Ų | 58 | 76.2 Ų | 76.2 | 31% | 0.31 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -61.5 | -41.1 | 175.4 | 174.1 | 79.5 | 0 | 0 | 0 | 112.1 | Y83 A105 L106 F107 G112 L113 | Y83-N109 WeakPolarHBondContact CE1-ND2 3.21Å; Y83-N109 VanDerWaalsContact CZ-ND2 3.3Å; Y83-N109 PolarHBondContact OH-ND2 3.31Å; A105-N109 VanDerWaalsContact O-CB 3.27Å; A105-N109 WeakPolarHBondContact O-CB 3.44Å; A105-N109 PolarHBondContact O-N 2.91Å; L106-N109 WeakPolarHBondContact O-CB 3.37Å; L106-N109 PolarHBondContact O-N 2.96Å; F107-N109 VanDerWaalsContact C-N 3.29Å; F107-N109 PolarHBondContact O-N 2.95Å; N109-G112 PolarHBondContact O-N 3.16Å; N109-L113 WeakPolarHBondContact O-CB 3.25Å; N109-L113 PolarHBondContact O-N 2.96Å |
| 110 | Q | 91.2 | Very high | 92.5 | Very high | 87 Ų | 87 | 70.8 Ų | 70.8 | 41% | 0.407 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -65.2 | -39.9 | 177.8 | -171.2 | 57.6 | 43.5 | 0 | 0 | 112.4 | L106 F107 V108 C114 | L106-Q110 PolarHBondContact O-N 2.99Å; F107-Q110 PolarHBondContact O-N 2.94Å; F107-Q110 VanDerWaalsContact O-N 3.15Å; V108-Q110 VanDerWaalsContact C-N 3.34Å; V108-Q110 PolarHBondContact O-N 3.31Å; Q110-C114 WeakPolarHBondContact O-CB 3.38Å; Q110-C114 PolarHBondContact O-N 3.45Å |
| 111 | I | 93.4 | Very high | 92.4 | Very high | 81 Ų | 81 | 66 Ų | 66 | 42% | 0.415 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -62.1 | -48.6 | 173 | -67.5 | 170 | 0 | 0 | 0 | 110.2 | F107 V108 L113 C114 L115 | F107-I111 HydrophobicContact CD1-CD1 3.81Å; F107-I111 HydrophobicContact CE1-CD1 3.29Å; F107-I111 HydrophobicContact CE1-CG1 4.33Å; F107-I111 HydrophobicContact CE2-CD1 4.36Å; F107-I111 HydrophobicContact CZ-CD1 3.61Å; F107-I111 HydrophobicContact CZ-CG1 4.32Å; F107-I111 PolarHBondContact O-N 3.24Å; V108-I111 PolarHBondContact O-N 3.45Å; I111-L113 PolarHBondContact O-N 2.94Å; I111-C114 PolarHBondContact O-N 2.7Å; I111-L115 HydrophobicContact CG2-CD1 3.99Å; I111-L115 HydrophobicContact CG2-CG 4.4Å; I111-L115 WeakPolarHBondContact O-CG 3.41Å; I111-L115 PolarHBondContact O-N 2.99Å |
| 112 | G | 91.6 | Very high | 92.4 | Very high | 24 Ų | 24 | 66.9 Ų | 66.9 | 25% | 0.247 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -58.8 | -45.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | V108 N109 L115 I116 | V108-G112 PolarHBondContact O-N 3.41Å; N109-G112 PolarHBondContact O-N 3.16Å; G112-L115 PolarHBondContact O-N 3.29Å; G112-I116 WeakPolarHBondContact O-CD1 3.29Å; G112-I116 VanDerWaalsContact O-CG1 3.29Å; G112-I116 WeakPolarHBondContact O-CG1 3.45Å; G112-I116 PolarHBondContact O-N 3.47Å |
| 113 | L | 90.2 | Very high | 92.5 | Very high | 39 Ų | 39 | 66.3 Ų | 66.3 | 20% | 0.204 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -60.4 | -46.3 | 175.6 | 178 | 66.7 | 0 | 0 | 0 | 111.5 | W79 Y83 N109 I111 L115 I116 V117 | W79-L113 HydrophobicContact CE3-CD2 4.04Å; W79-L113 HydrophobicContact CH2-CD1 4.02Å; W79-L113 HydrophobicContact CH2-CD2 3.42Å; W79-L113 VanDerWaalsContact CH2-CD2 3.42Å; W79-L113 HydrophobicContact CH2-CG 4.25Å; W79-L113 HydrophobicContact CZ2-CD2 3.98Å; W79-L113 HydrophobicContact CZ3-CD2 3.44Å; W79-L113 VanDerWaalsContact CZ3-CD2 3.44Å; Y83-L113 WeakPolarHBondContact OH-CD2 3.07Å; N109-L113 WeakPolarHBondContact O-CB 3.25Å; N109-L113 PolarHBondContact O-N 2.96Å; I111-L113 PolarHBondContact O-N 2.94Å; L113-L115 VanDerWaalsContact C-N 3.33Å; L113-L115 PolarHBondContact O-N 3.36Å; L113-I116 PolarHBondContact O-N 2.97Å; L113-V117 HydrophobicContact CD1-CG2 3.81Å; L113-V117 HydrophobicContact CG-CG2 4.27Å; L113-V117 WeakPolarHBondContact O-CB 3.4Å; L113-V117 VanDerWaalsContact O-CG2 3.3Å; L113-V117 WeakPolarHBondContact O-CG2 3.21Å; L113-V117 PolarHBondContact O-N 3.48Å |
| 114 | C | 91.4 | Very high | 92.5 | Very high | 70 Ų | 70 | 62.4 Ų | 62.4 | 47% | 0.473 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -59.4 | -44.3 | 178.1 | -176.9 | 0 | 0 | 0 | 0 | 111.5 | Q110 I111 S118 | Q110-C114 WeakPolarHBondContact O-CB 3.38Å; Q110-C114 PolarHBondContact O-N 3.45Å; I111-C114 PolarHBondContact O-N 2.7Å; C114-S118 WeakPolarHBondContact O-CB 3.31Å; C114-S118 PolarHBondContact O-N 3.4Å; C114-S118 PolarHBondContact O-OG 3.46Å |
| 115 | L | 94.3 | Very high | 92.5 | Very high | 92 Ų | 92 | 56.8 Ų | 56.8 | 48% | 0.482 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -62.1 | -46.3 | 177 | -71 | 172.7 | 0 | 0 | 0 | 112.1 | I111 G112 L113 S119 | I111-L115 HydrophobicContact CG2-CD1 3.99Å; I111-L115 HydrophobicContact CG2-CG 4.4Å; I111-L115 WeakPolarHBondContact O-CG 3.41Å; I111-L115 PolarHBondContact O-N 2.99Å; G112-L115 PolarHBondContact O-N 3.29Å; L113-L115 VanDerWaalsContact C-N 3.33Å; L113-L115 PolarHBondContact O-N 3.36Å; L115-S119 VanDerWaalsContact O-CB 3.31Å; L115-S119 WeakPolarHBondContact O-CB 3.41Å; L115-S119 PolarHBondContact O-N 3.21Å; L115-S119 PolarHBondContact O-OG 3.33Å |
| 116 | I | 91.4 | Very high | 92.8 | Very high | 35 Ų | 35 | 54.7 Ų | 54.7 | 18% | 0.179 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -65.4 | -49.4 | -178.7 | -70.6 | 164.1 | 0 | 0 | 0 | 110.9 | I19 M22 L23 F26 G112 L113 S118 S119 A120 | I19-I116 HydrophobicContact CG2-CD1 4.48Å; M22-I116 HydrophobicContact CE-CB 4.31Å; M22-I116 HydrophobicContact CE-CD1 3.42Å; M22-I116 VanDerWaalsContact CE-CD1 3.42Å; M22-I116 HydrophobicContact CE-CG1 3.7Å; M22-I116 HydrophobicContact CE-CG2 3.61Å; L23-I116 HydrophobicContact CD2-CG1 3.92Å; L23-I116 HydrophobicContact CG-CG1 4.42Å; F26-I116 HydrophobicContact CE2-CG2 4.24Å; G112-I116 WeakPolarHBondContact O-CD1 3.29Å; G112-I116 VanDerWaalsContact O-CG1 3.29Å; G112-I116 WeakPolarHBondContact O-CG1 3.45Å; G112-I116 PolarHBondContact O-N 3.47Å; L113-I116 PolarHBondContact O-N 2.97Å; I116-S118 PolarHBondContact O-N 2.87Å; I116-S119 PolarHBondContact O-N 3.33Å; I116-A120 WeakPolarHBondContact O-CB 2.99Å; I116-A120 PolarHBondContact O-N 3.49Å |
| 117 | V | 90.8 | Very high | 92.9 | Very high | 79 Ų | 79 | 53.3 Ų | 53.3 | 48% | 0.479 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -64.2 | -42.4 | -179.1 | 172.9 | 0 | 0 | 0 | 0 | 110.8 | L113 A120 A121 | L113-V117 HydrophobicContact CD1-CG2 3.81Å; L113-V117 HydrophobicContact CG-CG2 4.27Å; L113-V117 WeakPolarHBondContact O-CB 3.4Å; L113-V117 VanDerWaalsContact O-CG2 3.3Å; L113-V117 WeakPolarHBondContact O-CG2 3.21Å; L113-V117 PolarHBondContact O-N 3.48Å; V117-A120 PolarHBondContact O-N 3.39Å; V117-A121 WeakPolarHBondContact O-CB 3.41Å; V117-A121 PolarHBondContact O-N 3.06Å |
| 118 | S | 92.9 | Very high | 93 | Very high | 62 Ų | 62 | 49.8 Ų | 49.8 | 43% | 0.434 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -63.8 | -43.2 | 177.1 | -55.9 | 0 | 0 | 0 | 0 | 111.4 | C114 I116 A121 T122 | C114-S118 WeakPolarHBondContact O-CB 3.31Å; C114-S118 PolarHBondContact O-N 3.4Å; C114-S118 PolarHBondContact O-OG 3.46Å; I116-S118 PolarHBondContact O-N 2.87Å; S118-A121 PolarHBondContact O-N 2.6Å; S118-T122 WeakPolarHBondContact O-CG2 3.39Å; S118-T122 PolarHBondContact O-N 3.39Å; S118-T122 PolarHBondContact O-OG1 3.4Å |
| 119 | S | 94.3 | Very high | 93 | Very high | 29 Ų | 29 | 45.5 Ų | 45.5 | 20% | 0.203 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -62.9 | -44.3 | 177.4 | -56.2 | 0 | 0 | 0 | 0 | 111.6 | L115 I116 A121 T122 C123 | L115-S119 VanDerWaalsContact O-CB 3.31Å; L115-S119 WeakPolarHBondContact O-CB 3.41Å; L115-S119 PolarHBondContact O-N 3.21Å; L115-S119 PolarHBondContact O-OG 3.33Å; I116-S119 PolarHBondContact O-N 3.33Å; S119-A121 PolarHBondContact O-N 2.91Å; S119-T122 WeakPolarHBondContact CA-OG1 3.4Å; S119-T122 PolarHBondContact O-N 3.02Å; S119-T122 PolarHBondContact O-OG1 3.06Å; S119-C123 PolarHBondContact O-N 2.9Å; S119-C123 PolarHBondContact O-SG 3.43Å |
| 120 | A | 92.8 | Very high | 93.2 | Very high | 34 Ų | 34 | 46.2 Ų | 46.2 | 28% | 0.281 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -62 | -43.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | F26 I116 V117 C123 G124 | F26-A120 HydrophobicContact CE1-CB 4.02Å; F26-A120 HydrophobicContact CE2-CB 4.39Å; F26-A120 HydrophobicContact CZ-CB 3.83Å; I116-A120 WeakPolarHBondContact O-CB 2.99Å; I116-A120 PolarHBondContact O-N 3.49Å; V117-A120 PolarHBondContact O-N 3.39Å; A120-C123 PolarHBondContact O-N 3.34Å; A120-G124 PolarHBondContact O-N 3.36Å |
| 121 | A | 92.8 | Very high | 93.3 | Very high | 56 Ų | 56 | 43 Ų | 43 | 46% | 0.463 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -61.8 | -44.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | V117 S118 S119 C123 G124 I125 | V117-A121 WeakPolarHBondContact O-CB 3.41Å; V117-A121 PolarHBondContact O-N 3.06Å; S118-A121 PolarHBondContact O-N 2.6Å; S119-A121 PolarHBondContact O-N 2.91Å; A121-C123 VanDerWaalsContact C-N 3.34Å; A121-C123 PolarHBondContact O-N 3.13Å; A121-G124 WeakPolarHBondContact O-CA 3.3Å; A121-G124 PolarHBondContact O-N 3.01Å; A121-G124 VanDerWaalsContact O-N 3.13Å; A121-I125 PolarHBondContact O-N 3.43Å |
| 122 | T | 94.3 | Very high | 93.1 | Very high | 59 Ų | 59 | 41.2 Ų | 41.2 | 36% | 0.362 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -62.7 | -39.2 | 175.4 | 54.2 | 0 | 0 | 0 | 0 | 112.7 | S118 S119 G124 I125 V126 | S118-T122 WeakPolarHBondContact O-CG2 3.39Å; S118-T122 PolarHBondContact O-N 3.39Å; S118-T122 PolarHBondContact O-OG1 3.4Å; S119-T122 WeakPolarHBondContact CA-OG1 3.4Å; S119-T122 PolarHBondContact O-N 3.02Å; S119-T122 PolarHBondContact O-OG1 3.06Å; T122-G124 VanDerWaalsContact C-N 3.31Å; T122-G124 PolarHBondContact O-N 2.95Å; T122-I125 PolarHBondContact O-N 2.93Å; T122-V126 WeakPolarHBondContact O-CG2 3.38Å; T122-V126 PolarHBondContact O-N 2.84Å; T122-V126 VanDerWaalsContact O-N 3.08Å |
| 123 | C | 95.1 | Very high | 92.8 | Very high | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -64.6 | -36.9 | 173.7 | -66 | 0 | 0 | 0 | 0 | 111.6 | F26 I29 S119 A120 A121 I125 V126 M127 M149 | F26-C123 HydrophobicContact CD1-CB 4.41Å; F26-C123 PolarHBondContact O-SG 3.37Å; F26-C123 VanDerWaalsContact O-SG 3.39Å; I29-C123 HydrophobicContact CG2-CB 4.08Å; S119-C123 PolarHBondContact O-N 2.9Å; S119-C123 PolarHBondContact O-SG 3.43Å; A120-C123 PolarHBondContact O-N 3.34Å; A121-C123 VanDerWaalsContact C-N 3.34Å; A121-C123 PolarHBondContact O-N 3.13Å; C123-I125 VanDerWaalsContact C-N 3.33Å; C123-I125 PolarHBondContact O-N 3.07Å; C123-V126 PolarHBondContact O-N 3.35Å; C123-M127 VanDerWaalsContact O-CB 3.28Å; C123-M127 WeakPolarHBondContact O-CB 3.42Å; C123-M127 PolarHBondContact O-N 3.39Å; C123-M149 HydrophobicContact CB-CE 3.75Å; C123-M149 HydrophobicContact CB-SD 4.49Å |
| 124 | G | 94.1 | Very high | 92.7 | Very high | 25 Ų | 25 | 43.7 Ų | 43.7 | 26% | 0.258 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -61.8 | -37.8 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | A120 A121 T122 F128 | A120-G124 PolarHBondContact O-N 3.36Å; A121-G124 WeakPolarHBondContact O-CA 3.3Å; A121-G124 PolarHBondContact O-N 3.01Å; A121-G124 VanDerWaalsContact O-N 3.13Å; T122-G124 VanDerWaalsContact C-N 3.31Å; T122-G124 PolarHBondContact O-N 2.95Å; G124-F128 PolarHBondContact O-N 3.39Å |
| 125 | I | 94.4 | Very high | 92.6 | Very high | 50 Ų | 50 | 40.8 Ų | 40.8 | 26% | 0.256 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -66.1 | -46.5 | 174.4 | -65.8 | 162.2 | 0 | 0 | 0 | 110.9 | V43 A47 L53 A121 T122 C123 M127 F128 A129 | V43-I125 HydrophobicContact CG1-CG2 4.08Å; A47-I125 HydrophobicContact CB-CG2 3.62Å; L53-I125 HydrophobicContact CD2-CD1 3.74Å; L53-I125 HydrophobicContact CD2-CG1 4.35Å; A121-I125 PolarHBondContact O-N 3.43Å; T122-I125 PolarHBondContact O-N 2.93Å; C123-I125 VanDerWaalsContact C-N 3.33Å; C123-I125 PolarHBondContact O-N 3.07Å; I125-M127 VanDerWaalsContact C-N 3.32Å; I125-M127 PolarHBondContact O-N 2.9Å; I125-F128 PolarHBondContact O-N 2.78Å; I125-A129 PolarHBondContact O-N 3.22Å |
| 126 | V | 96.1 | Very high | 92.4 | Very high | 1 Ų | 1 | 36.4 Ų | 36.4 | 1% | 0.006 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -60.8 | -43.5 | 176.9 | 175.6 | 0 | 0 | 0 | 0 | 110.8 | F30 G33 V43 T122 C123 F128 A129 Y130 F152 | F30-V126 HydrophobicContact CD2-CG2 3.75Å; F30-V126 HydrophobicContact CE2-CG2 3.96Å; G33-V126 VanDerWaalsContact C-CG1 3.41Å; V43-V126 HydrophobicContact CG1-CG2 4.06Å; T122-V126 WeakPolarHBondContact O-CG2 3.38Å; T122-V126 PolarHBondContact O-N 2.84Å; T122-V126 VanDerWaalsContact O-N 3.08Å; C123-V126 PolarHBondContact O-N 3.35Å; V126-F128 PolarHBondContact O-N 2.88Å; V126-A129 PolarHBondContact O-N 3.43Å; V126-Y130 PolarHBondContact O-N 2.97Å; V126-F152 HydrophobicContact CG1-CZ 4.2Å |
| 127 | M | 95.2 | Very high | 92.3 | Very high | 30 Ų | 30 | 37.3 Ų | 37.3 | 15% | 0.148 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -60.9 | -43.7 | 176.3 | -179.1 | -172.6 | 79 | 0 | 0 | 111.9 | C123 I125 A129 Y130 Y131 Y148 F152 | C123-M127 VanDerWaalsContact O-CB 3.28Å; C123-M127 WeakPolarHBondContact O-CB 3.42Å; C123-M127 PolarHBondContact O-N 3.39Å; I125-M127 VanDerWaalsContact C-N 3.32Å; I125-M127 PolarHBondContact O-N 2.9Å; M127-A129 VanDerWaalsContact C-N 3.35Å; M127-Y130 PolarHBondContact O-N 3.46Å; M127-Y131 HydrophobicContact CG-CD2 3.88Å; M127-Y131 HydrophobicContact CG-CE2 4.1Å; M127-Y131 WeakPolarHBondContact O-CD2 3.47Å; M127-Y131 PolarHBondContact O-N 2.67Å; M127-Y148 HydrophobicContact CE-CD1 4.41Å; M127-Y148 HydrophobicContact CE-CG 4.14Å; M127-F152 HydrophobicContact CB-CD1 3.84Å; M127-F152 HydrophobicContact CB-CD2 4.43Å; M127-F152 HydrophobicContact CB-CE1 3.88Å; M127-F152 HydrophobicContact CB-CE2 4.46Å; M127-F152 HydrophobicContact CB-CG 4.13Å; M127-F152 HydrophobicContact CB-CZ 4.2Å; M127-F152 HydrophobicContact CG-CB 4.01Å; M127-F152 HydrophobicContact CG-CD1 3.94Å; M127-F152 HydrophobicContact CG-CD2 4.06Å; M127-F152 HydrophobicContact CG-CE1 4.41Å; M127-F152 HydrophobicContact CG-CG 3.74Å; M127-F152 HydrophobicContact SD-CB 4.11Å; M127-F152 HydrophobicContact SD-CD1 4.5Å; M127-F152 HydrophobicContact SD-CG 4.39Å |
| 128 | F | 93.5 | Very high | 92 | Very high | 42 Ų | 42 | 39.5 Ų | 39.5 | 18% | 0.184 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -60.1 | -45.2 | 173.6 | 169.1 | -96.9 | 0 | 0 | 0 | 111.5 | I46 R52 G124 I125 V126 Y130 Y131 N132 | I46-F128 HydrophobicContact CG2-CE1 4.18Å; R52-F128 HydrophobicContact CB-CD1 4.42Å; R52-F128 HydrophobicContact CB-CE1 4.46Å; R52-F128 HydrophobicContact CG-CD1 3.63Å; R52-F128 HydrophobicContact CG-CD2 4.06Å; R52-F128 HydrophobicContact CG-CE1 3.49Å; R52-F128 VanDerWaalsContact CG-CE1 3.49Å; R52-F128 HydrophobicContact CG-CE2 3.94Å; R52-F128 HydrophobicContact CG-CG 3.91Å; R52-F128 HydrophobicContact CG-CZ 3.65Å; G124-F128 PolarHBondContact O-N 3.39Å; I125-F128 PolarHBondContact O-N 2.78Å; V126-F128 PolarHBondContact O-N 2.88Å; F128-Y130 VanDerWaalsContact C-N 3.27Å; F128-Y130 PolarHBondContact O-N 3.4Å; F128-Y131 CarbonylContact O-C 3.54Å; F128-Y131 PolarHBondContact O-N 3.35Å; F128-N132 WeakPolarHBondContact O-CA 3.4Å; F128-N132 WeakPolarHBondContact O-CB 3.46Å; F128-N132 PolarHBondContact O-N 2.96Å |
| 129 | A | 93.7 | Very high | 91.8 | Very high | 3 Ų | 3 | 37.8 Ų | 37.8 | 3% | 0.025 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -62.7 | -36.1 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | V37 V43 I46 I125 V126 M127 | V37-A129 HydrophobicContact CG1-CB 4.15Å; V37-A129 HydrophobicContact CG2-CB 4.3Å; V43-A129 HydrophobicContact CB-CB 4.28Å; V43-A129 HydrophobicContact CG1-CB 3.98Å; V43-A129 HydrophobicContact CG2-CB 4.27Å; I46-A129 HydrophobicContact CB-CB 4.19Å; I46-A129 HydrophobicContact CD1-CB 4.43Å; I46-A129 HydrophobicContact CG2-CB 4.02Å; I125-A129 PolarHBondContact O-N 3.22Å; V126-A129 PolarHBondContact O-N 3.43Å; M127-A129 VanDerWaalsContact C-N 3.35Å |
| 130 | Y | 93.9 | Very high | 91.4 | Very high | 72 Ų | 72 | 39.3 Ų | 39.3 | 28% | 0.282 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -70 | -38.8 | 176.2 | -176.4 | -97.4 | 0 | 0 | 0 | 113.3 | L36 V37 V126 M127 F128 F152 D155 | L36-Y130 HydrophobicContact CB-CD2 4.12Å; L36-Y130 HydrophobicContact CB-CE2 3.94Å; L36-Y130 HydrophobicContact CD1-CE2 4.11Å; V37-Y130 HydrophobicContact CG2-CD2 4.2Å; V126-Y130 PolarHBondContact O-N 2.97Å; M127-Y130 PolarHBondContact O-N 3.46Å; F128-Y130 VanDerWaalsContact C-N 3.27Å; F128-Y130 PolarHBondContact O-N 3.4Å; Y130-F152 HydrophobicContact CD1-CD2 4.05Å; Y130-F152 AromaticContact CD1-CE2 3.68Å; Y130-F152 HydrophobicContact CD1-CE2 3.68Å; Y130-F152 HydrophobicContact CE1-CE2 4.34Å; Y130-F152 AromaticContact CG-CE2 3.78Å; Y130-F152 HydrophobicContact CG-CE2 3.78Å; Y130-D155 WeakPolarHBondContact CE1-OD2 3.38Å; Y130-D155 PolarHBondContact OH-OD2 3.49Å |
| 131 | Y | 93 | Very high | 91.2 | Very high | 20 Ų | 20 | 42.8 Ų | 42.8 | 8% | 0.078 | 24% | 0.239 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -99.4 | 16.2 | -179.4 | -67.2 | -54.9 | 0 | 0 | 0 | 114.4 | M127 F128 L133 C134 P136 Y151 F152 D155 | M127-Y131 HydrophobicContact CG-CD2 3.88Å; M127-Y131 HydrophobicContact CG-CE2 4.1Å; M127-Y131 WeakPolarHBondContact O-CD2 3.47Å; M127-Y131 PolarHBondContact O-N 2.67Å; F128-Y131 CarbonylContact O-C 3.54Å; F128-Y131 PolarHBondContact O-N 3.35Å; Y131-L133 VanDerWaalsContact C-N 3.25Å; Y131-L133 PolarHBondContact O-N 3.08Å; Y131-L133 VanDerWaalsContact O-N 3.16Å; Y131-C134 WeakPolarHBondContact CB-O 3.49Å; Y131-C134 WeakPolarHBondContact CD1-O 3.24Å; Y131-C134 CarbonylContact O-C 3.6Å; Y131-C134 VanDerWaalsContact O-C 3.26Å; Y131-C134 PolarHBondContact O-N 2.86Å; Y131-C134 VanDerWaalsContact O-N 3.16Å; Y131-P136 HydrophobicContact CD1-CG 4.35Å; Y131-P136 HydrophobicContact CD2-CG 4.1Å; Y131-P136 HydrophobicContact CE2-CG 4.23Å; Y131-P136 HydrophobicContact CG-CG 4.17Å; Y131-Y151 HydrophobicContact CE1-CE1 4.29Å; Y131-Y151 HydrophobicContact CE2-CD1 4.5Å; Y131-Y151 AromaticContact CZ-CE1 3.92Å; Y131-Y151 WeakPolarHBondContact OH-CD1 3.34Å; Y131-Y151 WeakPolarHBondContact OH-CE1 3.36Å; Y131-F152 HydrophobicContact CD2-CD2 4.39Å; Y131-F152 HydrophobicContact CE2-CB 4.07Å; Y131-F152 AromaticContact CE2-CD2 3.56Å; Y131-F152 HydrophobicContact CE2-CD2 3.56Å; Y131-F152 HydrophobicContact CE2-CE2 4.42Å; Y131-F152 HydrophobicContact CE2-CG 4.19Å; Y131-D155 WeakPolarHBondContact OH-CB 3.44Å; Y131-D155 PolarHBondContact OH-OD2 3.33Å |
| 132 | N | 88.7 | Confident | 91 | Very high | 43 Ų | 43 | 40.7 Ų | 40.7 | 23% | 0.23 | 22% | 0.219 | C | C | . | . | S | Bend | trans | -57.3 | -35.9 | -172 | 67.8 | -12.5 | 0 | 0 | 0 | 113.9 | I46 F128 | I46-N132 HydrophobicContact CG2-CB 3.84Å; I46-N132 VanDerWaalsContact CG2-ND2 3.3Å; I46-N132 WeakPolarHBondContact CG2-ND2 3.39Å; F128-N132 WeakPolarHBondContact O-CA 3.4Å; F128-N132 WeakPolarHBondContact O-CB 3.46Å; F128-N132 PolarHBondContact O-N 2.96Å |
| 133 | L | 86.6 | Confident | 90.6 | Very high | 98 Ų | 98 | 43.5 Ų | 43.5 | 51% | 0.513 | 24% | 0.241 | S | C | . | . | S | Bend | trans | -99.4 | -16.3 | -178.8 | -68.5 | 172.5 | 0 | 0 | 0 | 113 | Y131 F303 T304 D305 G306 | Y131-L133 VanDerWaalsContact C-N 3.25Å; Y131-L133 PolarHBondContact O-N 3.08Å; Y131-L133 VanDerWaalsContact O-N 3.16Å; L133-F303 CarbonylContact C-O 3.5Å; L133-T304 CarbonylContact O-C 3.51Å; L133-T304 VanDerWaalsContact O-C 3.3Å; L133-T304 WeakPolarHBondContact O-CA 3.2Å; L133-D305 PolarHBondContact O-N 3.08Å; L133-G306 WeakPolarHBondContact O-CA 3.39Å; L133-G306 PolarHBondContact O-N 3.4Å |
| 134 | C | 87.9 | Confident | 90.1 | Very high | 17 Ų | 17 | 45.1 Ų | 45.1 | 12% | 0.115 | 26% | 0.255 | C | S | . | . | trans | -139.4 | 89.7 | 179 | -176 | 0 | 0 | 0 | 0 | 111.1 | Y131 P136 C307 | Y131-C134 WeakPolarHBondContact CB-O 3.49Å; Y131-C134 WeakPolarHBondContact CD1-O 3.24Å; Y131-C134 CarbonylContact O-C 3.6Å; Y131-C134 VanDerWaalsContact O-C 3.26Å; Y131-C134 PolarHBondContact O-N 2.86Å; Y131-C134 VanDerWaalsContact O-N 3.16Å; C134-P136 WeakPolarHBondContact O-CD 2.98Å; C134-C307 WeakPolarHBondContact CA-SG 3.37Å; C134-C307 HydrophobicContact CB-CB 4.06Å; C134-C307 WeakPolarHBondContact CB-SG 3.36Å; C134-C307 WeakPolarHBondContact SG-CA 3.45Å; C134-C307 WeakPolarHBondContact SG-CB 3.46Å; C134-C307 CovalentContact SG-SG 2.04Å; C134-C307 PolarHBondContact SG-SG 3.34Å | ||
| 135 | D | 89.9 | Confident | 89.7 | Confident | 10 Ų | 10 | 47.1 Ų | 47.1 | 5% | 0.053 | 26% | 0.263 | C | S | . | . | trans | -65.9 | 117.4 | 173.6 | -176.3 | -22 | 0 | 0 | 0 | 110.6 | L137 K138 S139 Y148 S302 F303 | D135-L137 VanDerWaalsContact C-N 3.25Å; D135-L137 PolarHBondContact O-N 3.25Å; D135-L137 VanDerWaalsContact OD1-CB 3.32Å; D135-L137 WeakPolarHBondContact OD1-CB 3.15Å; D135-L137 PolarHBondContact OD1-N 2.77Å; D135-K138 HydrophobicContact CB-CB 4.18Å; D135-K138 HydrophobicContact CB-CG 4.44Å; D135-K138 PolarHBondContact O-N 3.49Å; D135-K138 PolarHBondContact OD1-N 3.18Å; D135-S139 WeakPolarHBondContact O-CB 3.25Å; D135-S139 PolarHBondContact O-N 3.35Å; D135-S139 PolarHBondContact O-OG 3.01Å; D135-Y148 PolarHBondContact OD1-OH 3.49Å; D135-S302 WeakPolarHBondContact OD2-CB 3.01Å; D135-S302 PolarHBondContact OD2-OG 2.82Å; D135-F303 WeakPolarHBondContact CB-O 3.5Å; D135-F303 PolarHBondContact N-O 3.47Å | ||
| 136 | P | 89.1 | Confident | 89.2 | Confident | 0 Ų | 0 | 48.7 Ų | 48.7 | 0% | 0 | 27% | 0.272 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65.6 | -25 | 180 | 26.3 | -34.2 | 0 | 0 | 0 | 113.3 | Y131 C134 S139 G140 R141 I142 Y148 Y151 | Y131-P136 HydrophobicContact CD1-CG 4.35Å; Y131-P136 HydrophobicContact CD2-CG 4.1Å; Y131-P136 HydrophobicContact CE2-CG 4.23Å; Y131-P136 HydrophobicContact CG-CG 4.17Å; C134-P136 WeakPolarHBondContact O-CD 2.98Å; P136-S139 VanDerWaalsContact CA-OG 3.28Å; P136-S139 WeakPolarHBondContact CA-OG 3.46Å; P136-S139 PolarHBondContact O-OG 3.35Å; P136-G140 PolarHBondContact O-N 3.22Å; P136-R141 HydrophobicContact CB-CB 4.16Å; P136-R141 WeakPolarHBondContact O-CA 3.47Å; P136-R141 WeakPolarHBondContact O-CB 3.35Å; P136-R141 PolarHBondContact O-N 3Å; P136-I142 HydrophobicContact CB-CD1 4.35Å; P136-I142 HydrophobicContact CB-CG1 4.26Å; P136-I142 HydrophobicContact CB-CG2 4.49Å; P136-I142 HydrophobicContact CG-CD1 4.15Å; P136-I142 PolarHBondContact O-N 3.3Å; P136-I142 VanDerWaalsContact O-N 3.09Å; P136-Y148 HydrophobicContact CG-CD1 3.71Å; P136-Y148 HydrophobicContact CG-CE1 3.56Å; P136-Y151 HydrophobicContact CB-CD1 4.02Å; P136-Y151 HydrophobicContact CB-CE1 3.86Å; P136-Y151 HydrophobicContact CG-CD1 4.39Å |
| 137 | L | 88.4 | Confident | 88.9 | Confident | 53 Ų | 53 | 52.5 Ų | 52.5 | 28% | 0.277 | 29% | 0.292 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.9 | -51.7 | 177.1 | -175.7 | 66.6 | 0 | 0 | 0 | 110.4 | D135 S139 G140 I142 P145 Y148 | D135-L137 VanDerWaalsContact C-N 3.25Å; D135-L137 PolarHBondContact O-N 3.25Å; D135-L137 VanDerWaalsContact OD1-CB 3.32Å; D135-L137 WeakPolarHBondContact OD1-CB 3.15Å; D135-L137 PolarHBondContact OD1-N 2.77Å; L137-S139 VanDerWaalsContact C-N 3.29Å; L137-S139 PolarHBondContact O-N 3.04Å; L137-G140 PolarHBondContact O-N 2.8Å; L137-G140 VanDerWaalsContact O-N 3.08Å; L137-I142 VanDerWaalsContact CA-CG1 3.49Å; L137-I142 HydrophobicContact CB-CD1 4.04Å; L137-I142 HydrophobicContact CB-CG1 3.9Å; L137-I142 HydrophobicContact CD1-CD1 4.36Å; L137-I142 HydrophobicContact CD1-CG1 3.93Å; L137-P145 HydrophobicContact CD2-CG 4.03Å; L137-Y148 HydrophobicContact CB-CE1 4.23Å; L137-Y148 WeakPolarHBondContact CB-OH 3.38Å; L137-Y148 HydrophobicContact CD2-CE2 4.34Å |
| 138 | K | 86.2 | Confident | 88.7 | Confident | 126 Ų | 126 | 53.5 Ų | 53.5 | 55% | 0.548 | 30% | 0.295 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.1 | -28.8 | 179.9 | -70.3 | -175.6 | 174.9 | 174 | 0 | 113.2 | D135 G140 S302 T304 | D135-K138 HydrophobicContact CB-CB 4.18Å; D135-K138 HydrophobicContact CB-CG 4.44Å; D135-K138 PolarHBondContact O-N 3.49Å; D135-K138 PolarHBondContact OD1-N 3.18Å; K138-G140 PolarHBondContact O-N 3.23Å; K138-S302 WeakPolarHBondContact CD-OG 3.28Å; K138-S302 WeakPolarHBondContact CE-OG 3.33Å; K138-S302 PolarHBondContact NZ-O 2.96Å; K138-S302 PolarHBondContact NZ-OG 3.45Å; K138-T304 HydrophobicContact CB-CG2 3.42Å; K138-T304 VanDerWaalsContact CB-CG2 3.42Å; K138-T304 HydrophobicContact CD-CG2 4.29Å |
| 139 | S | 87.1 | Confident | 88.6 | Confident | 26 Ų | 26 | 53.6 Ų | 53.6 | 18% | 0.182 | 30% | 0.296 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -79.1 | -2.4 | 173.4 | 60 | 0 | 0 | 0 | 0 | 114.2 | D135 P136 L137 R141 C307 | D135-S139 WeakPolarHBondContact O-CB 3.25Å; D135-S139 PolarHBondContact O-N 3.35Å; D135-S139 PolarHBondContact O-OG 3.01Å; P136-S139 VanDerWaalsContact CA-OG 3.28Å; P136-S139 WeakPolarHBondContact CA-OG 3.46Å; P136-S139 PolarHBondContact O-OG 3.35Å; L137-S139 VanDerWaalsContact C-N 3.29Å; L137-S139 PolarHBondContact O-N 3.04Å; S139-R141 VanDerWaalsContact C-N 3.3Å; S139-R141 PolarHBondContact O-N 3.12Å; S139-C307 VanDerWaalsContact CB-SG 3.58Å |
| 140 | G | 86.4 | Confident | 88.6 | Confident | 61 Ų | 61 | 55.1 Ų | 55.1 | 63% | 0.629 | 31% | 0.306 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74.8 | 14 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | P136 L137 K138 | P136-G140 PolarHBondContact O-N 3.22Å; L137-G140 PolarHBondContact O-N 2.8Å; L137-G140 VanDerWaalsContact O-N 3.08Å; K138-G140 PolarHBondContact O-N 3.23Å |
| 141 | R | 87.9 | Confident | 88.5 | Confident | 107 Ų | 107 | 54.5 Ų | 54.5 | 40% | 0.404 | 30% | 0.304 | S | S | . | . | S | Bend | trans | -75.2 | -27.6 | 174.9 | -63.7 | 178.5 | 179.2 | -177.3 | 3.3 | 112.1 | P136 S139 Y151 | P136-R141 HydrophobicContact CB-CB 4.16Å; P136-R141 WeakPolarHBondContact O-CA 3.47Å; P136-R141 WeakPolarHBondContact O-CB 3.35Å; P136-R141 PolarHBondContact O-N 3Å; S139-R141 VanDerWaalsContact C-N 3.3Å; S139-R141 PolarHBondContact O-N 3.12Å; R141-Y151 HydrophobicContact CB-CE2 4.42Å; R141-Y151 WeakPolarHBondContact CD-OH 3.28Å |
| 142 | I | 90.1 | Very high | 88.6 | Confident | 11 Ų | 11 | 53.6 Ų | 53.6 | 6% | 0.056 | 30% | 0.3 | C | S | . | . | trans | -125.3 | 148.4 | 169.9 | 64.3 | 176.9 | 0 | 0 | 0 | 110.1 | P136 L137 L147 Y148 Y151 | P136-I142 HydrophobicContact CB-CD1 4.35Å; P136-I142 HydrophobicContact CB-CG1 4.26Å; P136-I142 HydrophobicContact CB-CG2 4.49Å; P136-I142 HydrophobicContact CG-CD1 4.15Å; P136-I142 PolarHBondContact O-N 3.3Å; P136-I142 VanDerWaalsContact O-N 3.09Å; L137-I142 VanDerWaalsContact CA-CG1 3.49Å; L137-I142 HydrophobicContact CB-CD1 4.04Å; L137-I142 HydrophobicContact CB-CG1 3.9Å; L137-I142 HydrophobicContact CD1-CD1 4.36Å; L137-I142 HydrophobicContact CD1-CG1 3.93Å; I142-L147 HydrophobicContact CB-CB 4.19Å; I142-L147 HydrophobicContact CG2-CB 4.26Å; I142-Y148 HydrophobicContact CD1-CD1 3.53Å; I142-Y148 HydrophobicContact CD1-CD2 4.27Å; I142-Y148 HydrophobicContact CD1-CE1 3.7Å; I142-Y148 HydrophobicContact CD1-CE2 4.36Å; I142-Y148 HydrophobicContact CD1-CG 3.81Å; I142-Y151 HydrophobicContact CG2-CD1 4.15Å; I142-Y151 HydrophobicContact CG2-CD2 3.82Å; I142-Y151 HydrophobicContact CG2-CG 3.59Å | ||
| 143 | S | 85.6 | Confident | 88.8 | Confident | 118 Ų | 118 | 51.6 Ų | 51.6 | 83% | 0.825 | 29% | 0.29 | S | S | * | . | S | Bend | trans | -94.3 | -15.4 | -178.4 | -49.6 | 0 | 0 | 0 | 0 | 113.9 | ||
| 144 | A | 84.8 | Confident | 89.1 | Confident | 34 Ų | 34 | 51.2 Ų | 51.2 | 28% | 0.281 | 29% | 0.288 | S | S | . | . | S | Bend | trans | -146.3 | 148.3 | -175.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | D146 L147 | A144-D146 VanDerWaalsContact C-N 3.27Å; A144-D146 PolarHBondContact O-N 3.36Å; A144-L147 HydrophobicContact CB-CD1 4.34Å; A144-L147 HydrophobicContact CB-CG 4.41Å; A144-L147 WeakPolarHBondContact O-CB 3.35Å; A144-L147 PolarHBondContact O-N 3.29Å |
| 145 | P | 84.7 | Confident | 89.4 | Confident | 67 Ų | 67 | 52.5 Ų | 52.5 | 44% | 0.435 | 29% | 0.293 | S | S | . | . | G | 310 helix | trans | -59 | -33.5 | 178 | -23.9 | 33.4 | 0 | 0 | 0 | 113.8 | L137 L147 Y148 | L137-P145 HydrophobicContact CD2-CG 4.03Å; P145-L147 PolarHBondContact O-N 3.1Å; P145-Y148 HydrophobicContact CB-CD2 4.25Å; P145-Y148 HydrophobicContact CB-CE2 4.05Å; P145-Y148 WeakPolarHBondContact O-CD2 3.15Å; P145-Y148 PolarHBondContact O-N 2.7Å; P145-Y148 VanDerWaalsContact O-N 3.13Å |
| 146 | D | 85.2 | Confident | 89.6 | Confident | 83 Ų | 83 | 52.3 Ų | 52.3 | 44% | 0.444 | 29% | 0.292 | S | S | . | . | G | 310 helix | trans | -66.3 | -11.4 | -178.2 | -59.4 | -60.1 | 0 | 0 | 0 | 113.1 | A144 V236 | A144-D146 VanDerWaalsContact C-N 3.27Å; A144-D146 PolarHBondContact O-N 3.36Å; D146-V236 WeakPolarHBondContact OD2-CG2 3.39Å |
| 147 | L | 89.4 | Confident | 89.8 | Confident | 81 Ų | 81 | 53 Ų | 53 | 42% | 0.424 | 30% | 0.295 | S | S | . | . | G | 310 helix | trans | -90.2 | -3.8 | 178.3 | -60.5 | 175.8 | 0 | 0 | 0 | 114.1 | I142 A144 P145 M149 P150 Y151 | I142-L147 HydrophobicContact CB-CB 4.19Å; I142-L147 HydrophobicContact CG2-CB 4.26Å; A144-L147 HydrophobicContact CB-CD1 4.34Å; A144-L147 HydrophobicContact CB-CG 4.41Å; A144-L147 WeakPolarHBondContact O-CB 3.35Å; A144-L147 PolarHBondContact O-N 3.29Å; P145-L147 PolarHBondContact O-N 3.1Å; L147-M149 PolarHBondContact O-N 2.91Å; L147-P150 WeakPolarHBondContact O-CD 3.22Å; L147-Y151 WeakPolarHBondContact O-CB 3.5Å; L147-Y151 PolarHBondContact O-N 2.84Å |
| 148 | Y | 91.4 | Very high | 89.9 | Confident | 52 Ų | 52 | 54.4 Ų | 54.4 | 20% | 0.204 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -54 | -54.6 | 179.6 | -85.7 | -63.7 | 0 | 0 | 0 | 112.5 | M127 D135 P136 L137 I142 P145 Y151 F152 | M127-Y148 HydrophobicContact CE-CD1 4.41Å; M127-Y148 HydrophobicContact CE-CG 4.14Å; D135-Y148 PolarHBondContact OD1-OH 3.49Å; P136-Y148 HydrophobicContact CG-CD1 3.71Å; P136-Y148 HydrophobicContact CG-CE1 3.56Å; L137-Y148 HydrophobicContact CB-CE1 4.23Å; L137-Y148 WeakPolarHBondContact CB-OH 3.38Å; L137-Y148 HydrophobicContact CD2-CE2 4.34Å; I142-Y148 HydrophobicContact CD1-CD1 3.53Å; I142-Y148 HydrophobicContact CD1-CD2 4.27Å; I142-Y148 HydrophobicContact CD1-CE1 3.7Å; I142-Y148 HydrophobicContact CD1-CE2 4.36Å; I142-Y148 HydrophobicContact CD1-CG 3.81Å; P145-Y148 HydrophobicContact CB-CD2 4.25Å; P145-Y148 HydrophobicContact CB-CE2 4.05Å; P145-Y148 WeakPolarHBondContact O-CD2 3.15Å; P145-Y148 PolarHBondContact O-N 2.7Å; P145-Y148 VanDerWaalsContact O-N 3.13Å; Y148-Y151 PolarHBondContact O-N 2.94Å; Y148-F152 VanDerWaalsContact O-CB 3.27Å; Y148-F152 WeakPolarHBondContact O-CB 3.22Å; Y148-F152 PolarHBondContact O-N 3.29Å |
| 149 | M | 91.7 | Very high | 90.1 | Very high | 43 Ų | 43 | 55.1 Ų | 55.1 | 21% | 0.212 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -67.1 | -48.3 | -176.3 | -177.2 | 72 | 78.7 | 0 | 0 | 112.3 | C123 L147 Y151 F152 V153 F167 | C123-M149 HydrophobicContact CB-CE 3.75Å; C123-M149 HydrophobicContact CB-SD 4.49Å; L147-M149 PolarHBondContact O-N 2.91Å; M149-Y151 VanDerWaalsContact C-N 3.32Å; M149-Y151 PolarHBondContact O-N 2.83Å; M149-F152 PolarHBondContact O-N 3.28Å; M149-F152 HydrophobicContact SD-CD1 4.42Å; M149-V153 WeakPolarHBondContact O-CG2 3.36Å; M149-V153 PolarHBondContact O-N 3.16Å; M149-F167 HydrophobicContact CG-CE1 4.22Å; M149-F167 HydrophobicContact CG-CZ 4.01Å |
| 150 | P | 91.9 | Very high | 90.2 | Very high | 36 Ų | 36 | 58.8 Ų | 58.8 | 23% | 0.234 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -53.5 | -45.2 | 172.1 | -30.7 | 37.4 | 0 | 0 | 0 | 114 | L147 V153 L154 L168 | L147-P150 WeakPolarHBondContact O-CD 3.22Å; P150-V153 PolarHBondContact O-N 2.95Å; P150-L154 WeakPolarHBondContact O-CG 3.49Å; P150-L154 PolarHBondContact O-N 3.14Å; P150-L154 VanDerWaalsContact O-N 3.16Å; P150-L168 HydrophobicContact CB-CD2 4.1Å; P150-L168 HydrophobicContact CG-CD2 4.42Å |
| 151 | Y | 93.4 | Very high | 90.1 | Very high | 59 Ų | 59 | 61.8 Ų | 61.8 | 23% | 0.231 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -65 | -44.9 | 178.8 | -178.9 | -99.4 | 0 | 0 | 0 | 111.5 | Y131 P136 R141 I142 L147 Y148 M149 V153 L154 D155 | Y131-Y151 HydrophobicContact CE1-CE1 4.29Å; Y131-Y151 HydrophobicContact CE2-CD1 4.5Å; Y131-Y151 AromaticContact CZ-CE1 3.92Å; Y131-Y151 WeakPolarHBondContact OH-CD1 3.34Å; Y131-Y151 WeakPolarHBondContact OH-CE1 3.36Å; P136-Y151 HydrophobicContact CB-CD1 4.02Å; P136-Y151 HydrophobicContact CB-CE1 3.86Å; P136-Y151 HydrophobicContact CG-CD1 4.39Å; R141-Y151 HydrophobicContact CB-CE2 4.42Å; R141-Y151 WeakPolarHBondContact CD-OH 3.28Å; I142-Y151 HydrophobicContact CG2-CD1 4.15Å; I142-Y151 HydrophobicContact CG2-CD2 3.82Å; I142-Y151 HydrophobicContact CG2-CG 3.59Å; L147-Y151 WeakPolarHBondContact O-CB 3.5Å; L147-Y151 PolarHBondContact O-N 2.84Å; Y148-Y151 PolarHBondContact O-N 2.94Å; M149-Y151 VanDerWaalsContact C-N 3.32Å; M149-Y151 PolarHBondContact O-N 2.83Å; Y151-V153 VanDerWaalsContact C-N 3.33Å; Y151-V153 PolarHBondContact O-N 3.38Å; Y151-L154 WeakPolarHBondContact O-CB 3.45Å; Y151-L154 PolarHBondContact O-N 3.41Å; Y151-L154 VanDerWaalsContact O-N 3.14Å; Y151-D155 WeakPolarHBondContact O-CB 3.5Å; Y151-D155 PolarHBondContact O-N 3.38Å |
| 152 | F | 94.1 | Very high | 90.1 | Very high | 0 Ų | 0 | 59.2 Ų | 59.2 | 0% | 0 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -57.9 | -44.4 | 177.6 | -178.1 | -127.2 | 0 | 0 | 0 | 112.2 | I29 V126 M127 Y130 Y131 Y148 M149 L154 D155 I156 | I29-F152 HydrophobicContact CG2-CD1 4.07Å; I29-F152 HydrophobicContact CG2-CE1 3.67Å; V126-F152 HydrophobicContact CG1-CZ 4.2Å; M127-F152 HydrophobicContact CB-CD1 3.84Å; M127-F152 HydrophobicContact CB-CD2 4.43Å; M127-F152 HydrophobicContact CB-CE1 3.88Å; M127-F152 HydrophobicContact CB-CE2 4.46Å; M127-F152 HydrophobicContact CB-CG 4.13Å; M127-F152 HydrophobicContact CB-CZ 4.2Å; M127-F152 HydrophobicContact CG-CB 4.01Å; M127-F152 HydrophobicContact CG-CD1 3.94Å; M127-F152 HydrophobicContact CG-CD2 4.06Å; M127-F152 HydrophobicContact CG-CE1 4.41Å; M127-F152 HydrophobicContact CG-CG 3.74Å; M127-F152 HydrophobicContact SD-CB 4.11Å; M127-F152 HydrophobicContact SD-CD1 4.5Å; M127-F152 HydrophobicContact SD-CG 4.39Å; Y130-F152 HydrophobicContact CD1-CD2 4.05Å; Y130-F152 AromaticContact CD1-CE2 3.68Å; Y130-F152 HydrophobicContact CD1-CE2 3.68Å; Y130-F152 HydrophobicContact CE1-CE2 4.34Å; Y130-F152 AromaticContact CG-CE2 3.78Å; Y130-F152 HydrophobicContact CG-CE2 3.78Å; Y131-F152 HydrophobicContact CD2-CD2 4.39Å; Y131-F152 HydrophobicContact CE2-CB 4.07Å; Y131-F152 AromaticContact CE2-CD2 3.56Å; Y131-F152 HydrophobicContact CE2-CD2 3.56Å; Y131-F152 HydrophobicContact CE2-CE2 4.42Å; Y131-F152 HydrophobicContact CE2-CG 4.19Å; Y148-F152 VanDerWaalsContact O-CB 3.27Å; Y148-F152 WeakPolarHBondContact O-CB 3.22Å; Y148-F152 PolarHBondContact O-N 3.29Å; M149-F152 PolarHBondContact O-N 3.28Å; M149-F152 HydrophobicContact SD-CD1 4.42Å; F152-L154 VanDerWaalsContact C-N 3.34Å; F152-L154 PolarHBondContact O-N 2.92Å; F152-D155 PolarHBondContact O-N 2.84Å; F152-I156 HydrophobicContact CD1-CD1 4.16Å; F152-I156 HydrophobicContact CD2-CG2 3.68Å; F152-I156 HydrophobicContact CE1-CD1 3.8Å; F152-I156 HydrophobicContact CE2-CD1 4.32Å; F152-I156 HydrophobicContact CE2-CG2 3.29Å; F152-I156 HydrophobicContact CG-CG2 4.48Å; F152-I156 HydrophobicContact CZ-CD1 3.89Å; F152-I156 HydrophobicContact CZ-CG2 3.82Å; F152-I156 WeakPolarHBondContact O-CG1 3.45Å; F152-I156 WeakPolarHBondContact O-CG2 3.27Å; F152-I156 PolarHBondContact O-N 3.38Å |
| 153 | V | 94.1 | Very high | 90 | Very high | 2 Ų | 2 | 61 Ų | 61 | 1% | 0.012 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -62.9 | -41.2 | 177 | 174.9 | 0 | 0 | 0 | 0 | 111.6 | I29 M149 P150 Y151 D155 F157 F163 P164 F167 | I29-V153 HydrophobicContact CD1-CG2 3.45Å; I29-V153 VanDerWaalsContact CD1-CG2 3.45Å; I29-V153 HydrophobicContact CG1-CG2 3.91Å; M149-V153 WeakPolarHBondContact O-CG2 3.36Å; M149-V153 PolarHBondContact O-N 3.16Å; P150-V153 PolarHBondContact O-N 2.95Å; Y151-V153 VanDerWaalsContact C-N 3.33Å; Y151-V153 PolarHBondContact O-N 3.38Å; V153-D155 VanDerWaalsContact C-N 3.32Å; V153-F157 HydrophobicContact CG1-CD2 4.17Å; V153-F157 WeakPolarHBondContact O-CB 3.26Å; V153-F157 PolarHBondContact O-N 2.92Å; V153-F163 HydrophobicContact CG1-CD1 4.06Å; V153-F163 HydrophobicContact CG1-CE1 4.03Å; V153-P164 HydrophobicContact CG1-CB 4.06Å; V153-P164 HydrophobicContact CG1-CG 4.29Å; V153-F167 HydrophobicContact CB-CD1 4.31Å; V153-F167 HydrophobicContact CG1-CB 4.16Å; V153-F167 HydrophobicContact CG1-CD1 4.12Å; V153-F167 HydrophobicContact CG1-CG 4.18Å; V153-F167 HydrophobicContact CG2-CD1 3.89Å; V153-F167 HydrophobicContact CG2-CE1 3.84Å; V153-F167 HydrophobicContact CG2-CG 4.29Å; V153-F167 HydrophobicContact CG2-CZ 4.2Å |
| 154 | L | 92.9 | Very high | 90.2 | Very high | 90 Ų | 90 | 56 Ų | 56 | 47% | 0.471 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -63.8 | -39 | 176.3 | -72.4 | 165.7 | 0 | 0 | 0 | 112 | P150 Y151 F152 S158 P164 | P150-L154 WeakPolarHBondContact O-CG 3.49Å; P150-L154 PolarHBondContact O-N 3.14Å; P150-L154 VanDerWaalsContact O-N 3.16Å; Y151-L154 WeakPolarHBondContact O-CB 3.45Å; Y151-L154 PolarHBondContact O-N 3.41Å; Y151-L154 VanDerWaalsContact O-N 3.14Å; F152-L154 VanDerWaalsContact C-N 3.34Å; F152-L154 PolarHBondContact O-N 2.92Å; L154-S158 PolarHBondContact O-N 3.45Å; L154-P164 HydrophobicContact CD2-CB 3.53Å; L154-P164 HydrophobicContact CD2-CG 4.14Å; L154-P164 HydrophobicContact CG-CB 4.24Å |
| 155 | D | 93 | Very high | 90.5 | Very high | 43 Ų | 43 | 56.5 Ų | 56.5 | 23% | 0.23 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -69.7 | -55.4 | -177.4 | -164.1 | 13.9 | 0 | 0 | 0 | 111.4 | Y130 Y131 Y151 F152 V153 F157 S158 | Y130-D155 WeakPolarHBondContact CE1-OD2 3.38Å; Y130-D155 PolarHBondContact OH-OD2 3.49Å; Y131-D155 WeakPolarHBondContact OH-CB 3.44Å; Y131-D155 PolarHBondContact OH-OD2 3.33Å; Y151-D155 WeakPolarHBondContact O-CB 3.5Å; Y151-D155 PolarHBondContact O-N 3.38Å; F152-D155 PolarHBondContact O-N 2.84Å; V153-D155 VanDerWaalsContact C-N 3.32Å; D155-F157 VanDerWaalsContact C-N 3.31Å; D155-F157 PolarHBondContact O-N 3.03Å; D155-S158 WeakPolarHBondContact O-CB 3.28Å; D155-S158 PolarHBondContact O-N 2.99Å; D155-S158 PolarHBondContact O-OG 2.73Å |
| 156 | I | 94.2 | Very high | 90.8 | Very high | 6 Ų | 6 | 57.7 Ų | 57.7 | 3% | 0.031 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -72 | -22.6 | -174.8 | 72.6 | -174.8 | 0 | 0 | 0 | 113.9 | I29 Q32 L36 F152 | I29-I156 HydrophobicContact CG2-CD1 4.1Å; Q32-I156 HydrophobicContact CG-CB 4.21Å; Q32-I156 HydrophobicContact CG-CG1 4.29Å; Q32-I156 PolarHBondContact NE2-O 2.99Å; L36-I156 HydrophobicContact CD1-CB 3.6Å; L36-I156 HydrophobicContact CD1-CG2 3.6Å; F152-I156 HydrophobicContact CD1-CD1 4.16Å; F152-I156 HydrophobicContact CD2-CG2 3.68Å; F152-I156 HydrophobicContact CE1-CD1 3.8Å; F152-I156 HydrophobicContact CE2-CD1 4.32Å; F152-I156 HydrophobicContact CE2-CG2 3.29Å; F152-I156 HydrophobicContact CG-CG2 4.48Å; F152-I156 HydrophobicContact CZ-CD1 3.89Å; F152-I156 HydrophobicContact CZ-CG2 3.82Å; F152-I156 WeakPolarHBondContact O-CG1 3.45Å; F152-I156 WeakPolarHBondContact O-CG2 3.27Å; F152-I156 PolarHBondContact O-N 3.38Å |
| 157 | F | 94.3 | Very high | 90.9 | Very high | 16 Ų | 16 | 54.9 Ų | 54.9 | 7% | 0.07 | 32% | 0.315 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -108.3 | 21.4 | 176.8 | -68.3 | -77.9 | 0 | 0 | 0 | 113.2 | A28 I29 Q32 V153 D155 N159 H160 F163 P164 | A28-F157 HydrophobicContact CB-CZ 4.1Å; I29-F157 HydrophobicContact CG1-CE2 3.99Å; Q32-F157 HydrophobicContact CB-CE1 4.01Å; Q32-F157 HydrophobicContact CB-CE2 4.33Å; Q32-F157 HydrophobicContact CB-CZ 3.68Å; Q32-F157 HydrophobicContact CG-CD1 4.46Å; Q32-F157 HydrophobicContact CG-CE1 4.02Å; Q32-F157 HydrophobicContact CG-CZ 4.04Å; V153-F157 HydrophobicContact CG1-CD2 4.17Å; V153-F157 WeakPolarHBondContact O-CB 3.26Å; V153-F157 PolarHBondContact O-N 2.92Å; D155-F157 VanDerWaalsContact C-N 3.31Å; D155-F157 PolarHBondContact O-N 3.03Å; F157-N159 PolarHBondContact O-N 3.13Å; F157-N159 VanDerWaalsContact O-N 3.09Å; F157-H160 HydrophobicContact CB-CB 4.41Å; F157-H160 HydrophobicContact CD1-CB 4.16Å; F157-H160 CarbonylContact O-C 3.3Å; F157-H160 PolarHBondContact O-N 3.25Å; F157-F163 HydrophobicContact CB-CB 4.47Å; F157-F163 HydrophobicContact CB-CD1 4.19Å; F157-F163 HydrophobicContact CD1-CB 4.3Å; F157-F163 AromaticContact CD1-CD1 3.92Å; F157-F163 HydrophobicContact CD1-CD1 3.92Å; F157-F163 HydrophobicContact CD1-CE1 4.46Å; F157-F163 HydrophobicContact CD1-CG 4.03Å; F157-F163 AromaticContact CD2-CD1 3.33Å; F157-F163 HydrophobicContact CD2-CD1 3.33Å; F157-F163 AromaticContact CD2-CE1 3.47Å; F157-F163 HydrophobicContact CD2-CE1 3.47Å; F157-F163 VanDerWaalsContact CD2-CE1 3.47Å; F157-F163 HydrophobicContact CD2-CG 4.26Å; F157-F163 HydrophobicContact CD2-CZ 4.45Å; F157-F163 HydrophobicContact CE1-CD1 4.1Å; F157-F163 HydrophobicContact CE1-CD2 4.41Å; F157-F163 HydrophobicContact CE1-CE1 4.25Å; F157-F163 HydrophobicContact CE1-CG 4.2Å; F157-F163 HydrophobicContact CE1-CZ 4.45Å; F157-F163 AromaticContact CE2-CD1 3.55Å; F157-F163 HydrophobicContact CE2-CD1 3.55Å; F157-F163 AromaticContact CE2-CE1 3.2Å; F157-F163 HydrophobicContact CE2-CE1 3.2Å; F157-F163 HydrophobicContact CE2-CG 4.43Å; F157-F163 AromaticContact CE2-CZ 3.83Å; F157-F163 HydrophobicContact CE2-CZ 3.83Å; F157-F163 HydrophobicContact CG-CB 4.34Å; F157-F163 AromaticContact CG-CD1 3.54Å; F157-F163 HydrophobicContact CG-CD1 3.54Å; F157-F163 HydrophobicContact CG-CE1 4.12Å; F157-F163 HydrophobicContact CG-CG 4.07Å; F157-F163 AromaticContact CZ-CD1 3.93Å; F157-F163 HydrophobicContact CZ-CD1 3.93Å; F157-F163 AromaticContact CZ-CE1 3.64Å; F157-F163 HydrophobicContact CZ-CE1 3.64Å; F157-F163 HydrophobicContact CZ-CE2 4.29Å; F157-F163 HydrophobicContact CZ-CG 4.4Å; F157-F163 AromaticContact CZ-CZ 3.83Å; F157-F163 HydrophobicContact CZ-CZ 3.83Å; F157-P164 HydrophobicContact CB-CG 3.97Å |
| 158 | S | 89.9 | Confident | 90.9 | Very high | 82 Ų | 82 | 53.3 Ų | 53.3 | 57% | 0.573 | 31% | 0.307 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.2 | -33.5 | 175.9 | 49.5 | 0 | 0 | 0 | 0 | 113.7 | L154 D155 | L154-S158 PolarHBondContact O-N 3.45Å; D155-S158 WeakPolarHBondContact O-CB 3.28Å; D155-S158 PolarHBondContact O-N 2.99Å; D155-S158 PolarHBondContact O-OG 2.73Å |
| 159 | N | 89.7 | Confident | 90.9 | Very high | 141 Ų | 141 | 53.5 Ų | 53.5 | 75% | 0.754 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.7 | -5.3 | 177.6 | -64.5 | -35.4 | 0 | 0 | 0 | 114.8 | F157 P161 | F157-N159 PolarHBondContact O-N 3.13Å; F157-N159 VanDerWaalsContact O-N 3.09Å; N159-P161 WeakPolarHBondContact O-CD 3.3Å |
| 160 | H | 89.6 | Confident | 90.7 | Very high | 102 Ų | 102 | 52 Ų | 52 | 47% | 0.472 | 31% | 0.314 | S | S | . | . | S | Bend | trans | -121 | 76.9 | -176.2 | -64.2 | 94.4 | 0 | 0 | 0 | 110.3 | F157 G162 F163 | F157-H160 HydrophobicContact CB-CB 4.41Å; F157-H160 HydrophobicContact CD1-CB 4.16Å; F157-H160 CarbonylContact O-C 3.3Å; F157-H160 PolarHBondContact O-N 3.25Å; H160-G162 PolarHBondContact O-N 3.29Å; H160-F163 PolarHBondContact O-N 2.96Å |
| 161 | P | 84.1 | Confident | 90.5 | Very high | 125 Ų | 125 | 52.5 Ų | 52.5 | 81% | 0.812 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.5 | 130.6 | -179.8 | 26.1 | -33.9 | 0 | 0 | 0 | 110.2 | N159 | N159-P161 WeakPolarHBondContact O-CD 3.3Š|
| 162 | G | 87.6 | Confident | 90.3 | Very high | 53 Ų | 53 | 57.1 Ų | 57.1 | 55% | 0.546 | 34% | 0.339 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 111.4 | -35.5 | -178.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | H160 G165 L166 | H160-G162 PolarHBondContact O-N 3.29Å; G162-G165 PolarHBondContact O-N 2.92Å; G162-L166 WeakPolarHBondContact O-CB 3.37Å; G162-L166 PolarHBondContact O-N 3.39Å |
| 163 | F | 89.4 | Confident | 89.9 | Confident | 47 Ų | 47 | 59.1 Ų | 59.1 | 21% | 0.206 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -63.4 | -48.7 | 179.2 | -176.4 | -81.5 | 0 | 0 | 0 | 112.6 | A28 I29 V153 F157 H160 G165 L166 F167 | A28-F163 HydrophobicContact CB-CE2 3.51Å; A28-F163 HydrophobicContact CB-CZ 3.53Å; I29-F163 HydrophobicContact CG1-CE1 4.19Å; I29-F163 HydrophobicContact CG1-CZ 4.39Å; V153-F163 HydrophobicContact CG1-CD1 4.06Å; V153-F163 HydrophobicContact CG1-CE1 4.03Å; F157-F163 HydrophobicContact CB-CB 4.47Å; F157-F163 HydrophobicContact CB-CD1 4.19Å; F157-F163 HydrophobicContact CD1-CB 4.3Å; F157-F163 AromaticContact CD1-CD1 3.92Å; F157-F163 HydrophobicContact CD1-CD1 3.92Å; F157-F163 HydrophobicContact CD1-CE1 4.46Å; F157-F163 HydrophobicContact CD1-CG 4.03Å; F157-F163 AromaticContact CD2-CD1 3.33Å; F157-F163 HydrophobicContact CD2-CD1 3.33Å; F157-F163 AromaticContact CD2-CE1 3.47Å; F157-F163 HydrophobicContact CD2-CE1 3.47Å; F157-F163 VanDerWaalsContact CD2-CE1 3.47Å; F157-F163 HydrophobicContact CD2-CG 4.26Å; F157-F163 HydrophobicContact CD2-CZ 4.45Å; F157-F163 HydrophobicContact CE1-CD1 4.1Å; F157-F163 HydrophobicContact CE1-CD2 4.41Å; F157-F163 HydrophobicContact CE1-CE1 4.25Å; F157-F163 HydrophobicContact CE1-CG 4.2Å; F157-F163 HydrophobicContact CE1-CZ 4.45Å; F157-F163 AromaticContact CE2-CD1 3.55Å; F157-F163 HydrophobicContact CE2-CD1 3.55Å; F157-F163 AromaticContact CE2-CE1 3.2Å; F157-F163 HydrophobicContact CE2-CE1 3.2Å; F157-F163 HydrophobicContact CE2-CG 4.43Å; F157-F163 AromaticContact CE2-CZ 3.83Å; F157-F163 HydrophobicContact CE2-CZ 3.83Å; F157-F163 HydrophobicContact CG-CB 4.34Å; F157-F163 AromaticContact CG-CD1 3.54Å; F157-F163 HydrophobicContact CG-CD1 3.54Å; F157-F163 HydrophobicContact CG-CE1 4.12Å; F157-F163 HydrophobicContact CG-CG 4.07Å; F157-F163 AromaticContact CZ-CD1 3.93Å; F157-F163 HydrophobicContact CZ-CD1 3.93Å; F157-F163 AromaticContact CZ-CE1 3.64Å; F157-F163 HydrophobicContact CZ-CE1 3.64Å; F157-F163 HydrophobicContact CZ-CE2 4.29Å; F157-F163 HydrophobicContact CZ-CG 4.4Å; F157-F163 AromaticContact CZ-CZ 3.83Å; F157-F163 HydrophobicContact CZ-CZ 3.83Å; H160-F163 PolarHBondContact O-N 2.96Å; F163-G165 VanDerWaalsContact C-N 3.27Å; F163-G165 PolarHBondContact O-N 3.49Å; F163-L166 PolarHBondContact O-N 3.31Å; F163-F167 HydrophobicContact CE1-CB 4.5Å; F163-F167 PolarHBondContact O-N 2.91Å |
| 164 | P | 89.8 | Confident | 89.5 | Confident | 13 Ų | 13 | 59.7 Ų | 59.7 | 8% | 0.084 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -60.4 | -37.2 | 176.1 | -24.2 | 34.7 | 0 | 0 | 0 | 113 | V153 L154 F157 F167 L168 | V153-P164 HydrophobicContact CG1-CB 4.06Å; V153-P164 HydrophobicContact CG1-CG 4.29Å; L154-P164 HydrophobicContact CD2-CB 3.53Å; L154-P164 HydrophobicContact CD2-CG 4.14Å; L154-P164 HydrophobicContact CG-CB 4.24Å; F157-P164 HydrophobicContact CB-CG 3.97Å; P164-F167 PolarHBondContact O-N 3.23Å; P164-L168 WeakPolarHBondContact O-CB 3.44Å; P164-L168 VanDerWaalsContact O-CG 3.3Å; P164-L168 WeakPolarHBondContact O-CG 3.26Å; P164-L168 PolarHBondContact O-N 3.35Å |
| 165 | G | 90.5 | Very high | 89.2 | Confident | 46 Ų | 46 | 59.9 Ų | 59.9 | 47% | 0.474 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -64.2 | -44.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | G162 F163 A169 | G162-G165 PolarHBondContact O-N 2.92Å; F163-G165 VanDerWaalsContact C-N 3.27Å; F163-G165 PolarHBondContact O-N 3.49Å; G165-A169 VanDerWaalsContact O-CB 3.23Å; G165-A169 WeakPolarHBondContact O-CB 3.33Å; G165-A169 PolarHBondContact O-N 3.41Å |
| 166 | L | 90.1 | Very high | 88.9 | Confident | 91 Ų | 91 | 63.7 Ų | 63.7 | 48% | 0.476 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -63.3 | -45.4 | 175.7 | -177.6 | 65.7 | 0 | 0 | 0 | 111.5 | V21 G162 F163 A169 C170 | V21-L166 HydrophobicContact CG1-CD1 4.16Å; V21-L166 HydrophobicContact CG1-CD2 4.03Å; V21-L166 HydrophobicContact CG1-CG 3.94Å; G162-L166 WeakPolarHBondContact O-CB 3.37Å; G162-L166 PolarHBondContact O-N 3.39Å; F163-L166 PolarHBondContact O-N 3.31Å; L166-A169 PolarHBondContact O-N 3.45Å; L166-C170 PolarHBondContact O-N 3.02Å; L166-C170 PolarHBondContact O-SG 3.49Å |
| 167 | F | 88.6 | Confident | 88.4 | Confident | 24 Ų | 24 | 64.3 Ų | 64.3 | 11% | 0.105 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -59.6 | -49.9 | 177.8 | 179.8 | -95.8 | 0 | 0 | 0 | 111.7 | F26 I29 M149 V153 F163 P164 A169 C170 A171 | F26-F167 HydrophobicContact CE1-CE2 4.41Å; I29-F167 HydrophobicContact CD1-CD2 3.81Å; I29-F167 HydrophobicContact CD1-CE2 3.44Å; I29-F167 VanDerWaalsContact CD1-CE2 3.44Å; I29-F167 HydrophobicContact CD1-CZ 3.92Å; M149-F167 HydrophobicContact CG-CE1 4.22Å; M149-F167 HydrophobicContact CG-CZ 4.01Å; V153-F167 HydrophobicContact CB-CD1 4.31Å; V153-F167 HydrophobicContact CG1-CB 4.16Å; V153-F167 HydrophobicContact CG1-CD1 4.12Å; V153-F167 HydrophobicContact CG1-CG 4.18Å; V153-F167 HydrophobicContact CG2-CD1 3.89Å; V153-F167 HydrophobicContact CG2-CE1 3.84Å; V153-F167 HydrophobicContact CG2-CG 4.29Å; V153-F167 HydrophobicContact CG2-CZ 4.2Å; F163-F167 HydrophobicContact CE1-CB 4.5Å; F163-F167 PolarHBondContact O-N 2.91Å; P164-F167 PolarHBondContact O-N 3.23Å; F167-A169 PolarHBondContact O-N 3.39Å; F167-C170 PolarHBondContact O-N 2.97Å; F167-A171 PolarHBondContact O-N 3.39Å |
| 168 | L | 89.1 | Confident | 88 | Confident | 48 Ų | 48 | 67.9 Ų | 67.9 | 25% | 0.251 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -62.2 | -43.6 | 177.2 | -72.6 | 171.4 | 0 | 0 | 0 | 111.6 | P150 P164 C170 A171 Y172 | P150-L168 HydrophobicContact CB-CD2 4.1Å; P150-L168 HydrophobicContact CG-CD2 4.42Å; P164-L168 WeakPolarHBondContact O-CB 3.44Å; P164-L168 VanDerWaalsContact O-CG 3.3Å; P164-L168 WeakPolarHBondContact O-CG 3.26Å; P164-L168 PolarHBondContact O-N 3.35Å; L168-C170 VanDerWaalsContact C-N 3.31Å; L168-C170 PolarHBondContact O-N 2.86Å; L168-A171 PolarHBondContact O-N 3Å; L168-Y172 HydrophobicContact CB-CD2 4.47Å; L168-Y172 HydrophobicContact CB-CE2 4.33Å; L168-Y172 WeakPolarHBondContact O-CD2 3.28Å; L168-Y172 PolarHBondContact O-N 3.27Å |
| 169 | A | 90.4 | Very high | 87.9 | Confident | 57 Ų | 57 | 66 Ų | 66 | 47% | 0.471 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -58.8 | -42.2 | 177 | 0 | 0 | 0 | 0 | 0 | 112 | G165 L166 F167 S173 | G165-A169 VanDerWaalsContact O-CB 3.23Å; G165-A169 WeakPolarHBondContact O-CB 3.33Å; G165-A169 PolarHBondContact O-N 3.41Å; L166-A169 PolarHBondContact O-N 3.45Å; F167-A169 PolarHBondContact O-N 3.39Å; A169-S173 WeakPolarHBondContact O-CB 3.25Å; A169-S173 PolarHBondContact O-N 3.2Å |
| 170 | C | 88.3 | Confident | 87.7 | Confident | 12 Ų | 12 | 60 Ų | 60 | 8% | 0.081 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -68.8 | -39.7 | 176.4 | -73.1 | 0 | 0 | 0 | 0 | 113 | V21 L166 F167 L168 S173 G174 | V21-C170 VanDerWaalsContact CB-SG 3.59Å; V21-C170 HydrophobicContact CG1-CB 4.38Å; V21-C170 WeakPolarHBondContact CG1-SG 3.29Å; L166-C170 PolarHBondContact O-N 3.02Å; L166-C170 PolarHBondContact O-SG 3.49Å; F167-C170 PolarHBondContact O-N 2.97Å; L168-C170 VanDerWaalsContact C-N 3.31Å; L168-C170 PolarHBondContact O-N 2.86Å; C170-S173 PolarHBondContact O-N 3.38Å; C170-G174 PolarHBondContact O-N 2.86Å |
| 171 | A | 87.9 | Confident | 87.5 | Confident | 45 Ų | 45 | 56.3 Ų | 56.3 | 37% | 0.372 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -60.5 | -46.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | F167 L168 G174 T175 | F167-A171 PolarHBondContact O-N 3.39Å; L168-A171 PolarHBondContact O-N 3Å; A171-G174 PolarHBondContact O-N 2.7Å; A171-T175 PolarHBondContact O-N 3.3Å; A171-T175 VanDerWaalsContact O-N 3.11Å; A171-T175 PolarHBondContact O-OG1 2.96Å |
| 172 | Y | 88.2 | Confident | 87.7 | Confident | 157 Ų | 157 | 52.8 Ų | 52.8 | 62% | 0.616 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -63.2 | -42.9 | 175.5 | -75 | -60.5 | 0 | 0 | 0 | 112.3 | L168 G174 T175 L176 | L168-Y172 HydrophobicContact CB-CD2 4.47Å; L168-Y172 HydrophobicContact CB-CE2 4.33Å; L168-Y172 WeakPolarHBondContact O-CD2 3.28Å; L168-Y172 PolarHBondContact O-N 3.27Å; Y172-G174 VanDerWaalsContact C-N 3.27Å; Y172-G174 PolarHBondContact O-N 3.25Å; Y172-T175 PolarHBondContact O-N 2.97Å; Y172-L176 WeakPolarHBondContact O-CB 3.4Å; Y172-L176 WeakPolarHBondContact O-CD1 3.48Å; Y172-L176 VanDerWaalsContact O-CG 3.29Å; Y172-L176 WeakPolarHBondContact O-CG 3.22Å; Y172-L176 PolarHBondContact O-N 3.17Å |
| 173 | S | 86.4 | Confident | 87.8 | Confident | 42 Ų | 42 | 51.6 Ų | 51.6 | 29% | 0.294 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -55.8 | -42.4 | 174.9 | -177.3 | 0 | 0 | 0 | 0 | 111.6 | Q18 A169 C170 L176 S177 | Q18-S173 VanDerWaalsContact OE1-CB 3.31Å; Q18-S173 PolarHBondContact OE1-O 3.43Å; Q18-S173 PolarHBondContact OE1-OG 3.39Å; A169-S173 WeakPolarHBondContact O-CB 3.25Å; A169-S173 PolarHBondContact O-N 3.2Å; C170-S173 PolarHBondContact O-N 3.38Å; S173-L176 WeakPolarHBondContact O-CB 3.15Å; S173-L176 PolarHBondContact O-N 3.11Å; S173-S177 PolarHBondContact O-N 3.24Å |
| 174 | G | 85.8 | Confident | 87.7 | Confident | 13 Ų | 13 | 52.3 Ų | 52.3 | 13% | 0.134 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -68.9 | -40.5 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114 | C170 A171 Y172 L176 S177 T178 | C170-G174 PolarHBondContact O-N 2.86Å; A171-G174 PolarHBondContact O-N 2.7Å; Y172-G174 VanDerWaalsContact C-N 3.27Å; Y172-G174 PolarHBondContact O-N 3.25Å; G174-L176 VanDerWaalsContact C-N 3.33Å; G174-S177 PolarHBondContact O-N 2.94Å; G174-T178 PolarHBondContact O-N 3.41Å; G174-T178 PolarHBondContact O-OG1 2.85Å |
| 175 | T | 87.3 | Confident | 87.7 | Confident | 95 Ų | 95 | 51.9 Ų | 51.9 | 58% | 0.583 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -61.7 | -43.3 | 171.7 | -56.3 | 0 | 0 | 0 | 0 | 110.8 | A171 Y172 T178 A179 | A171-T175 PolarHBondContact O-N 3.3Å; A171-T175 VanDerWaalsContact O-N 3.11Å; A171-T175 PolarHBondContact O-OG1 2.96Å; Y172-T175 PolarHBondContact O-N 2.97Å; T175-T178 PolarHBondContact O-N 2.9Å; T175-A179 VanDerWaalsContact O-CB 3.26Å; T175-A179 WeakPolarHBondContact O-CB 3.42Å; T175-A179 PolarHBondContact O-N 3.35Å |
| 176 | L | 85.8 | Confident | 87.7 | Confident | 123 Ų | 123 | 53 Ų | 53 | 64% | 0.644 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -62.4 | -42.1 | 177.6 | -77.6 | 156.2 | 0 | 0 | 0 | 112.5 | Y172 S173 G174 S180 | Y172-L176 WeakPolarHBondContact O-CB 3.4Å; Y172-L176 WeakPolarHBondContact O-CD1 3.48Å; Y172-L176 VanDerWaalsContact O-CG 3.29Å; Y172-L176 WeakPolarHBondContact O-CG 3.22Å; Y172-L176 PolarHBondContact O-N 3.17Å; S173-L176 WeakPolarHBondContact O-CB 3.15Å; S173-L176 PolarHBondContact O-N 3.11Å; G174-L176 VanDerWaalsContact C-N 3.33Å; L176-S180 WeakPolarHBondContact O-CB 3.24Å; L176-S180 PolarHBondContact O-N 3.32Å |
| 177 | S | 83.9 | Confident | 87.7 | Confident | 18 Ų | 18 | 48.7 Ų | 48.7 | 13% | 0.126 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -63.6 | -44.3 | 176.6 | 178.2 | 0 | 0 | 0 | 0 | 112 | D15 S173 G174 T181 | D15-S177 WeakPolarHBondContact OD1-CB 3.35Å; D15-S177 PolarHBondContact OD1-OG 3.34Å; D15-S177 PolarHBondContact OD2-OG 2.92Å; S173-S177 PolarHBondContact O-N 3.24Å; G174-S177 PolarHBondContact O-N 2.94Å; S177-T181 PolarHBondContact O-N 3.17Å; S177-T181 PolarHBondContact O-OG1 2.96Å |
| 178 | T | 86.1 | Confident | 87.7 | Confident | 91 Ų | 91 | 48.7 Ų | 48.7 | 56% | 0.558 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -65.3 | -50.2 | 177.6 | -53.8 | 0 | 0 | 0 | 0 | 111.1 | G174 T175 S180 T181 S182 | G174-T178 PolarHBondContact O-N 3.41Å; G174-T178 PolarHBondContact O-OG1 2.85Å; T175-T178 PolarHBondContact O-N 2.9Å; T178-S180 VanDerWaalsContact C-N 3.33Å; T178-S180 PolarHBondContact O-N 2.89Å; T178-T181 PolarHBondContact O-N 3.34Å; T178-T181 VanDerWaalsContact O-N 3.13Å; T178-S182 PolarHBondContact O-N 3.26Å; T178-S182 PolarHBondContact O-OG 3.25Å |
| 179 | A | 87.9 | Confident | 87.8 | Confident | 42 Ų | 42 | 48.6 Ų | 48.6 | 35% | 0.347 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -59.2 | -43.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | T175 T181 S182 I183 | T175-A179 VanDerWaalsContact O-CB 3.26Å; T175-A179 WeakPolarHBondContact O-CB 3.42Å; T175-A179 PolarHBondContact O-N 3.35Å; A179-T181 VanDerWaalsContact C-N 3.33Å; A179-T181 PolarHBondContact O-N 3.44Å; A179-S182 PolarHBondContact O-N 3.38Å; A179-I183 WeakPolarHBondContact O-CB 3.48Å; A179-I183 WeakPolarHBondContact O-CD1 3.39Å; A179-I183 VanDerWaalsContact O-CG1 3.25Å; A179-I183 WeakPolarHBondContact O-CG1 3.25Å; A179-I183 PolarHBondContact O-N 3.39Å |
| 180 | S | 84.8 | Confident | 87.9 | Confident | 16 Ų | 16 | 46.9 Ų | 46.9 | 11% | 0.112 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -61.3 | -41 | 176 | 179.3 | 0 | 0 | 0 | 0 | 112.4 | T3 L176 T178 N184 | T3-S180 WeakPolarHBondContact CB-OG 3.45Å; T3-S180 WeakPolarHBondContact CG2-OG 3.48Å; T3-S180 PolarHBondContact OG1-OG 2.89Å; L176-S180 WeakPolarHBondContact O-CB 3.24Å; L176-S180 PolarHBondContact O-N 3.32Å; T178-S180 VanDerWaalsContact C-N 3.33Å; T178-S180 PolarHBondContact O-N 2.89Å; S180-N184 WeakPolarHBondContact O-CB 3.24Å; S180-N184 PolarHBondContact O-N 3.5Å; S180-N184 PolarHBondContact O-ND2 2.9Å |
| 181 | T | 85.5 | Confident | 87.9 | Confident | 24 Ų | 24 | 46.7 Ų | 46.7 | 15% | 0.147 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -64.3 | -45.9 | 178.7 | -57.2 | 0 | 0 | 0 | 0 | 110.1 | A88 R92 S177 T178 A179 N184 A185 | A88-T181 HydrophobicContact CB-CG2 3.87Å; R92-T181 PolarHBondContact NH2-OG1 3.2Å; R92-T181 VanDerWaalsContact NH2-OG1 3.1Å; S177-T181 PolarHBondContact O-N 3.17Å; S177-T181 PolarHBondContact O-OG1 2.96Å; T178-T181 PolarHBondContact O-N 3.34Å; T178-T181 VanDerWaalsContact O-N 3.13Å; A179-T181 VanDerWaalsContact C-N 3.33Å; A179-T181 PolarHBondContact O-N 3.44Å; T181-N184 PolarHBondContact O-N 2.91Å; T181-A185 WeakPolarHBondContact O-CB 3.38Å; T181-A185 PolarHBondContact O-N 2.67Å |
| 182 | S | 88.4 | Confident | 87.9 | Confident | 51 Ų | 51 | 48.5 Ų | 48.5 | 36% | 0.357 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -64 | -44.2 | 178.5 | -60.3 | 0 | 0 | 0 | 0 | 112.7 | T178 A179 N184 A185 M186 | T178-S182 PolarHBondContact O-N 3.26Å; T178-S182 PolarHBondContact O-OG 3.25Å; A179-S182 PolarHBondContact O-N 3.38Å; S182-N184 VanDerWaalsContact C-N 3.34Å; S182-N184 PolarHBondContact O-N 2.9Å; S182-A185 PolarHBondContact O-N 2.97Å; S182-M186 WeakPolarHBondContact O-CG 3.46Å; S182-M186 PolarHBondContact O-N 3.04Å |
| 183 | I | 90.1 | Very high | 88 | Confident | 28 Ų | 28 | 46.2 Ų | 46.2 | 14% | 0.144 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -60 | -45.3 | 177.2 | -72 | 164.4 | 0 | 0 | 0 | 110.8 | A179 M186 A187 S215 | A179-I183 WeakPolarHBondContact O-CB 3.48Å; A179-I183 WeakPolarHBondContact O-CD1 3.39Å; A179-I183 VanDerWaalsContact O-CG1 3.25Å; A179-I183 WeakPolarHBondContact O-CG1 3.25Å; A179-I183 PolarHBondContact O-N 3.39Å; I183-M186 HydrophobicContact CG1-CE 4.28Å; I183-M186 PolarHBondContact O-N 2.95Å; I183-A187 WeakPolarHBondContact O-CB 3.37Å; I183-A187 PolarHBondContact O-N 3.08Å; I183-S215 VanDerWaalsContact CG2-O 3.28Å; I183-S215 WeakPolarHBondContact CG2-O 3.3Å |
| 184 | N | 86.6 | Confident | 88.2 | Confident | 63 Ų | 63 | 48.9 Ų | 48.9 | 34% | 0.337 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -64.2 | -41.5 | 177.3 | -74 | -12.8 | 0 | 0 | 0 | 112.2 | T3 S180 T181 S182 A187 A188 | T3-N184 WeakPolarHBondContact CG2-ND2 3.21Å; T3-N184 WeakPolarHBondContact CG2-OD1 3.49Å; S180-N184 WeakPolarHBondContact O-CB 3.24Å; S180-N184 PolarHBondContact O-N 3.5Å; S180-N184 PolarHBondContact O-ND2 2.9Å; T181-N184 PolarHBondContact O-N 2.91Å; S182-N184 VanDerWaalsContact C-N 3.34Å; S182-N184 PolarHBondContact O-N 2.9Å; N184-A187 PolarHBondContact O-N 2.96Å; N184-A188 VanDerWaalsContact O-CB 3.3Å; N184-A188 WeakPolarHBondContact O-CB 3.48Å; N184-A188 PolarHBondContact O-N 3.05Å |
| 185 | A | 89.4 | Confident | 88.4 | Confident | 4 Ų | 4 | 50.5 Ų | 50.5 | 3% | 0.033 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -63 | -45.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | Q87 A88 T181 S182 A188 V189 | Q87-A185 HydrophobicContact CB-CB 4.4Å; Q87-A185 HydrophobicContact CG-CB 4.25Å; A88-A185 HydrophobicContact CB-CB 3.9Å; T181-A185 WeakPolarHBondContact O-CB 3.38Å; T181-A185 PolarHBondContact O-N 2.67Å; S182-A185 PolarHBondContact O-N 2.97Å; A185-A188 PolarHBondContact O-N 2.9Å; A185-V189 VanDerWaalsContact O-CG2 3.31Å; A185-V189 WeakPolarHBondContact O-CG2 3.31Å; A185-V189 PolarHBondContact O-N 3.37Å |
| 186 | M | 91 | Very high | 88.2 | Confident | 68 Ų | 68 | 51.5 Ų | 51.5 | 34% | 0.335 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -62.7 | -44.5 | 175.2 | -69.6 | -174.7 | -66 | 0 | 0 | 112 | S182 I183 A188 V189 T190 Y218 | S182-M186 WeakPolarHBondContact O-CG 3.46Å; S182-M186 PolarHBondContact O-N 3.04Å; I183-M186 HydrophobicContact CG1-CE 4.28Å; I183-M186 PolarHBondContact O-N 2.95Å; M186-A188 VanDerWaalsContact C-N 3.29Å; M186-A188 PolarHBondContact O-N 2.93Å; M186-V189 PolarHBondContact O-N 2.91Å; M186-T190 WeakPolarHBondContact O-CB 3.26Å; M186-T190 PolarHBondContact O-N 3.13Å; M186-T190 PolarHBondContact O-OG1 3.12Å; M186-Y218 HydrophobicContact CB-CD1 4.31Å; M186-Y218 HydrophobicContact CB-CD2 3.97Å; M186-Y218 HydrophobicContact CB-CE1 4.3Å; M186-Y218 HydrophobicContact CB-CE2 3.96Å; M186-Y218 HydrophobicContact CB-CG 4.18Å; M186-Y218 HydrophobicContact CE-CD1 4.09Å; M186-Y218 HydrophobicContact CE-CG 4.13Å; M186-Y218 HydrophobicContact SD-CD1 4.1Å; M186-Y218 HydrophobicContact SD-CE1 4.37Å |
| 187 | A | 90.6 | Very high | 88.2 | Confident | 1 Ų | 1 | 48.8 Ų | 48.8 | 1% | 0.008 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -61.3 | -39.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | I183 N184 M191 L214 S215 Y218 | I183-A187 WeakPolarHBondContact O-CB 3.37Å; I183-A187 PolarHBondContact O-N 3.08Å; N184-A187 PolarHBondContact O-N 2.96Å; A187-M191 WeakPolarHBondContact O-CB 3.44Å; A187-M191 PolarHBondContact O-N 2.93Å; A187-L214 HydrophobicContact CB-CB 4.02Å; A187-S215 WeakPolarHBondContact CB-OG 3.37Å; A187-Y218 HydrophobicContact CB-CD2 4.39Å |
| 188 | A | 88.1 | Confident | 88.3 | Confident | 25 Ų | 25 | 55.3 Ų | 55.3 | 21% | 0.207 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -66.9 | -45.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | N184 A185 M186 M191 E192 | N184-A188 VanDerWaalsContact O-CB 3.3Å; N184-A188 WeakPolarHBondContact O-CB 3.48Å; N184-A188 PolarHBondContact O-N 3.05Å; A185-A188 PolarHBondContact O-N 2.9Å; M186-A188 VanDerWaalsContact C-N 3.29Å; M186-A188 PolarHBondContact O-N 2.93Å; A188-M191 PolarHBondContact O-N 3.29Å; A188-E192 WeakPolarHBondContact O-CB 3.31Å; A188-E192 WeakPolarHBondContact O-CG 3.45Å; A188-E192 PolarHBondContact O-N 2.88Å |
| 189 | V | 91.4 | Very high | 88.1 | Confident | 46 Ų | 46 | 53.5 Ų | 53.5 | 28% | 0.279 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -60.1 | -50 | 177 | 167.1 | 0 | 0 | 0 | 0 | 110.7 | Q87 A185 M186 M191 E192 D193 | Q87-V189 HydrophobicContact CB-CG2 4Å; Q87-V189 HydrophobicContact CG-CG2 3.52Å; A185-V189 VanDerWaalsContact O-CG2 3.31Å; A185-V189 WeakPolarHBondContact O-CG2 3.31Å; A185-V189 PolarHBondContact O-N 3.37Å; M186-V189 PolarHBondContact O-N 2.91Å; V189-M191 VanDerWaalsContact C-N 3.29Å; V189-M191 PolarHBondContact O-N 3.33Å; V189-E192 PolarHBondContact O-N 3.44Å; V189-D193 WeakPolarHBondContact CG1-OD2 3.38Å; V189-D193 VanDerWaalsContact O-CB 3.23Å; V189-D193 WeakPolarHBondContact O-CB 3.3Å; V189-D193 PolarHBondContact O-N 2.88Å |
| 190 | T | 92.5 | Very high | 87 | Confident | 20 Ų | 20 | 58.3 Ų | 58.3 | 12% | 0.123 | 31% | 0.307 | C | S | . | . | I | π-helix | trans | -63.7 | -37.9 | 178.6 | -61.5 | 0 | 0 | 0 | 0 | 111.9 | M186 I194 L195 L214 Y218 | M186-T190 WeakPolarHBondContact O-CB 3.26Å; M186-T190 PolarHBondContact O-N 3.13Å; M186-T190 PolarHBondContact O-OG1 3.12Å; T190-I194 HydrophobicContact CG2-CD1 4.36Å; T190-I194 WeakPolarHBondContact O-CB 3.43Å; T190-I194 PolarHBondContact O-N 3.45Å; T190-L195 PolarHBondContact O-N 3.47Å; T190-L214 HydrophobicContact CG2-CD1 3.88Å; T190-L214 HydrophobicContact CG2-CD2 3.96Å; T190-Y218 PolarHBondContact OG1-OH 3.5Å |
| 191 | M | 89.1 | Confident | 86.6 | Confident | 9 Ų | 9 | 67.6 Ų | 67.6 | 4% | 0.044 | 35% | 0.346 | C | S | . | . | I | π-helix | trans | -66.2 | -49 | 177.6 | -172.9 | 68.5 | -118.5 | 0 | 0 | 111.8 | A187 A188 V189 L195 R196 L199 L207 V210 L214 | A187-M191 WeakPolarHBondContact O-CB 3.44Å; A187-M191 PolarHBondContact O-N 2.93Å; A188-M191 PolarHBondContact O-N 3.29Å; V189-M191 VanDerWaalsContact C-N 3.29Å; V189-M191 PolarHBondContact O-N 3.33Å; M191-L195 HydrophobicContact CE-CB 3.9Å; M191-L195 HydrophobicContact SD-CD1 4.31Å; M191-R196 VanDerWaalsContact O-CB 3.27Å; M191-R196 WeakPolarHBondContact O-CB 3.42Å; M191-R196 PolarHBondContact O-N 3.25Å; M191-L199 HydrophobicContact CE-CD1 4.38Å; M191-L207 HydrophobicContact CE-CD1 3.18Å; M191-L207 HydrophobicContact CE-CD2 4.38Å; M191-L207 HydrophobicContact CE-CG 3.61Å; M191-L207 HydrophobicContact SD-CD1 4.28Å; M191-L207 HydrophobicContact SD-CG 4.16Å; M191-V210 HydrophobicContact SD-CB 4.33Å; M191-V210 HydrophobicContact SD-CG1 3.9Å; M191-L214 HydrophobicContact CB-CD1 4.32Å |
| 192 | E | 87.4 | Confident | 86.2 | Confident | 83 Ų | 83 | 69.8 Ų | 69.8 | 39% | 0.388 | 36% | 0.355 | S | S | . | . | I | π-helix | trans | -81 | -41.2 | -173.2 | -71.5 | -66.4 | 159 | 0 | 0 | 113 | A188 V189 R196 | A188-E192 WeakPolarHBondContact O-CB 3.31Å; A188-E192 WeakPolarHBondContact O-CG 3.45Å; A188-E192 PolarHBondContact O-N 2.88Å; V189-E192 PolarHBondContact O-N 3.44Å; E192-R196 IonicContact OE1-CZ 2.95Å; E192-R196 IonicContact OE1-NH1 2.95Å; E192-R196 PolarHBondContact OE1-NH1 3.41Å; E192-R196 WeakPolarHBondContact OE2-CD 3.23Å; E192-R196 IonicContact OE2-CZ 3.79Å; E192-R196 IonicContact OE2-NE 3.76Å; E192-R196 IonicContact OE2-NH1 2.63Å; E192-R196 PolarHBondContact OE2-NH1 2.86Å |
| 193 | D | 90.2 | Very high | 85.9 | Confident | 109 Ų | 109 | 72.5 Ų | 72.5 | 58% | 0.583 | 36% | 0.362 | S | S | * | . | I | π-helix | trans | -91.5 | -32.1 | -171.3 | -58.4 | -23.9 | 0 | 0 | 0 | 112.5 | V189 | V189-D193 WeakPolarHBondContact CG1-OD2 3.38Å; V189-D193 VanDerWaalsContact O-CB 3.23Å; V189-D193 WeakPolarHBondContact O-CB 3.3Å; V189-D193 PolarHBondContact O-N 2.88Å |
| 194 | I | 90.3 | Very high | 85.5 | Confident | 97 Ų | 97 | 77.2 Ų | 77.2 | 50% | 0.497 | 38% | 0.383 | S | S | . | . | I | π-helix | trans | -105.4 | -50.9 | -175.4 | -55.8 | 177 | 0 | 0 | 0 | 111.4 | T190 H198 | T190-I194 HydrophobicContact CG2-CD1 4.36Å; T190-I194 WeakPolarHBondContact O-CB 3.43Å; T190-I194 PolarHBondContact O-N 3.45Å; I194-H198 PolarHBondContact O-ND1 3.16Å |
| 195 | L | 89.5 | Confident | 85.3 | Confident | 47 Ų | 47 | 81.9 Ų | 81.9 | 25% | 0.246 | 40% | 0.401 | C | S | . | . | I | π-helix | trans | -85.6 | -43.4 | -170.5 | -66.9 | -178.4 | 0 | 0 | 0 | 113.2 | T190 M191 P197 H198 L199 V210 L214 | T190-L195 PolarHBondContact O-N 3.47Å; M191-L195 HydrophobicContact CE-CB 3.9Å; M191-L195 HydrophobicContact SD-CD1 4.31Å; L195-P197 VanDerWaalsContact C-CD 3.46Å; L195-H198 CarbonylContact O-C 3.56Å; L195-H198 PolarHBondContact O-N 3.31Å; L195-L199 HydrophobicContact CB-CD1 3.85Å; L195-L199 HydrophobicContact CB-CG 4.47Å; L195-L199 HydrophobicContact CD2-CD1 4.47Å; L195-L199 WeakPolarHBondContact O-CB 3.13Å; L195-L199 VanDerWaalsContact O-CG 3.28Å; L195-L199 WeakPolarHBondContact O-CG 3.28Å; L195-L199 PolarHBondContact O-N 3.49Å; L195-V210 HydrophobicContact CD1-CG1 3.77Å; L195-L214 HydrophobicContact CD1-CD1 3.82Å |
| 196 | R | 84.4 | Confident | 85 | Confident | 116 Ų | 116 | 87.3 Ų | 87.3 | 44% | 0.438 | 42% | 0.424 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.2 | -39.5 | -175.8 | -169.7 | 174.3 | -172.6 | 173.3 | 6.7 | 114.1 | M191 E192 H198 L199 L200 | M191-R196 VanDerWaalsContact O-CB 3.27Å; M191-R196 WeakPolarHBondContact O-CB 3.42Å; M191-R196 PolarHBondContact O-N 3.25Å; E192-R196 IonicContact OE1-CZ 2.95Å; E192-R196 IonicContact OE1-NH1 2.95Å; E192-R196 PolarHBondContact OE1-NH1 3.41Å; E192-R196 WeakPolarHBondContact OE2-CD 3.23Å; E192-R196 IonicContact OE2-CZ 3.79Å; E192-R196 IonicContact OE2-NE 3.76Å; E192-R196 IonicContact OE2-NH1 2.63Å; E192-R196 PolarHBondContact OE2-NH1 2.86Å; R196-H198 PolarHBondContact O-N 2.92Å; R196-L199 PolarHBondContact O-N 3.38Å; R196-L200 PolarHBondContact O-N 3.36Å |
| 197 | P | 85.9 | Confident | 84.6 | Confident | 67 Ų | 67 | 85.1 Ų | 85.1 | 44% | 0.435 | 41% | 0.413 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.9 | -29.5 | 174.6 | -24.6 | 35.2 | 0 | 0 | 0 | 113.5 | L195 L200 | L195-P197 VanDerWaalsContact C-CD 3.46Å; P197-L200 VanDerWaalsContact O-CD1 3.3Å; P197-L200 WeakPolarHBondContact O-CD1 3.29Å; P197-L200 WeakPolarHBondContact O-CG 3.43Å |
| 198 | H | 84.8 | Confident | 84.2 | Confident | 155 Ų | 155 | 88.7 Ų | 88.7 | 72% | 0.718 | 44% | 0.435 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.4 | -20 | -178.6 | -59.1 | 102 | 0 | 0 | 0 | 113.1 | I194 L195 R196 | I194-H198 PolarHBondContact O-ND1 3.16Å; L195-H198 CarbonylContact O-C 3.56Å; L195-H198 PolarHBondContact O-N 3.31Å; R196-H198 PolarHBondContact O-N 2.92Å |
| 199 | L | 81.3 | Confident | 84.1 | Confident | 52 Ų | 52 | 93.5 Ų | 93.5 | 27% | 0.272 | 46% | 0.456 | S | S | . | . | trans | -109.1 | 24.1 | -173.8 | -59.9 | -178.6 | 0 | 0 | 0 | 113.5 | M191 L195 R196 K201 M202 | M191-L199 HydrophobicContact CE-CD1 4.38Å; L195-L199 HydrophobicContact CB-CD1 3.85Å; L195-L199 HydrophobicContact CB-CG 4.47Å; L195-L199 HydrophobicContact CD2-CD1 4.47Å; L195-L199 WeakPolarHBondContact O-CB 3.13Å; L195-L199 VanDerWaalsContact O-CG 3.28Å; L195-L199 WeakPolarHBondContact O-CG 3.28Å; L195-L199 PolarHBondContact O-N 3.49Å; R196-L199 PolarHBondContact O-N 3.38Å; L199-K201 PolarHBondContact O-N 2.98Å; L199-M202 HydrophobicContact CB-CG 4.15Å; L199-M202 HydrophobicContact CB-SD 3.85Å; L199-M202 HydrophobicContact CD1-SD 3.76Å; L199-M202 HydrophobicContact CD2-SD 3.67Å; L199-M202 HydrophobicContact CG-SD 3.95Å; L199-M202 PolarHBondContact O-N 3.37Å | ||
| 200 | L | 65.9 | Low | 83.9 | Confident | 143 Ų | 143 | 93.4 Ų | 93.4 | 75% | 0.749 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -50.1 | -19.2 | -172.8 | -70.8 | 164.1 | 0 | 0 | 0 | 116.2 | R196 P197 | R196-L200 PolarHBondContact O-N 3.36Å; P197-L200 VanDerWaalsContact O-CD1 3.3Å; P197-L200 WeakPolarHBondContact O-CD1 3.29Å; P197-L200 WeakPolarHBondContact O-CG 3.43Å |
| 201 | K | 75.6 | Confident | 83.6 | Confident | 212 Ų | 212 | 94.3 Ų | 94.3 | 92% | 0.922 | 46% | 0.463 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -106.7 | 6.7 | -177.7 | -66.3 | -176.5 | 179.3 | 178.4 | 0 | 114.8 | L199 | L199-K201 PolarHBondContact O-N 2.98Š|
| 202 | M | 77.3 | Confident | 83.4 | Confident | 70 Ų | 70 | 99.1 Ų | 99.1 | 35% | 0.345 | 48% | 0.484 | S | S | . | . | trans | -81.5 | 141 | -177.5 | -69.8 | -169.8 | 75.2 | 0 | 0 | 113 | L199 K206 | L199-M202 HydrophobicContact CB-CG 4.15Å; L199-M202 HydrophobicContact CB-SD 3.85Å; L199-M202 HydrophobicContact CD1-SD 3.76Å; L199-M202 HydrophobicContact CD2-SD 3.67Å; L199-M202 HydrophobicContact CG-SD 3.95Å; L199-M202 PolarHBondContact O-N 3.37Å; M202-K206 HydrophobicContact CE-CB 3.71Å; M202-K206 HydrophobicContact CE-CD 4.11Å | ||
| 203 | E | 83.1 | Confident | 83.5 | Confident | 107 Ų | 107 | 96.8 Ų | 96.8 | 50% | 0.5 | 48% | 0.481 | S | S | . | . | trans | -62.3 | 141.7 | 173.7 | -170.5 | -172.8 | 163.4 | 0 | 0 | 111.3 | K205 K206 L207 | E203-K205 PolarHBondContact O-N 3.27Å; E203-K205 VanDerWaalsContact O-N 3.12Å; E203-K205 WeakPolarHBondContact OE1-CD 3.5Å; E203-K206 PolarHBondContact O-N 3.19Å; E203-L207 PolarHBondContact O-N 3.08Å; E203-L207 VanDerWaalsContact O-N 3.08Å | ||
| 204 | Q | 81.5 | Confident | 83.5 | Confident | 127 Ų | 127 | 92.8 Ų | 92.8 | 59% | 0.593 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -51.6 | -37.9 | -179.9 | -72.5 | -63.7 | -32.6 | 0 | 0 | 113.4 | K206 L207 V208 | Q204-K206 VanDerWaalsContact C-N 3.34Å; Q204-K206 PolarHBondContact O-N 3.06Å; Q204-L207 WeakPolarHBondContact O-CB 3.48Å; Q204-L207 PolarHBondContact O-N 3.34Å; Q204-V208 WeakPolarHBondContact O-CG2 3.45Å; Q204-V208 PolarHBondContact O-N 3.48Å |
| 205 | K | 81.9 | Confident | 83.4 | Confident | 161 Ų | 161 | 89.3 Ų | 89.3 | 70% | 0.7 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -62.2 | -39.5 | 176.9 | -67.8 | -177 | -175.6 | 167.9 | 0 | 112.8 | E203 L209 | E203-K205 PolarHBondContact O-N 3.27Å; E203-K205 VanDerWaalsContact O-N 3.12Å; E203-K205 WeakPolarHBondContact OE1-CD 3.5Å; K205-L209 PolarHBondContact O-N 3.37Å; K205-L209 VanDerWaalsContact O-N 3.16Å |
| 206 | K | 83.6 | Confident | 83.5 | Confident | 118 Ų | 118 | 94.6 Ų | 94.6 | 51% | 0.513 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -72.1 | -36.1 | 177.3 | -63.3 | -177.4 | -179.1 | 178.1 | 0 | 110.9 | M202 E203 Q204 V208 L209 V210 | M202-K206 HydrophobicContact CE-CB 3.71Å; M202-K206 HydrophobicContact CE-CD 4.11Å; E203-K206 PolarHBondContact O-N 3.19Å; Q204-K206 VanDerWaalsContact C-N 3.34Å; Q204-K206 PolarHBondContact O-N 3.06Å; K206-V208 VanDerWaalsContact C-N 3.35Å; K206-V208 PolarHBondContact O-N 3.25Å; K206-L209 WeakPolarHBondContact O-CB 3.37Å; K206-L209 PolarHBondContact O-N 3.44Å; K206-V210 WeakPolarHBondContact O-CG2 3.41Å; K206-V210 PolarHBondContact O-N 3.47Å |
| 207 | L | 82.5 | Confident | 83.9 | Confident | 23 Ų | 23 | 94.5 Ų | 94.5 | 12% | 0.12 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -59.2 | -45.4 | 174.6 | -148.7 | 76.7 | 0 | 0 | 0 | 111.9 | M191 E203 Q204 L209 V210 S211 | M191-L207 HydrophobicContact CE-CD1 3.18Å; M191-L207 HydrophobicContact CE-CD2 4.38Å; M191-L207 HydrophobicContact CE-CG 3.61Å; M191-L207 HydrophobicContact SD-CD1 4.28Å; M191-L207 HydrophobicContact SD-CG 4.16Å; E203-L207 PolarHBondContact O-N 3.08Å; E203-L207 VanDerWaalsContact O-N 3.08Å; Q204-L207 WeakPolarHBondContact O-CB 3.48Å; Q204-L207 PolarHBondContact O-N 3.34Å; L207-L209 VanDerWaalsContact C-N 3.32Å; L207-L209 PolarHBondContact O-N 2.95Å; L207-V210 PolarHBondContact O-N 3.26Å; L207-S211 PolarHBondContact O-N 3.46Å |
| 208 | V | 82.4 | Confident | 84.2 | Confident | 75 Ų | 75 | 94.7 Ų | 94.7 | 46% | 0.455 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -63.8 | -38.5 | 175.6 | 173.1 | 0 | 0 | 0 | 0 | 111.3 | Q204 K206 S211 K212 | Q204-V208 WeakPolarHBondContact O-CG2 3.45Å; Q204-V208 PolarHBondContact O-N 3.48Å; K206-V208 VanDerWaalsContact C-N 3.35Å; K206-V208 PolarHBondContact O-N 3.25Å; V208-S211 PolarHBondContact O-N 3.43Å; V208-K212 HydrophobicContact CG1-CD 4.41Å; V208-K212 WeakPolarHBondContact O-CB 3.5Å; V208-K212 WeakPolarHBondContact O-CG 3.33Å; V208-K212 PolarHBondContact O-N 3.15Å |
| 209 | L | 86.2 | Confident | 84.5 | Confident | 126 Ų | 126 | 88.1 Ų | 88.1 | 66% | 0.66 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -64.9 | -42.4 | 176.1 | -171.7 | 67.9 | 0 | 0 | 0 | 111.8 | K205 K206 L207 K212 G213 | K205-L209 PolarHBondContact O-N 3.37Å; K205-L209 VanDerWaalsContact O-N 3.16Å; K206-L209 WeakPolarHBondContact O-CB 3.37Å; K206-L209 PolarHBondContact O-N 3.44Å; L207-L209 VanDerWaalsContact C-N 3.32Å; L207-L209 PolarHBondContact O-N 2.95Å; L209-K212 PolarHBondContact O-N 3.25Å; L209-G213 PolarHBondContact O-N 2.98Å |
| 210 | V | 87.4 | Confident | 85.1 | Confident | 45 Ų | 45 | 87.7 Ų | 87.7 | 27% | 0.273 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -62.5 | -46.4 | 175.5 | 172.3 | 0 | 0 | 0 | 0 | 110.8 | M191 L195 K206 L207 K212 G213 L214 | M191-V210 HydrophobicContact SD-CB 4.33Å; M191-V210 HydrophobicContact SD-CG1 3.9Å; L195-V210 HydrophobicContact CD1-CG1 3.77Å; K206-V210 WeakPolarHBondContact O-CG2 3.41Å; K206-V210 PolarHBondContact O-N 3.47Å; L207-V210 PolarHBondContact O-N 3.26Å; V210-K212 VanDerWaalsContact C-N 3.33Å; V210-K212 PolarHBondContact O-N 3.03Å; V210-G213 CarbonylContact O-C 3.57Å; V210-G213 WeakPolarHBondContact O-CA 3.21Å; V210-G213 PolarHBondContact O-N 2.95Å; V210-G213 VanDerWaalsContact O-N 3.08Å; V210-L214 HydrophobicContact CG1-CD1 4.49Å; V210-L214 PolarHBondContact O-N 3.03Å |
| 211 | S | 85.1 | Confident | 86.4 | Confident | 39 Ų | 39 | 82.5 Ų | 82.5 | 27% | 0.273 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -60.4 | -39.8 | 176.5 | 179.4 | 0 | 0 | 0 | 0 | 112.6 | L207 V208 L214 S215 | L207-S211 PolarHBondContact O-N 3.46Å; V208-S211 PolarHBondContact O-N 3.43Å; S211-L214 PolarHBondContact O-N 3.17Å; S211-S215 PolarHBondContact O-N 3.46Å; S211-S215 PolarHBondContact O-OG 3.44Å |
| 212 | K | 84.8 | Confident | 87.1 | Confident | 110 Ų | 110 | 75.1 Ų | 75.1 | 48% | 0.478 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -64.4 | -39.9 | 172.2 | -76 | -178.8 | 175.6 | -174.5 | 0 | 112.2 | V208 L209 V210 S215 F216 | V208-K212 HydrophobicContact CG1-CD 4.41Å; V208-K212 WeakPolarHBondContact O-CB 3.5Å; V208-K212 WeakPolarHBondContact O-CG 3.33Å; V208-K212 PolarHBondContact O-N 3.15Å; L209-K212 PolarHBondContact O-N 3.25Å; V210-K212 VanDerWaalsContact C-N 3.33Å; V210-K212 PolarHBondContact O-N 3.03Å; K212-S215 PolarHBondContact O-N 3.42Å; K212-F216 PolarHBondContact O-N 3.35Å |
| 213 | G | 90.3 | Very high | 87.7 | Confident | 33 Ų | 33 | 77.7 Ų | 77.7 | 34% | 0.34 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -62.3 | -44.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | L209 V210 S215 F216 L217 | L209-G213 PolarHBondContact O-N 2.98Å; V210-G213 CarbonylContact O-C 3.57Å; V210-G213 WeakPolarHBondContact O-CA 3.21Å; V210-G213 PolarHBondContact O-N 2.95Å; V210-G213 VanDerWaalsContact O-N 3.08Å; G213-S215 PolarHBondContact O-N 2.66Å; G213-F216 WeakPolarHBondContact O-CB 3.49Å; G213-F216 PolarHBondContact O-N 3Å; G213-L217 WeakPolarHBondContact O-CG 3.43Å; G213-L217 PolarHBondContact O-N 3.47Å |
| 214 | L | 90.4 | Very high | 88.1 | Confident | 25 Ų | 25 | 76.6 Ų | 76.6 | 13% | 0.131 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -60.3 | -45.2 | 173.7 | -73 | 174.6 | 0 | 0 | 0 | 111.8 | A187 T190 M191 L195 V210 S211 F216 L217 Y218 | A187-L214 HydrophobicContact CB-CB 4.02Å; T190-L214 HydrophobicContact CG2-CD1 3.88Å; T190-L214 HydrophobicContact CG2-CD2 3.96Å; M191-L214 HydrophobicContact CB-CD1 4.32Å; L195-L214 HydrophobicContact CD1-CD1 3.82Å; V210-L214 HydrophobicContact CG1-CD1 4.49Å; V210-L214 PolarHBondContact O-N 3.03Å; S211-L214 PolarHBondContact O-N 3.17Å; L214-F216 VanDerWaalsContact C-N 3.26Å; L214-F216 PolarHBondContact O-N 2.86Å; L214-L217 PolarHBondContact O-N 3.32Å; L214-L217 VanDerWaalsContact O-N 3.17Å; L214-Y218 HydrophobicContact CB-CD2 4.43Å; L214-Y218 HydrophobicContact CB-CE2 4.33Å; L214-Y218 WeakPolarHBondContact O-CD2 3.23Å; L214-Y218 PolarHBondContact O-N 2.86Å |
| 215 | S | 88.6 | Confident | 88.5 | Confident | 24 Ų | 24 | 75.1 Ų | 75.1 | 17% | 0.168 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -59.8 | -38.9 | 177.7 | -57 | 0 | 0 | 0 | 0 | 111.8 | I183 A187 S211 K212 G213 G219 | I183-S215 VanDerWaalsContact CG2-O 3.28Å; I183-S215 WeakPolarHBondContact CG2-O 3.3Å; A187-S215 WeakPolarHBondContact CB-OG 3.37Å; S211-S215 PolarHBondContact O-N 3.46Å; S211-S215 PolarHBondContact O-OG 3.44Å; K212-S215 PolarHBondContact O-N 3.42Å; G213-S215 PolarHBondContact O-N 2.66Å; S215-G219 PolarHBondContact O-N 2.78Å |
| 216 | F | 90.3 | Very high | 88.8 | Confident | 158 Ų | 158 | 70 Ų | 70 | 69% | 0.693 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -65.7 | -45.6 | 174.2 | 179.3 | -96.1 | 0 | 0 | 0 | 112.1 | K212 G213 L214 G219 A220 | K212-F216 PolarHBondContact O-N 3.35Å; G213-F216 WeakPolarHBondContact O-CB 3.49Å; G213-F216 PolarHBondContact O-N 3Å; L214-F216 VanDerWaalsContact C-N 3.26Å; L214-F216 PolarHBondContact O-N 2.86Å; F216-G219 PolarHBondContact O-N 3.29Å; F216-A220 PolarHBondContact O-N 2.86Å |
| 217 | L | 92.9 | Very high | 89 | Confident | 115 Ų | 115 | 67.1 Ų | 67.1 | 60% | 0.602 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -60.7 | -46.9 | 177.7 | -74.6 | 168.3 | 0 | 0 | 0 | 112.3 | G213 L214 G219 A220 G221 | G213-L217 WeakPolarHBondContact O-CG 3.43Å; G213-L217 PolarHBondContact O-N 3.47Å; L214-L217 PolarHBondContact O-N 3.32Å; L214-L217 VanDerWaalsContact O-N 3.17Å; L217-G219 VanDerWaalsContact C-N 3.35Å; L217-A220 PolarHBondContact O-N 3.07Å; L217-G221 PolarHBondContact O-N 3.49Å |
| 218 | Y | 93 | Very high | 89.2 | Confident | 71 Ų | 71 | 70.9 Ų | 70.9 | 28% | 0.278 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -63.9 | -40.1 | 175.6 | -74.6 | -59.4 | 0 | 0 | 0 | 112 | M186 A187 T190 L214 A220 G221 C222 | M186-Y218 HydrophobicContact CB-CD1 4.31Å; M186-Y218 HydrophobicContact CB-CD2 3.97Å; M186-Y218 HydrophobicContact CB-CE1 4.3Å; M186-Y218 HydrophobicContact CB-CE2 3.96Å; M186-Y218 HydrophobicContact CB-CG 4.18Å; M186-Y218 HydrophobicContact CE-CD1 4.09Å; M186-Y218 HydrophobicContact CE-CG 4.13Å; M186-Y218 HydrophobicContact SD-CD1 4.1Å; M186-Y218 HydrophobicContact SD-CE1 4.37Å; A187-Y218 HydrophobicContact CB-CD2 4.39Å; T190-Y218 PolarHBondContact OG1-OH 3.5Å; L214-Y218 HydrophobicContact CB-CD2 4.43Å; L214-Y218 HydrophobicContact CB-CE2 4.33Å; L214-Y218 WeakPolarHBondContact O-CD2 3.23Å; L214-Y218 PolarHBondContact O-N 2.86Å; Y218-A220 PolarHBondContact O-N 2.92Å; Y218-G221 PolarHBondContact O-N 2.88Å; Y218-C222 PolarHBondContact O-N 3.43Å; Y218-C222 PolarHBondContact O-SG 2.91Å |
| 219 | G | 91.3 | Very high | 89.3 | Confident | 17 Ų | 17 | 69 Ų | 69 | 18% | 0.175 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -59.9 | -44.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | S215 F216 L217 C222 I223 | S215-G219 PolarHBondContact O-N 2.78Å; F216-G219 PolarHBondContact O-N 3.29Å; L217-G219 VanDerWaalsContact C-N 3.35Å; G219-C222 PolarHBondContact O-N 3.5Å; G219-I223 WeakPolarHBondContact O-CG1 3.05Å; G219-I223 PolarHBondContact O-N 3.01Å; G219-I223 VanDerWaalsContact O-N 3.14Å |
| 220 | A | 92.8 | Very high | 88.9 | Confident | 43 Ų | 43 | 67.8 Ų | 67.8 | 36% | 0.355 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -61.8 | -44.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | F216 L217 Y218 C222 I223 T224 | F216-A220 PolarHBondContact O-N 2.86Å; L217-A220 PolarHBondContact O-N 3.07Å; Y218-A220 PolarHBondContact O-N 2.92Å; A220-C222 PolarHBondContact O-N 3.3Å; A220-I223 PolarHBondContact O-N 3.36Å; A220-I223 VanDerWaalsContact O-N 3.17Å; A220-T224 PolarHBondContact O-N 3.44Å; A220-T224 PolarHBondContact O-OG1 3.14Å |
| 221 | G | 93.1 | Very high | 88.6 | Confident | 33 Ų | 33 | 73.5 Ų | 73.5 | 34% | 0.34 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -59.4 | -42.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | L217 Y218 I223 T224 V225 | L217-G221 PolarHBondContact O-N 3.49Å; Y218-G221 PolarHBondContact O-N 2.88Å; G221-I223 VanDerWaalsContact C-N 3.33Å; G221-I223 PolarHBondContact O-N 3.31Å; G221-T224 WeakPolarHBondContact O-CB 3.03Å; G221-T224 PolarHBondContact O-N 2.9Å; G221-V225 WeakPolarHBondContact O-CG2 3.34Å; G221-V225 PolarHBondContact O-N 3.22Å |
| 222 | C | 90.6 | Very high | 88.2 | Confident | 58 Ų | 58 | 75.3 Ų | 75.3 | 39% | 0.392 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -59.8 | -41.4 | 174.4 | -71.4 | 0 | 0 | 0 | 0 | 112.1 | Y218 G219 A220 V225 A226 | Y218-C222 PolarHBondContact O-N 3.43Å; Y218-C222 PolarHBondContact O-SG 2.91Å; G219-C222 PolarHBondContact O-N 3.5Å; A220-C222 PolarHBondContact O-N 3.3Å; C222-V225 PolarHBondContact O-N 3.26Å; C222-A226 WeakPolarHBondContact O-CB 3.49Å; C222-A226 PolarHBondContact O-N 3.5Å |
| 223 | I | 90.9 | Very high | 87.4 | Confident | 124 Ų | 124 | 78.4 Ų | 78.4 | 64% | 0.636 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -65.3 | -42.1 | 176.2 | -65.7 | 167.7 | 0 | 0 | 0 | 110.6 | G219 A220 G221 A226 A227 | G219-I223 WeakPolarHBondContact O-CG1 3.05Å; G219-I223 PolarHBondContact O-N 3.01Å; G219-I223 VanDerWaalsContact O-N 3.14Å; A220-I223 PolarHBondContact O-N 3.36Å; A220-I223 VanDerWaalsContact O-N 3.17Å; G221-I223 VanDerWaalsContact C-N 3.33Å; G221-I223 PolarHBondContact O-N 3.31Å; I223-A226 PolarHBondContact O-N 3.32Å; I223-A227 PolarHBondContact O-N 3.27Å |
| 224 | T | 90.9 | Very high | 86.4 | Confident | 83 Ų | 83 | 82.4 Ų | 82.4 | 51% | 0.509 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -60.5 | -47.3 | 175.7 | -56 | 0 | 0 | 0 | 0 | 111.5 | A220 G221 A226 A227 L228 | A220-T224 PolarHBondContact O-N 3.44Å; A220-T224 PolarHBondContact O-OG1 3.14Å; G221-T224 WeakPolarHBondContact O-CB 3.03Å; G221-T224 PolarHBondContact O-N 2.9Å; T224-A226 VanDerWaalsContact C-N 3.33Å; T224-A226 PolarHBondContact O-N 2.9Å; T224-A227 PolarHBondContact O-N 2.99Å; T224-L228 HydrophobicContact CG2-CD1 4.17Å; T224-L228 WeakPolarHBondContact O-CG 3.49Å; T224-L228 PolarHBondContact O-N 2.86Å |
| 225 | V | 89 | Confident | 85.4 | Confident | 96 Ų | 96 | 82.3 Ų | 82.3 | 58% | 0.582 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -63.7 | -39.2 | 177.3 | 174 | 0 | 0 | 0 | 0 | 111.2 | G221 C222 L228 S229 | G221-V225 WeakPolarHBondContact O-CG2 3.34Å; G221-V225 PolarHBondContact O-N 3.22Å; C222-V225 PolarHBondContact O-N 3.26Å; V225-L228 PolarHBondContact O-N 2.93Å; V225-S229 WeakPolarHBondContact O-CB 3.39Å; V225-S229 PolarHBondContact O-N 2.93Å |
| 226 | A | 87.9 | Confident | 85 | Confident | 54 Ų | 54 | 84.4 Ų | 84.4 | 45% | 0.446 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61.7 | -44 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | C222 I223 T224 S229 | C222-A226 WeakPolarHBondContact O-CB 3.49Å; C222-A226 PolarHBondContact O-N 3.5Å; I223-A226 PolarHBondContact O-N 3.32Å; T224-A226 VanDerWaalsContact C-N 3.33Å; T224-A226 PolarHBondContact O-N 2.9Å; A226-S229 PolarHBondContact O-N 3.22Å; A226-S229 PolarHBondContact O-OG 3.35Å |
| 227 | A | 88.1 | Confident | 84.6 | Confident | 57 Ų | 57 | 81.9 Ų | 81.9 | 47% | 0.471 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -63 | -42.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | I223 T224 S229 S230 | I223-A227 PolarHBondContact O-N 3.27Å; T224-A227 PolarHBondContact O-N 2.99Å; A227-S229 VanDerWaalsContact C-N 3.31Å; A227-S229 PolarHBondContact O-N 3.36Å; A227-S230 WeakPolarHBondContact O-CB 3.47Å; A227-S230 PolarHBondContact O-N 2.89Å |
| 228 | L | 87.1 | Confident | 83.9 | Confident | 103 Ų | 103 | 79.7 Ų | 79.7 | 54% | 0.539 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -65.9 | -33.2 | 176.5 | -69.9 | 173.7 | 0 | 0 | 0 | 112.6 | T224 V225 S230 F231 | T224-L228 HydrophobicContact CG2-CD1 4.17Å; T224-L228 WeakPolarHBondContact O-CG 3.49Å; T224-L228 PolarHBondContact O-N 2.86Å; V225-L228 PolarHBondContact O-N 2.93Å; L228-S230 PolarHBondContact O-N 3.31Å; L228-F231 HydrophobicContact CD2-CD2 4.44Å; L228-F231 PolarHBondContact O-N 2.94Å; L228-F231 VanDerWaalsContact O-N 3.07Å |
| 229 | S | 83.9 | Confident | 83.4 | Confident | 34 Ų | 34 | 76.9 Ų | 76.9 | 24% | 0.238 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -63.7 | -21.5 | 178.2 | 75.5 | 0 | 0 | 0 | 0 | 113.3 | V225 A226 A227 F231 L232 | V225-S229 WeakPolarHBondContact O-CB 3.39Å; V225-S229 PolarHBondContact O-N 2.93Å; A226-S229 PolarHBondContact O-N 3.22Å; A226-S229 PolarHBondContact O-OG 3.35Å; A227-S229 VanDerWaalsContact C-N 3.31Å; A227-S229 PolarHBondContact O-N 3.36Å; S229-F231 PolarHBondContact O-N 3.45Å; S229-L232 WeakPolarHBondContact O-CB 3.35Å; S229-L232 PolarHBondContact O-N 2.91Å; S229-L232 VanDerWaalsContact O-N 3.16Å |
| 230 | S | 79.5 | Confident | 83.1 | Confident | 101 Ų | 101 | 79.4 Ų | 79.4 | 71% | 0.706 | 47% | 0.47 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.7 | -13.7 | 175.8 | -56.1 | 0 | 0 | 0 | 0 | 113.4 | A227 L228 | A227-S230 WeakPolarHBondContact O-CB 3.47Å; A227-S230 PolarHBondContact O-N 2.89Å; L228-S230 PolarHBondContact O-N 3.31Å |
| 231 | F | 80.8 | Confident | 82.7 | Confident | 165 Ų | 165 | 82.3 Ų | 82.3 | 72% | 0.724 | 47% | 0.474 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.3 | -0.8 | 173.4 | -60.5 | -67.3 | 0 | 0 | 0 | 113.2 | L228 S229 | L228-F231 HydrophobicContact CD2-CD2 4.44Å; L228-F231 PolarHBondContact O-N 2.94Å; L228-F231 VanDerWaalsContact O-N 3.07Å; S229-F231 PolarHBondContact O-N 3.45Å |
| 232 | L | 75.3 | Confident | 82.5 | Confident | 78 Ų | 78 | 83.2 Ų | 83.2 | 41% | 0.408 | 47% | 0.473 | S | S | . | . | trans | -93.6 | 126.9 | -179.8 | -59.2 | 170.4 | 0 | 0 | 0 | 109 | S229 W234 | S229-L232 WeakPolarHBondContact O-CB 3.35Å; S229-L232 PolarHBondContact O-N 2.91Å; S229-L232 VanDerWaalsContact O-N 3.16Å; L232-W234 HydrophobicContact CB-CD2 4.49Å; L232-W234 HydrophobicContact CB-CG 4.37Å; L232-W234 HydrophobicContact CD1-CZ2 3.9Å; L232-W234 VanDerWaalsContact CD1-NE1 3.31Å; L232-W234 HydrophobicContact CD2-CH2 4.46Å; L232-W234 HydrophobicContact CD2-CZ2 3.84Å; L232-W234 HydrophobicContact CG-CZ2 4.33Å; L232-W234 PolarHBondContact O-N 3.3Å | ||
| 233 | D | 68.8 | Low | 82.4 | Confident | 175 Ų | 175 | 85 Ų | 85 | 94% | 0.936 | 48% | 0.483 | S | S | * | . | trans | -76.4 | -10.4 | -179.8 | -61.9 | -51.7 | 0 | 0 | 0 | 113.1 | ||||
| 234 | W | 68.5 | Low | 82.2 | Confident | 116 Ų | 116 | 80.6 Ų | 80.6 | 44% | 0.439 | 46% | 0.459 | S | S | . | . | S | Bend | trans | -82.4 | 148 | 175.5 | 55.7 | 48.5 | 0 | 0 | 0 | 112 | L232 V236 T288 | L232-W234 HydrophobicContact CB-CD2 4.49Å; L232-W234 HydrophobicContact CB-CG 4.37Å; L232-W234 HydrophobicContact CD1-CZ2 3.9Å; L232-W234 VanDerWaalsContact CD1-NE1 3.31Å; L232-W234 HydrophobicContact CD2-CH2 4.46Å; L232-W234 HydrophobicContact CD2-CZ2 3.84Å; L232-W234 HydrophobicContact CG-CZ2 4.33Å; L232-W234 PolarHBondContact O-N 3.3Å; W234-V236 PolarHBondContact O-N 3.21Å; W234-T288 HydrophobicContact CE3-CG2 3.9Å; W234-T288 HydrophobicContact CH2-CG2 3.91Å; W234-T288 HydrophobicContact CZ3-CG2 3.23Å |
| 235 | G | 70.9 | Confident | 82.1 | Confident | 24 Ų | 24 | 78.2 Ų | 78.2 | 25% | 0.247 | 45% | 0.451 | C | S | . | . | trans | -59.3 | 135.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112 | L237 Q238 G239 | G235-L237 VanDerWaalsContact C-N 3.25Å; G235-L237 PolarHBondContact O-N 3.48Å; G235-Q238 WeakPolarHBondContact O-CB 3.32Å; G235-Q238 PolarHBondContact O-N 3.37Å; G235-G239 PolarHBondContact O-N 3.35Å; G235-G239 VanDerWaalsContact O-N 3.17Å | ||
| 236 | V | 80.1 | Confident | 82.2 | Confident | 68 Ų | 68 | 74.4 Ų | 74.4 | 41% | 0.412 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -59.5 | -37.6 | -172.5 | 177.7 | 0 | 0 | 0 | 0 | 112 | D146 W234 Q238 G239 S240 | D146-V236 WeakPolarHBondContact OD2-CG2 3.39Å; W234-V236 PolarHBondContact O-N 3.21Å; V236-Q238 VanDerWaalsContact C-N 3.33Å; V236-Q238 PolarHBondContact O-N 3.13Å; V236-G239 PolarHBondContact O-N 3.16Å; V236-S240 WeakPolarHBondContact O-CB 3.42Å; V236-S240 PolarHBondContact O-N 2.88Å; V236-S240 PolarHBondContact O-OG 2.84Å |
| 237 | L | 80.3 | Confident | 82.4 | Confident | 104 Ų | 104 | 75.5 Ų | 75.5 | 55% | 0.545 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -60 | -43.2 | 177.1 | -169.4 | 79.5 | 0 | 0 | 0 | 111.9 | G235 S240 F241 | G235-L237 VanDerWaalsContact C-N 3.25Å; G235-L237 PolarHBondContact O-N 3.48Å; L237-S240 PolarHBondContact O-N 2.73Å; L237-F241 HydrophobicContact CD1-CE2 4.08Å; L237-F241 HydrophobicContact CD2-CE2 4.29Å; L237-F241 HydrophobicContact CG-CD2 4.15Å; L237-F241 HydrophobicContact CG-CE2 3.89Å; L237-F241 VanDerWaalsContact O-CD2 3.27Å; L237-F241 WeakPolarHBondContact O-CD2 3.26Å; L237-F241 PolarHBondContact O-N 3.22Å |
| 238 | Q | 79 | Confident | 82.5 | Confident | 70 Ų | 70 | 74.1 Ų | 74.1 | 33% | 0.327 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -67.8 | -48.9 | -179.2 | -170.9 | 179.6 | -8.3 | 0 | 0 | 111.1 | R65 G235 V236 S240 F241 T242 | R65-Q238 VanDerWaalsContact CZ-CD 3.48Å; R65-Q238 VanDerWaalsContact NH1-CD 3.3Å; G235-Q238 WeakPolarHBondContact O-CB 3.32Å; G235-Q238 PolarHBondContact O-N 3.37Å; V236-Q238 VanDerWaalsContact C-N 3.33Å; V236-Q238 PolarHBondContact O-N 3.13Å; Q238-S240 PolarHBondContact O-N 3.41Å; Q238-F241 PolarHBondContact O-N 3.45Å; Q238-F241 VanDerWaalsContact O-N 3.15Å; Q238-T242 PolarHBondContact O-N 2.89Å; Q238-T242 PolarHBondContact O-OG1 3.2Å |
| 239 | G | 83.3 | Confident | 82.7 | Confident | 12 Ų | 12 | 71 Ų | 71 | 12% | 0.124 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -56.4 | -39.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | G235 V236 T242 V243 | G235-G239 PolarHBondContact O-N 3.35Å; G235-G239 VanDerWaalsContact O-N 3.17Å; V236-G239 PolarHBondContact O-N 3.16Å; G239-T242 PolarHBondContact O-N 3.35Å; G239-V243 WeakPolarHBondContact O-CG2 3.3Å; G239-V243 PolarHBondContact O-N 3.46Å |
| 240 | S | 84.8 | Confident | 83.2 | Confident | 69 Ų | 69 | 70 Ų | 70 | 48% | 0.483 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -62.9 | -47 | 176.9 | -58.3 | 0 | 0 | 0 | 0 | 112.5 | V236 L237 Q238 T242 M244 | V236-S240 WeakPolarHBondContact O-CB 3.42Å; V236-S240 PolarHBondContact O-N 2.88Å; V236-S240 PolarHBondContact O-OG 2.84Å; L237-S240 PolarHBondContact O-N 2.73Å; Q238-S240 PolarHBondContact O-N 3.41Å; S240-T242 VanDerWaalsContact C-N 3.35Å; S240-T242 PolarHBondContact O-N 3.43Å; S240-M244 VanDerWaalsContact O-CB 3.26Å; S240-M244 WeakPolarHBondContact O-CB 3.45Å; S240-M244 PolarHBondContact O-N 2.94Å |
| 241 | F | 84.5 | Confident | 83.9 | Confident | 104 Ų | 104 | 67.7 Ų | 67.7 | 46% | 0.456 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -64.1 | -38.4 | 176.4 | -80.3 | -62 | 0 | 0 | 0 | 112.3 | V78 L237 Q238 M244 G245 | V78-F241 HydrophobicContact CG1-CE1 4.3Å; L237-F241 HydrophobicContact CD1-CE2 4.08Å; L237-F241 HydrophobicContact CD2-CE2 4.29Å; L237-F241 HydrophobicContact CG-CD2 4.15Å; L237-F241 HydrophobicContact CG-CE2 3.89Å; L237-F241 VanDerWaalsContact O-CD2 3.27Å; L237-F241 WeakPolarHBondContact O-CD2 3.26Å; L237-F241 PolarHBondContact O-N 3.22Å; Q238-F241 PolarHBondContact O-N 3.45Å; Q238-F241 VanDerWaalsContact O-N 3.15Å; F241-M244 HydrophobicContact CD1-CE 3.44Å; F241-M244 VanDerWaalsContact CD1-CE 3.44Å; F241-M244 HydrophobicContact CE1-CE 3.84Å; F241-G245 PolarHBondContact O-N 3.45Å |
| 242 | T | 87.9 | Confident | 84.5 | Confident | 52 Ų | 52 | 60.3 Ų | 60.3 | 32% | 0.319 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -62.6 | -52.7 | 176.6 | -58.2 | 0 | 0 | 0 | 0 | 111.4 | Q238 G239 S240 M244 G245 V246 A284 | Q238-T242 PolarHBondContact O-N 2.89Å; Q238-T242 PolarHBondContact O-OG1 3.2Å; G239-T242 PolarHBondContact O-N 3.35Å; S240-T242 VanDerWaalsContact C-N 3.35Å; S240-T242 PolarHBondContact O-N 3.43Å; T242-M244 VanDerWaalsContact C-N 3.29Å; T242-M244 PolarHBondContact O-N 2.92Å; T242-G245 PolarHBondContact O-N 2.75Å; T242-G245 VanDerWaalsContact O-N 3.14Å; T242-V246 HydrophobicContact CG2-CG2 4.49Å; T242-V246 VanDerWaalsContact O-CG2 3.3Å; T242-V246 WeakPolarHBondContact O-CG2 3.5Å; T242-V246 PolarHBondContact O-N 3.33Å; T242-A284 HydrophobicContact CG2-CB 3.85Å |
| 243 | V | 88.1 | Confident | 85.4 | Confident | 97 Ų | 97 | 58.3 Ų | 58.3 | 59% | 0.588 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -60 | -43.5 | 179.3 | 172.2 | 0 | 0 | 0 | 0 | 110.9 | G239 G245 V246 V247 | G239-V243 WeakPolarHBondContact O-CG2 3.3Å; G239-V243 PolarHBondContact O-N 3.46Å; V243-G245 PolarHBondContact O-N 3.37Å; V243-V246 PolarHBondContact O-N 3.09Å; V243-V247 PolarHBondContact O-N 3.13Å; V243-V247 VanDerWaalsContact O-N 3.16Å |
| 244 | M | 87.8 | Confident | 86.6 | Confident | 30 Ų | 30 | 51.4 Ų | 51.4 | 15% | 0.148 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -62.1 | -43.2 | 176.5 | -177.1 | -178.5 | 65.4 | 0 | 0 | 111.7 | V78 M82 S240 F241 T242 S248 | V78-M244 HydrophobicContact CB-CE 4.2Å; V78-M244 HydrophobicContact CG1-CE 3.26Å; V78-M244 HydrophobicContact CG1-SD 4.45Å; V78-M244 HydrophobicContact CG2-CE 4Å; M82-M244 HydrophobicContact CE-CE 4.38Å; M82-M244 HydrophobicContact CE-CG 4.5Å; M82-M244 HydrophobicContact CE-SD 3.07Å; M82-M244 WeakPolarHBondContact CE-SD 3.49Å; M82-M244 HydrophobicContact CG-SD 3.9Å; M82-M244 HydrophobicContact SD-SD 3.6Å; M82-M244 VanDerWaalsContact SD-SD 3.6Å; S240-M244 VanDerWaalsContact O-CB 3.26Å; S240-M244 WeakPolarHBondContact O-CB 3.45Å; S240-M244 PolarHBondContact O-N 2.94Å; F241-M244 HydrophobicContact CD1-CE 3.44Å; F241-M244 VanDerWaalsContact CD1-CE 3.44Å; F241-M244 HydrophobicContact CE1-CE 3.84Å; T242-M244 VanDerWaalsContact C-N 3.29Å; T242-M244 PolarHBondContact O-N 2.92Å; M244-S248 WeakPolarHBondContact CG-OG 3.49Å; M244-S248 WeakPolarHBondContact O-CA 3.45Å; M244-S248 WeakPolarHBondContact O-CB 3.36Å; M244-S248 PolarHBondContact O-N 3.33Å; M244-S248 PolarHBondContact O-OG 3.36Å |
| 245 | G | 88.6 | Confident | 87.8 | Confident | 33 Ų | 33 | 50.8 Ų | 50.8 | 34% | 0.34 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -60.9 | -45.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | F241 T242 V243 V247 G249 | F241-G245 PolarHBondContact O-N 3.45Å; T242-G245 PolarHBondContact O-N 2.75Å; T242-G245 VanDerWaalsContact O-N 3.14Å; V243-G245 PolarHBondContact O-N 3.37Å; G245-V247 VanDerWaalsContact C-N 3.34Å; G245-V247 PolarHBondContact O-N 3.41Å; G245-G249 PolarHBondContact O-N 3.47Å |
| 246 | V | 92.1 | Very high | 88.9 | Confident | 16 Ų | 16 | 52.6 Ų | 52.6 | 10% | 0.097 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -60.3 | -41.3 | -178.9 | 172.2 | 0 | 0 | 0 | 0 | 112.5 | T242 V243 P250 F277 L281 A284 | T242-V246 HydrophobicContact CG2-CG2 4.49Å; T242-V246 VanDerWaalsContact O-CG2 3.3Å; T242-V246 WeakPolarHBondContact O-CG2 3.5Å; T242-V246 PolarHBondContact O-N 3.33Å; V243-V246 PolarHBondContact O-N 3.09Å; V246-P250 WeakPolarHBondContact O-CD 3.46Å; V246-P250 WeakPolarHBondContact O-CG 2.95Å; V246-F277 HydrophobicContact CG1-CD2 4.25Å; V246-F277 HydrophobicContact CG1-CE2 3.96Å; V246-L281 HydrophobicContact CG1-CB 4.39Å; V246-A284 HydrophobicContact CG2-CB 3.56Å |
| 247 | V | 90.9 | Very high | 89.5 | Confident | 77 Ų | 77 | 52 Ų | 52 | 47% | 0.467 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -87.8 | -44.3 | -177.7 | 179.8 | 0 | 0 | 0 | 0 | 111.4 | V243 G245 V251 F277 | V243-V247 PolarHBondContact O-N 3.13Å; V243-V247 VanDerWaalsContact O-N 3.16Å; G245-V247 VanDerWaalsContact C-N 3.34Å; G245-V247 PolarHBondContact O-N 3.41Å; V247-V251 VanDerWaalsContact O-CG2 3.29Å; V247-V251 WeakPolarHBondContact O-CG2 3.39Å; V247-F277 HydrophobicContact CG2-CE2 4.34Å |
| 248 | S | 90.4 | Very high | 90.1 | Very high | 28 Ų | 28 | 49.7 Ų | 49.7 | 20% | 0.196 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -80.3 | -29.2 | -169.6 | -43.9 | 0 | 0 | 0 | 0 | 112.4 | S81 M244 V251 L252 | S81-S248 VanDerWaalsContact OG-CB 3.27Å; S81-S248 WeakPolarHBondContact OG-CB 3.48Å; S81-S248 PolarHBondContact OG-O 2.87Å; M244-S248 WeakPolarHBondContact CG-OG 3.49Å; M244-S248 WeakPolarHBondContact O-CA 3.45Å; M244-S248 WeakPolarHBondContact O-CB 3.36Å; M244-S248 PolarHBondContact O-N 3.33Å; M244-S248 PolarHBondContact O-OG 3.36Å; S248-V251 PolarHBondContact O-N 2.94Å; S248-L252 VanDerWaalsContact O-CB 3.3Å; S248-L252 WeakPolarHBondContact O-CB 3.49Å; S248-L252 PolarHBondContact O-N 2.81Å |
| 249 | G | 92.3 | Very high | 90.8 | Very high | 38 Ų | 38 | 52.3 Ų | 52.3 | 39% | 0.392 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -58.7 | -56.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | G245 V251 L252 G253 | G245-G249 PolarHBondContact O-N 3.47Å; G249-V251 VanDerWaalsContact C-N 3.3Å; G249-V251 PolarHBondContact O-N 3.43Å; G249-L252 PolarHBondContact O-N 2.92Å; G249-G253 PolarHBondContact O-N 3.37Å |
| 250 | P | 94.2 | Very high | 91.3 | Very high | 13 Ų | 13 | 59.1 Ų | 59.1 | 8% | 0.084 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -60.8 | -37.8 | 177.9 | -25.1 | 34.9 | 0 | 0 | 0 | 113.1 | V246 G253 V254 G276 F277 | V246-P250 WeakPolarHBondContact O-CD 3.46Å; V246-P250 WeakPolarHBondContact O-CG 2.95Å; P250-G253 PolarHBondContact O-N 3.44Å; P250-V254 PolarHBondContact O-N 2.98Å; P250-V254 VanDerWaalsContact O-N 3.14Å; P250-G276 VanDerWaalsContact CG-C 3.46Å; P250-F277 HydrophobicContact CG-CB 4.32Å |
| 251 | V | 93 | Very high | 91.8 | Very high | 52 Ų | 52 | 59.1 Ų | 59.1 | 32% | 0.315 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -63.2 | -51.1 | 176.6 | 172.1 | 0 | 0 | 0 | 0 | 110.4 | V85 V247 S248 G249 G253 V254 F255 | V85-V251 HydrophobicContact CG1-CG1 3.72Å; V247-V251 VanDerWaalsContact O-CG2 3.29Å; V247-V251 WeakPolarHBondContact O-CG2 3.39Å; S248-V251 PolarHBondContact O-N 2.94Å; G249-V251 VanDerWaalsContact C-N 3.3Å; G249-V251 PolarHBondContact O-N 3.43Å; V251-G253 VanDerWaalsContact C-N 3.28Å; V251-G253 PolarHBondContact O-N 2.95Å; V251-V254 PolarHBondContact O-N 3.11Å; V251-F255 HydrophobicContact CG1-CD2 4.17Å; V251-F255 HydrophobicContact CG1-CE2 4.14Å; V251-F255 WeakPolarHBondContact O-CD2 3.44Å; V251-F255 PolarHBondContact O-N 3.21Å; V251-F255 VanDerWaalsContact O-N 3.12Å |
| 252 | L | 94 | Very high | 91.9 | Very high | 10 Ų | 10 | 60.8 Ų | 60.8 | 5% | 0.052 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -56.5 | -43.2 | 175 | 175.8 | 64.3 | 0 | 0 | 0 | 111.5 | M77 L80 V85 S248 G249 V254 F255 I256 | M77-L252 HydrophobicContact SD-CD2 4.13Å; L80-L252 HydrophobicContact CB-CD2 4.44Å; L80-L252 HydrophobicContact CD2-CD1 4.18Å; L80-L252 HydrophobicContact CD2-CD2 4.28Å; L80-L252 HydrophobicContact CG-CD1 4.02Å; L80-L252 HydrophobicContact CG-CD2 4.38Å; V85-L252 HydrophobicContact CG2-CD1 3.7Å; S248-L252 VanDerWaalsContact O-CB 3.3Å; S248-L252 WeakPolarHBondContact O-CB 3.49Å; S248-L252 PolarHBondContact O-N 2.81Å; G249-L252 PolarHBondContact O-N 2.92Å; L252-V254 VanDerWaalsContact C-N 3.31Å; L252-V254 PolarHBondContact O-N 2.68Å; L252-F255 PolarHBondContact O-N 2.94Å; L252-F255 VanDerWaalsContact O-N 3.17Å; L252-I256 HydrophobicContact CD1-CD1 4.02Å; L252-I256 HydrophobicContact CD1-CG1 4.17Å; L252-I256 HydrophobicContact CD2-CD1 4.42Å; L252-I256 HydrophobicContact CG-CD1 3.87Å; L252-I256 HydrophobicContact CG-CG1 4.41Å; L252-I256 WeakPolarHBondContact O-CG1 3.36Å; L252-I256 PolarHBondContact O-N 3.29Å |
| 253 | G | 94.1 | Very high | 92 | Very high | 36 Ų | 36 | 61.4 Ų | 61.4 | 37% | 0.371 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -55.7 | -43.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113 | G249 P250 V251 I256 L257 | G249-G253 PolarHBondContact O-N 3.37Å; P250-G253 PolarHBondContact O-N 3.44Å; V251-G253 VanDerWaalsContact C-N 3.28Å; V251-G253 PolarHBondContact O-N 2.95Å; G253-I256 PolarHBondContact O-N 2.95Å; G253-L257 VanDerWaalsContact O-CB 3.32Å; G253-L257 WeakPolarHBondContact O-CB 3.27Å; G253-L257 PolarHBondContact O-N 3.5Å |
| 254 | V | 94.4 | Very high | 92.2 | Very high | 30 Ų | 30 | 59.1 Ų | 59.1 | 18% | 0.182 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -73.6 | -32 | 177.5 | 167 | 0 | 0 | 0 | 0 | 113.6 | P250 V251 L252 L257 G258 A269 I273 | P250-V254 PolarHBondContact O-N 2.98Å; P250-V254 VanDerWaalsContact O-N 3.14Å; V251-V254 PolarHBondContact O-N 3.11Å; L252-V254 VanDerWaalsContact C-N 3.31Å; L252-V254 PolarHBondContact O-N 2.68Å; V254-L257 PolarHBondContact O-N 3.22Å; V254-G258 PolarHBondContact O-N 3.49Å; V254-A269 HydrophobicContact CG1-CB 4.08Å; V254-I273 HydrophobicContact CB-CD1 4.07Å; V254-I273 HydrophobicContact CB-CG1 3.92Å; V254-I273 HydrophobicContact CG1-CD1 4.12Å; V254-I273 HydrophobicContact CG1-CG1 4.41Å; V254-I273 HydrophobicContact CG2-CB 4.5Å; V254-I273 HydrophobicContact CG2-CD1 3.9Å; V254-I273 HydrophobicContact CG2-CG1 3.26Å |
| 255 | F | 92.9 | Very high | 92.5 | Very high | 104 Ų | 104 | 62.4 Ų | 62.4 | 46% | 0.456 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -63.3 | -44.8 | 170.8 | -90.1 | -101.1 | 0 | 0 | 0 | 111.5 | V85 V251 L252 G258 M259 | V85-F255 HydrophobicContact CG1-CB 4.46Å; V85-F255 HydrophobicContact CG1-CD1 3.92Å; V85-F255 HydrophobicContact CG1-CD2 3.29Å; V85-F255 HydrophobicContact CG1-CE1 3.89Å; V85-F255 HydrophobicContact CG1-CE2 3.24Å; V85-F255 HydrophobicContact CG1-CG 3.62Å; V85-F255 HydrophobicContact CG1-CZ 3.55Å; V85-F255 HydrophobicContact CG2-CB 4.4Å; V85-F255 HydrophobicContact CG2-CG 4.32Å; V251-F255 HydrophobicContact CG1-CD2 4.17Å; V251-F255 HydrophobicContact CG1-CE2 4.14Å; V251-F255 WeakPolarHBondContact O-CD2 3.44Å; V251-F255 PolarHBondContact O-N 3.21Å; V251-F255 VanDerWaalsContact O-N 3.12Å; L252-F255 PolarHBondContact O-N 2.94Å; L252-F255 VanDerWaalsContact O-N 3.17Å; F255-G258 PolarHBondContact O-N 3.1Å; F255-M259 HydrophobicContact CB-CE 4.18Å; F255-M259 WeakPolarHBondContact O-CB 3.47Å; F255-M259 WeakPolarHBondContact O-CE 3.34Å; F255-M259 WeakPolarHBondContact O-CG 3.35Å; F255-M259 PolarHBondContact O-N 3.41Å |
| 256 | I | 93.6 | Very high | 92.7 | Very high | 62 Ų | 62 | 70.9 Ų | 70.9 | 32% | 0.318 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -61.5 | -47.4 | 175.6 | -67.8 | 172.1 | 0 | 0 | 0 | 110.3 | L252 G253 G258 M259 F260 | L252-I256 HydrophobicContact CD1-CD1 4.02Å; L252-I256 HydrophobicContact CD1-CG1 4.17Å; L252-I256 HydrophobicContact CD2-CD1 4.42Å; L252-I256 HydrophobicContact CG-CD1 3.87Å; L252-I256 HydrophobicContact CG-CG1 4.41Å; L252-I256 WeakPolarHBondContact O-CG1 3.36Å; L252-I256 PolarHBondContact O-N 3.29Å; G253-I256 PolarHBondContact O-N 2.95Å; I256-G258 PolarHBondContact O-N 3.1Å; I256-M259 PolarHBondContact O-N 3.37Å; I256-F260 HydrophobicContact CG2-CD2 3.95Å; I256-F260 WeakPolarHBondContact O-CD2 3.38Å; I256-F260 PolarHBondContact O-N 3.3Å |
| 257 | L | 93.7 | Very high | 92.8 | Very high | 55 Ų | 55 | 76.8 Ų | 76.8 | 29% | 0.288 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -56.9 | -48.4 | 177.5 | -175.2 | 67.6 | 0 | 0 | 0 | 111.3 | G253 V254 M259 V261 T264 | G253-L257 VanDerWaalsContact O-CB 3.32Å; G253-L257 WeakPolarHBondContact O-CB 3.27Å; G253-L257 PolarHBondContact O-N 3.5Å; V254-L257 PolarHBondContact O-N 3.22Å; L257-M259 PolarHBondContact O-N 3.17Å; L257-V261 HydrophobicContact CD1-CB 3.85Å; L257-V261 HydrophobicContact CD1-CG1 4.19Å; L257-V261 HydrophobicContact CD1-CG2 3.84Å; L257-V261 WeakPolarHBondContact O-CA 3.3Å; L257-V261 VanDerWaalsContact O-CB 3.31Å; L257-V261 WeakPolarHBondContact O-CB 3.38Å; L257-V261 PolarHBondContact O-N 3.48Å; L257-T264 HydrophobicContact CD2-CG2 3.73Å; L257-T264 HydrophobicContact CG-CG2 3.7Å; L257-T264 WeakPolarHBondContact CG-OG1 3.36Å; L257-T264 PolarHBondContact O-OG1 3.48Å |
| 258 | G | 92.8 | Very high | 92.9 | Very high | 56 Ų | 56 | 74.4 Ų | 74.4 | 58% | 0.577 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -65.4 | -32.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | V254 F255 I256 | V254-G258 PolarHBondContact O-N 3.49Å; F255-G258 PolarHBondContact O-N 3.1Å; I256-G258 PolarHBondContact O-N 3.1Å |
| 259 | M | 93.2 | Very high | 93.1 | Very high | 125 Ų | 125 | 74 Ų | 74 | 62% | 0.616 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -80.6 | -40.8 | 179.5 | -75.2 | -174.6 | -73.8 | 0 | 0 | 113.2 | F255 I256 L257 | F255-M259 HydrophobicContact CB-CE 4.18Å; F255-M259 WeakPolarHBondContact O-CB 3.47Å; F255-M259 WeakPolarHBondContact O-CE 3.34Å; F255-M259 WeakPolarHBondContact O-CG 3.35Å; F255-M259 PolarHBondContact O-N 3.41Å; I256-M259 PolarHBondContact O-N 3.37Å; L257-M259 PolarHBondContact O-N 3.17Å |
| 260 | F | 94.6 | Very high | 93.3 | Very high | 155 Ų | 155 | 80.4 Ų | 80.4 | 68% | 0.68 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -108.9 | -17.1 | -167.2 | -64.4 | -74.2 | 0 | 0 | 0 | 114.3 | I256 P262 | I256-F260 HydrophobicContact CG2-CD2 3.95Å; I256-F260 WeakPolarHBondContact O-CD2 3.38Å; I256-F260 PolarHBondContact O-N 3.3Å; F260-P262 WeakPolarHBondContact O-CD 3.44Å |
| 261 | V | 94.4 | Very high | 93.3 | Very high | 69 Ų | 69 | 83.1 Ų | 83.1 | 42% | 0.418 | 47% | 0.467 | S | S | . | . | trans | -110.7 | 100.1 | -177.3 | -175.8 | 0 | 0 | 0 | 0 | 110.3 | L257 G263 T264 | L257-V261 HydrophobicContact CD1-CB 3.85Å; L257-V261 HydrophobicContact CD1-CG1 4.19Å; L257-V261 HydrophobicContact CD1-CG2 3.84Å; L257-V261 WeakPolarHBondContact O-CA 3.3Å; L257-V261 VanDerWaalsContact O-CB 3.31Å; L257-V261 WeakPolarHBondContact O-CB 3.38Å; L257-V261 PolarHBondContact O-N 3.48Å; V261-G263 PolarHBondContact O-N 3.02Å; V261-T264 WeakPolarHBondContact CB-OG1 3.33Å; V261-T264 WeakPolarHBondContact O-CB 3.39Å; V261-T264 PolarHBondContact O-N 3.02Å; V261-T264 PolarHBondContact O-OG1 3.34Å | ||
| 262 | P | 88 | Confident | 93.4 | Very high | 139 Ų | 139 | 82.2 Ų | 82.2 | 90% | 0.903 | 47% | 0.468 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.9 | -17.2 | -174.4 | 25 | -33.4 | 0 | 0 | 0 | 114.2 | F260 T264 | F260-P262 WeakPolarHBondContact O-CD 3.44Å; P262-T264 VanDerWaalsContact C-N 3.31Å; P262-T264 PolarHBondContact O-N 2.96Å |
| 263 | G | 88.7 | Confident | 93.4 | Very high | 65 Ų | 65 | 84.9 Ų | 84.9 | 67% | 0.67 | 48% | 0.482 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.1 | 7.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | V261 N265 | V261-G263 PolarHBondContact O-N 3.02Å; G263-N265 PolarHBondContact O-N 3.28Å |
| 264 | T | 92.3 | Very high | 93.5 | Very high | 48 Ų | 48 | 88.6 Ų | 88.6 | 29% | 0.294 | 49% | 0.493 | S | S | . | . | trans | -69.3 | 126.8 | -174.4 | -58.2 | 0 | 0 | 0 | 0 | 111.4 | L257 V261 P262 | L257-T264 HydrophobicContact CD2-CG2 3.73Å; L257-T264 HydrophobicContact CG-CG2 3.7Å; L257-T264 WeakPolarHBondContact CG-OG1 3.36Å; L257-T264 PolarHBondContact O-OG1 3.48Å; V261-T264 WeakPolarHBondContact CB-OG1 3.33Å; V261-T264 WeakPolarHBondContact O-CB 3.39Å; V261-T264 PolarHBondContact O-N 3.02Å; V261-T264 PolarHBondContact O-OG1 3.34Å; P262-T264 VanDerWaalsContact C-N 3.31Å; P262-T264 PolarHBondContact O-N 2.96Å | ||
| 265 | N | 94.3 | Very high | 93.6 | Very high | 99 Ų | 99 | 89.8 Ų | 89.8 | 53% | 0.529 | 51% | 0.506 | S | S | . | . | trans | -108.7 | 161.4 | 175.6 | 69.7 | 53.4 | 0 | 0 | 0 | 111.1 | G263 L267 G268 A269 | G263-N265 PolarHBondContact O-N 3.28Å; N265-L267 VanDerWaalsContact C-N 3.31Å; N265-L267 PolarHBondContact O-N 3.48Å; N265-L267 PolarHBondContact OD1-N 3.25Å; N265-G268 PolarHBondContact O-N 3.13Å; N265-G268 PolarHBondContact OD1-N 3.38Å; N265-A269 PolarHBondContact O-N 3.02Å | ||
| 266 | R | 93.3 | Very high | 93.7 | Very high | 211 Ų | 211 | 86 Ų | 86 | 80% | 0.796 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -60.4 | -39.7 | -176.5 | -60.9 | -179.5 | -172.3 | 171.1 | 1.9 | 112.6 | A269 Y270 | R266-A269 PolarHBondContact O-N 3.28Å; R266-Y270 HydrophobicContact CB-CE2 4.4Å; R266-Y270 WeakPolarHBondContact O-CD2 3.47Å; R266-Y270 PolarHBondContact O-N 3.45Å |
| 267 | L | 94.2 | Very high | 93.8 | Very high | 141 Ų | 141 | 86.9 Ų | 86.9 | 74% | 0.738 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -66.4 | -41 | -179.6 | -69.2 | 172.9 | 0 | 0 | 0 | 111.7 | N265 Y270 S271 | N265-L267 VanDerWaalsContact C-N 3.31Å; N265-L267 PolarHBondContact O-N 3.48Å; N265-L267 PolarHBondContact OD1-N 3.25Å; L267-Y270 PolarHBondContact O-N 3.41Å; L267-S271 WeakPolarHBondContact O-CB 3.15Å; L267-S271 PolarHBondContact O-N 2.65Å; L267-S271 PolarHBondContact O-OG 3.27Å; L267-S271 VanDerWaalsContact O-OG 3.09Å |
| 268 | G | 92.9 | Very high | 93.9 | Very high | 27 Ų | 27 | 87.6 Ų | 87.6 | 28% | 0.278 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -66.8 | -37.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | N265 S271 G272 | N265-G268 PolarHBondContact O-N 3.13Å; N265-G268 PolarHBondContact OD1-N 3.38Å; G268-S271 WeakPolarHBondContact CA-OG 3.49Å; G268-S271 PolarHBondContact O-OG 3.47Å; G268-G272 PolarHBondContact O-N 3Å |
| 269 | A | 94.9 | Very high | 94.1 | Very high | 19 Ų | 19 | 89 Ų | 89 | 16% | 0.157 | 50% | 0.504 | C | S | . | . | H | α-helix | trans | -64.1 | -48.8 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | V254 N265 R266 G272 I273 | V254-A269 HydrophobicContact CG1-CB 4.08Å; N265-A269 PolarHBondContact O-N 3.02Å; R266-A269 PolarHBondContact O-N 3.28Å; A269-G272 PolarHBondContact O-N 2.86Å; A269-I273 WeakPolarHBondContact O-CG1 3.17Å; A269-I273 PolarHBondContact O-N 3.37Å |
| 270 | Y | 94.9 | Very high | 94.1 | Very high | 172 Ų | 172 | 84.6 Ų | 84.6 | 68% | 0.675 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -64.6 | -43.6 | 178.8 | -71.7 | -53.7 | 0 | 0 | 0 | 113 | R266 L267 G272 I273 L274 | R266-Y270 HydrophobicContact CB-CE2 4.4Å; R266-Y270 WeakPolarHBondContact O-CD2 3.47Å; R266-Y270 PolarHBondContact O-N 3.45Å; L267-Y270 PolarHBondContact O-N 3.41Å; Y270-G272 VanDerWaalsContact C-N 3.32Å; Y270-I273 PolarHBondContact O-N 2.92Å; Y270-L274 WeakPolarHBondContact O-CB 3.49Å; Y270-L274 PolarHBondContact O-N 3.46Å |
| 271 | S | 94.8 | Very high | 94.1 | Very high | 71 Ų | 71 | 81 Ų | 81 | 50% | 0.497 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -65.7 | -37.4 | 177.2 | 66 | 0 | 0 | 0 | 0 | 111.6 | L267 G268 L274 A275 | L267-S271 WeakPolarHBondContact O-CB 3.15Å; L267-S271 PolarHBondContact O-N 2.65Å; L267-S271 PolarHBondContact O-OG 3.27Å; L267-S271 VanDerWaalsContact O-OG 3.09Å; G268-S271 WeakPolarHBondContact CA-OG 3.49Å; G268-S271 PolarHBondContact O-OG 3.47Å; S271-L274 PolarHBondContact O-N 2.9Å; S271-A275 WeakPolarHBondContact O-CB 3.34Å; S271-A275 PolarHBondContact O-N 3.3Å |
| 272 | G | 94.8 | Very high | 94.1 | Very high | 33 Ų | 33 | 84.5 Ų | 84.5 | 34% | 0.34 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -62.7 | -46.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | G268 A269 Y270 G276 | G268-G272 PolarHBondContact O-N 3Å; A269-G272 PolarHBondContact O-N 2.86Å; Y270-G272 VanDerWaalsContact C-N 3.32Å; G272-G276 PolarHBondContact O-N 3.3Å |
| 273 | I | 95.1 | Very high | 94.2 | Very high | 65 Ų | 65 | 82.3 Ų | 82.3 | 33% | 0.333 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -60.9 | -48.9 | 174.9 | -66 | 177.7 | 0 | 0 | 0 | 110.3 | V254 A269 Y270 G276 F277 | V254-I273 HydrophobicContact CB-CD1 4.07Å; V254-I273 HydrophobicContact CB-CG1 3.92Å; V254-I273 HydrophobicContact CG1-CD1 4.12Å; V254-I273 HydrophobicContact CG1-CG1 4.41Å; V254-I273 HydrophobicContact CG2-CB 4.5Å; V254-I273 HydrophobicContact CG2-CD1 3.9Å; V254-I273 HydrophobicContact CG2-CG1 3.26Å; A269-I273 WeakPolarHBondContact O-CG1 3.17Å; A269-I273 PolarHBondContact O-N 3.37Å; Y270-I273 PolarHBondContact O-N 2.92Å; I273-G276 PolarHBondContact O-N 3.44Å; I273-F277 VanDerWaalsContact O-CB 3.25Å; I273-F277 WeakPolarHBondContact O-CB 3.44Å; I273-F277 PolarHBondContact O-N 2.92Å |
| 274 | L | 95.9 | Very high | 94.3 | Very high | 114 Ų | 114 | 80 Ų | 80 | 60% | 0.597 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -63.9 | -48.6 | -175.8 | -176.9 | 62.2 | 0 | 0 | 0 | 111.3 | Y270 S271 F277 C278 | Y270-L274 WeakPolarHBondContact O-CB 3.49Å; Y270-L274 PolarHBondContact O-N 3.46Å; S271-L274 PolarHBondContact O-N 2.9Å; L274-F277 PolarHBondContact O-N 3.46Å; L274-C278 WeakPolarHBondContact O-CB 3.4Å; L274-C278 PolarHBondContact O-N 3.16Å; L274-C278 PolarHBondContact O-SG 3.17Å |
| 275 | A | 95.9 | Very high | 94.2 | Very high | 56 Ų | 56 | 80.9 Ų | 80.9 | 46% | 0.463 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -61.9 | -46.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | S271 F277 C278 V279 | S271-A275 WeakPolarHBondContact O-CB 3.34Å; S271-A275 PolarHBondContact O-N 3.3Å; A275-F277 VanDerWaalsContact C-N 3.33Å; A275-F277 PolarHBondContact O-N 3.32Å; A275-C278 PolarHBondContact O-N 2.96Å; A275-V279 WeakPolarHBondContact O-CG2 3.46Å; A275-V279 PolarHBondContact O-N 3.14Å |
| 276 | G | 95.8 | Very high | 93.9 | Very high | 24 Ų | 24 | 77.4 Ų | 77.4 | 25% | 0.247 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -60.5 | -41.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | P250 G272 I273 S280 | P250-G276 VanDerWaalsContact CG-C 3.46Å; G272-G276 PolarHBondContact O-N 3.3Å; I273-G276 PolarHBondContact O-N 3.44Å; G276-S280 VanDerWaalsContact O-CB 3.28Å; G276-S280 WeakPolarHBondContact O-CB 3.43Å; G276-S280 PolarHBondContact O-N 2.87Å; G276-S280 PolarHBondContact O-OG 3.3Å |
| 277 | F | 95.6 | Very high | 93.5 | Very high | 81 Ų | 81 | 70.3 Ų | 70.3 | 36% | 0.355 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -65.6 | -45.9 | 175.9 | -177.5 | -98.7 | 0 | 0 | 0 | 111.7 | V246 V247 P250 I273 L274 A275 V279 S280 L281 | V246-F277 HydrophobicContact CG1-CD2 4.25Å; V246-F277 HydrophobicContact CG1-CE2 3.96Å; V247-F277 HydrophobicContact CG2-CE2 4.34Å; P250-F277 HydrophobicContact CG-CB 4.32Å; I273-F277 VanDerWaalsContact O-CB 3.25Å; I273-F277 WeakPolarHBondContact O-CB 3.44Å; I273-F277 PolarHBondContact O-N 2.92Å; L274-F277 PolarHBondContact O-N 3.46Å; A275-F277 VanDerWaalsContact C-N 3.33Å; A275-F277 PolarHBondContact O-N 3.32Å; F277-V279 PolarHBondContact O-N 3.31Å; F277-S280 PolarHBondContact O-N 3.09Å; F277-L281 HydrophobicContact CE1-CD2 4.13Å; F277-L281 WeakPolarHBondContact O-CB 3.45Å; F277-L281 PolarHBondContact O-N 3.24Å |
| 278 | C | 96.5 | Very high | 92.9 | Very high | 69 Ų | 69 | 66.4 Ų | 66.4 | 47% | 0.466 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -60.7 | -45.4 | 177.4 | -72.7 | 0 | 0 | 0 | 0 | 112.3 | L274 A275 L281 W282 | L274-C278 WeakPolarHBondContact O-CB 3.4Å; L274-C278 PolarHBondContact O-N 3.16Å; L274-C278 PolarHBondContact O-SG 3.17Å; A275-C278 PolarHBondContact O-N 2.96Å; C278-L281 PolarHBondContact O-N 3.49Å; C278-W282 VanDerWaalsContact O-CB 3.31Å; C278-W282 WeakPolarHBondContact O-CB 3.18Å; C278-W282 PolarHBondContact O-N 3.35Å |
| 279 | V | 95.5 | Very high | 92.6 | Very high | 87 Ų | 87 | 70.8 Ų | 70.8 | 53% | 0.527 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -64.3 | -45.4 | 177.2 | 172.1 | 0 | 0 | 0 | 0 | 110.7 | A275 F277 L281 W282 L283 | A275-V279 WeakPolarHBondContact O-CG2 3.46Å; A275-V279 PolarHBondContact O-N 3.14Å; F277-V279 PolarHBondContact O-N 3.31Å; V279-L281 VanDerWaalsContact C-N 3.34Å; V279-L281 PolarHBondContact O-N 3.36Å; V279-W282 WeakPolarHBondContact O-CB 3.41Å; V279-W282 PolarHBondContact O-N 3.27Å; V279-L283 HydrophobicContact CG1-CD1 4.14Å; V279-L283 WeakPolarHBondContact O-CG 3.4Å; V279-L283 PolarHBondContact O-N 2.77Å |
| 280 | S | 94.3 | Very high | 92.2 | Very high | 32 Ų | 32 | 77 Ų | 77 | 22% | 0.224 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -64.7 | -40.3 | 179.6 | -55.2 | 0 | 0 | 0 | 0 | 111.8 | G276 F277 L283 A284 | G276-S280 VanDerWaalsContact O-CB 3.28Å; G276-S280 WeakPolarHBondContact O-CB 3.43Å; G276-S280 PolarHBondContact O-N 2.87Å; G276-S280 PolarHBondContact O-OG 3.3Å; F277-S280 PolarHBondContact O-N 3.09Å; S280-L283 PolarHBondContact O-N 3.26Å; S280-A284 WeakPolarHBondContact O-CB 3.36Å; S280-A284 PolarHBondContact O-N 3.19Å |
| 281 | L | 93.9 | Very high | 91.5 | Very high | 79 Ų | 79 | 73 Ų | 73 | 41% | 0.414 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -65.3 | -43.2 | 175.7 | -176.9 | 64.5 | 0 | 0 | 0 | 111.3 | V246 F277 C278 V279 L283 A284 V285 | V246-L281 HydrophobicContact CG1-CB 4.39Å; F277-L281 HydrophobicContact CE1-CD2 4.13Å; F277-L281 WeakPolarHBondContact O-CB 3.45Å; F277-L281 PolarHBondContact O-N 3.24Å; C278-L281 PolarHBondContact O-N 3.49Å; V279-L281 VanDerWaalsContact C-N 3.34Å; V279-L281 PolarHBondContact O-N 3.36Å; L281-L283 PolarHBondContact O-N 2.97Å; L281-A284 PolarHBondContact O-N 3.16Å; L281-V285 HydrophobicContact CD1-CG2 4.17Å; L281-V285 HydrophobicContact CG-CG2 4.41Å; L281-V285 WeakPolarHBondContact O-CB 3.44Å; L281-V285 VanDerWaalsContact O-CG2 3.31Å; L281-V285 WeakPolarHBondContact O-CG2 3.46Å; L281-V285 PolarHBondContact O-N 3.47Å |
| 282 | W | 94.1 | Very high | 90.8 | Very high | 143 Ų | 143 | 71.6 Ų | 71.6 | 54% | 0.542 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -58 | -47.5 | 174.9 | 175.1 | -96.6 | 0 | 0 | 0 | 111.5 | C278 V279 G286 F341 I345 | C278-W282 VanDerWaalsContact O-CB 3.31Å; C278-W282 WeakPolarHBondContact O-CB 3.18Å; C278-W282 PolarHBondContact O-N 3.35Å; V279-W282 WeakPolarHBondContact O-CB 3.41Å; V279-W282 PolarHBondContact O-N 3.27Å; W282-G286 PolarHBondContact O-N 3.38Å; W282-F341 HydrophobicContact CH2-CZ 4.32Å; W282-F341 HydrophobicContact CZ2-CZ 4.28Å; W282-I345 HydrophobicContact CZ2-CD1 4.08Å; W282-I345 HydrophobicContact CZ2-CG1 4.47Å |
| 283 | L | 91.4 | Very high | 90.2 | Very high | 93 Ų | 93 | 73 Ų | 73 | 49% | 0.487 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -63.6 | -43.6 | 177.2 | -71 | 173.3 | 0 | 0 | 0 | 112.1 | V279 S280 L281 G286 S287 | V279-L283 HydrophobicContact CG1-CD1 4.14Å; V279-L283 WeakPolarHBondContact O-CG 3.4Å; V279-L283 PolarHBondContact O-N 2.77Å; S280-L283 PolarHBondContact O-N 3.26Å; L281-L283 PolarHBondContact O-N 2.97Å; L283-G286 PolarHBondContact O-N 3.17Å; L283-S287 WeakPolarHBondContact O-CB 3.48Å; L283-S287 PolarHBondContact O-N 3.44Å; L283-S287 PolarHBondContact O-OG 3.19Å |
| 284 | A | 89.8 | Confident | 89.5 | Confident | 16 Ų | 16 | 76.8 Ų | 76.8 | 13% | 0.132 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -61.4 | -51.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | T242 V246 S280 L281 G286 S287 T288 | T242-A284 HydrophobicContact CG2-CB 3.85Å; V246-A284 HydrophobicContact CG2-CB 3.56Å; S280-A284 WeakPolarHBondContact O-CB 3.36Å; S280-A284 PolarHBondContact O-N 3.19Å; L281-A284 PolarHBondContact O-N 3.16Å; A284-G286 PolarHBondContact O-N 3.16Å; A284-S287 PolarHBondContact O-N 2.84Å; A284-S287 PolarHBondContact O-OG 3.48Å; A284-T288 WeakPolarHBondContact O-CG2 3.09Å; A284-T288 PolarHBondContact O-N 2.69Å; A284-T288 VanDerWaalsContact O-N 3.13Å; A284-T288 PolarHBondContact O-OG1 3.16Å |
| 285 | V | 89.8 | Confident | 88.6 | Confident | 66 Ų | 66 | 79.8 Ų | 79.8 | 40% | 0.4 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -62 | -44.6 | 177.8 | 174.4 | 0 | 0 | 0 | 0 | 110.8 | L281 S287 T288 L289 | L281-V285 HydrophobicContact CD1-CG2 4.17Å; L281-V285 HydrophobicContact CG-CG2 4.41Å; L281-V285 WeakPolarHBondContact O-CB 3.44Å; L281-V285 VanDerWaalsContact O-CG2 3.31Å; L281-V285 WeakPolarHBondContact O-CG2 3.46Å; L281-V285 PolarHBondContact O-N 3.47Å; V285-S287 PolarHBondContact O-N 3.27Å; V285-T288 WeakPolarHBondContact CA-OG1 3.43Å; V285-T288 PolarHBondContact O-N 2.94Å; V285-T288 VanDerWaalsContact O-N 3.09Å; V285-T288 PolarHBondContact O-OG1 2.96Å; V285-L289 HydrophobicContact CG1-CD1 3.66Å; V285-L289 HydrophobicContact CG1-CG 4.13Å; V285-L289 WeakPolarHBondContact O-CG 3.24Å; V285-L289 PolarHBondContact O-N 3.44Å |
| 286 | G | 88.4 | Confident | 87.8 | Confident | 27 Ų | 27 | 79 Ų | 79 | 28% | 0.278 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -57.3 | -45.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | W282 L283 A284 T288 L289 H290 | W282-G286 PolarHBondContact O-N 3.38Å; L283-G286 PolarHBondContact O-N 3.17Å; A284-G286 PolarHBondContact O-N 3.16Å; G286-T288 PolarHBondContact O-N 3.14Å; G286-L289 PolarHBondContact O-N 3.3Å; G286-H290 PolarHBondContact O-N 3.07Å |
| 287 | S | 84.9 | Confident | 86.9 | Confident | 62 Ų | 62 | 80.1 Ų | 80.1 | 43% | 0.434 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -64.1 | -28.6 | 177.1 | 75.2 | 0 | 0 | 0 | 0 | 113.3 | L283 A284 V285 P291 | L283-S287 WeakPolarHBondContact O-CB 3.48Å; L283-S287 PolarHBondContact O-N 3.44Å; L283-S287 PolarHBondContact O-OG 3.19Å; A284-S287 PolarHBondContact O-N 2.84Å; A284-S287 PolarHBondContact O-OG 3.48Å; V285-S287 PolarHBondContact O-N 3.27Å; S287-P291 WeakPolarHBondContact O-CA 3.49Å |
| 288 | T | 82.5 | Confident | 85.9 | Confident | 58 Ų | 58 | 78.6 Ų | 78.6 | 36% | 0.356 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -83.1 | -34.2 | 178 | 58.6 | 0 | 0 | 0 | 0 | 113.4 | W234 A284 V285 G286 | W234-T288 HydrophobicContact CE3-CG2 3.9Å; W234-T288 HydrophobicContact CH2-CG2 3.91Å; W234-T288 HydrophobicContact CZ3-CG2 3.23Å; A284-T288 WeakPolarHBondContact O-CG2 3.09Å; A284-T288 PolarHBondContact O-N 2.69Å; A284-T288 VanDerWaalsContact O-N 3.13Å; A284-T288 PolarHBondContact O-OG1 3.16Å; V285-T288 WeakPolarHBondContact CA-OG1 3.43Å; V285-T288 PolarHBondContact O-N 2.94Å; V285-T288 VanDerWaalsContact O-N 3.09Å; V285-T288 PolarHBondContact O-OG1 2.96Å; G286-T288 PolarHBondContact O-N 3.14Å |
| 289 | L | 85.9 | Confident | 85.1 | Confident | 120 Ų | 120 | 79.4 Ų | 79.4 | 63% | 0.628 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -79.1 | -32.9 | 178.6 | -68.7 | 176.3 | 0 | 0 | 0 | 112 | V285 G286 P291 | V285-L289 HydrophobicContact CG1-CD1 3.66Å; V285-L289 HydrophobicContact CG1-CG 4.13Å; V285-L289 WeakPolarHBondContact O-CG 3.24Å; V285-L289 PolarHBondContact O-N 3.44Å; G286-L289 PolarHBondContact O-N 3.3Å; L289-P291 VanDerWaalsContact C-CD 3.48Å; L289-P291 WeakPolarHBondContact O-CD 3.49Å |
| 290 | H | 85.7 | Confident | 84.4 | Confident | 150 Ų | 150 | 78 Ų | 78 | 69% | 0.694 | 44% | 0.436 | S | S | * | . | S | Bend | trans | -125.9 | 70.5 | -179.8 | -56.7 | 91.2 | 0 | 0 | 0 | 109.9 | G286 | G286-H290 PolarHBondContact O-N 3.07Š|
| 291 | P | 81.1 | Confident | 83.7 | Confident | 88 Ų | 88 | 80.5 Ų | 80.5 | 57% | 0.571 | 45% | 0.452 | S | S | * | . | P | Polyproline II helix | trans | -63.2 | 140.4 | 179.3 | 26.6 | -33.7 | 0 | 0 | 0 | 110.5 | S287 L289 | S287-P291 WeakPolarHBondContact O-CA 3.49Å; L289-P291 VanDerWaalsContact C-CD 3.48Å; L289-P291 WeakPolarHBondContact O-CD 3.49Å |
| 292 | P | 80.9 | Confident | 83 | Confident | 40 Ų | 40 | 78.2 Ų | 78.2 | 26% | 0.26 | 44% | 0.442 | S | S | . | . | P | Polyproline II helix | trans | -61.6 | 157.1 | 171 | -11.2 | 23.9 | 0 | 0 | 0 | 110.7 | R63 T296 M297 | R63-P292 HydrophobicContact CB-CB 4.26Å; R63-P292 HydrophobicContact CB-CG 4.05Å; P292-T296 HydrophobicContact CB-CG2 3.99Å; P292-M297 HydrophobicContact CB-CG 3.94Å; P292-M297 HydrophobicContact CG-CG 4.13Å; P292-M297 WeakPolarHBondContact O-CE 3.34Å |
| 293 | S | 81.7 | Confident | 82.5 | Confident | 63 Ų | 63 | 76.3 Ų | 76.3 | 44% | 0.441 | 44% | 0.438 | S | S | . | . | P | Polyproline II helix | trans | -61.3 | 154.8 | 174.2 | 66.3 | 0 | 0 | 0 | 0 | 111.3 | E295 T296 M297 | S293-E295 PolarHBondContact O-N 2.96Å; S293-T296 WeakPolarHBondContact O-CA 3.32Å; S293-T296 WeakPolarHBondContact O-CB 3.08Å; S293-T296 PolarHBondContact O-N 3.28Å; S293-T296 PolarHBondContact OG-N 2.98Å; S293-T296 PolarHBondContact OG-OG1 3.28Å; S293-M297 PolarHBondContact O-N 3.21Å |
| 294 | E | 80.9 | Confident | 82 | Confident | 144 Ų | 144 | 73.9 Ų | 73.9 | 67% | 0.673 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -54.4 | -36.4 | 177.1 | -67.1 | -170.3 | 161.8 | 0 | 0 | 112.6 | M297 G298 V299 | E294-M297 HydrophobicContact CG-CE 4.36Å; E294-M297 PolarHBondContact O-N 3.01Å; E294-G298 PolarHBondContact O-N 2.61Å; E294-G298 VanDerWaalsContact O-N 3.16Å; E294-V299 HydrophobicContact CB-CB 4.19Å; E294-V299 HydrophobicContact CB-CG2 4.24Å; E294-V299 PolarHBondContact O-N 2.88Å |
| 295 | E | 77.1 | Confident | 81.4 | Confident | 178 Ų | 178 | 79.5 Ų | 79.5 | 83% | 0.832 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -64.8 | -44.3 | 174.5 | -170.5 | 177.7 | -170.8 | 0 | 0 | 111.9 | S293 M297 G298 | S293-E295 PolarHBondContact O-N 2.96Å; E295-M297 VanDerWaalsContact C-N 3.32Å; E295-M297 PolarHBondContact O-N 2.94Å; E295-G298 PolarHBondContact O-N 2.97Å; E295-G298 VanDerWaalsContact O-N 3.13Å |
| 296 | T | 78.8 | Confident | 80.7 | Confident | 38 Ų | 38 | 78.5 Ų | 78.5 | 23% | 0.233 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -67.2 | -34.7 | 177.1 | -51.3 | 0 | 0 | 0 | 0 | 111.5 | R63 K64 P292 S293 G298 | R63-T296 HydrophobicContact CB-CG2 3.79Å; K64-T296 WeakPolarHBondContact CG-O 3.36Å; P292-T296 HydrophobicContact CB-CG2 3.99Å; S293-T296 WeakPolarHBondContact O-CA 3.32Å; S293-T296 WeakPolarHBondContact O-CB 3.08Å; S293-T296 PolarHBondContact O-N 3.28Å; S293-T296 PolarHBondContact OG-N 2.98Å; S293-T296 PolarHBondContact OG-OG1 3.28Å; T296-G298 PolarHBondContact O-N 2.85Å |
| 297 | M | 76.3 | Confident | 80.4 | Confident | 49 Ų | 49 | 77.9 Ų | 77.9 | 24% | 0.241 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -72.5 | -13.7 | 175.6 | -71.8 | -168 | -70.9 | 0 | 0 | 113.2 | P292 S293 E294 E295 V299 | P292-M297 HydrophobicContact CB-CG 3.94Å; P292-M297 HydrophobicContact CG-CG 4.13Å; P292-M297 WeakPolarHBondContact O-CE 3.34Å; S293-M297 PolarHBondContact O-N 3.21Å; E294-M297 HydrophobicContact CG-CE 4.36Å; E294-M297 PolarHBondContact O-N 3.01Å; E295-M297 VanDerWaalsContact C-N 3.32Å; E295-M297 PolarHBondContact O-N 2.94Å; M297-V299 HydrophobicContact CB-CG2 4.02Å; M297-V299 HydrophobicContact CE-CG2 4.33Å |
| 298 | G | 74.1 | Confident | 79.7 | Confident | 48 Ų | 48 | 79.8 Ų | 79.8 | 50% | 0.495 | 46% | 0.463 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 73.1 | 32 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113 | E294 E295 T296 L300 | E294-G298 PolarHBondContact O-N 2.61Å; E294-G298 VanDerWaalsContact O-N 3.16Å; E295-G298 PolarHBondContact O-N 2.97Å; E295-G298 VanDerWaalsContact O-N 3.13Å; T296-G298 PolarHBondContact O-N 2.85Å; G298-L300 PolarHBondContact O-N 3.23Å |
| 299 | V | 80.5 | Confident | 78.8 | Confident | 86 Ų | 86 | 83.2 Ų | 83.2 | 52% | 0.521 | 47% | 0.473 | S | S | . | . | trans | -69 | 115.9 | 176.9 | -177.9 | 0 | 0 | 0 | 0 | 109 | E294 M297 | E294-V299 HydrophobicContact CB-CB 4.19Å; E294-V299 HydrophobicContact CB-CG2 4.24Å; E294-V299 PolarHBondContact O-N 2.88Å; M297-V299 HydrophobicContact CB-CG2 4.02Å; M297-V299 HydrophobicContact CE-CG2 4.33Å | ||
| 300 | L | 81 | Confident | 77.1 | Confident | 59 Ų | 59 | 82.4 Ų | 82.4 | 31% | 0.309 | 48% | 0.484 | S | S | . | . | trans | -79.2 | 141.4 | 179.3 | -71.2 | 168.4 | 0 | 0 | 0 | 111.1 | S51 R52 G298 | S51-L300 WeakPolarHBondContact O-CD1 3.3Å; R52-L300 HydrophobicContact CG-CD1 4.47Å; R52-L300 PolarHBondContact NH2-O 3Å; R52-L300 VanDerWaalsContact NH2-O 3.11Å; G298-L300 PolarHBondContact O-N 3.23Å | ||
| 301 | P | 79 | Confident | 75.2 | Confident | 84 Ų | 84 | 83.1 Ų | 83.1 | 55% | 0.545 | 49% | 0.492 | S | S | . | . | trans | -63.5 | 154.4 | -176.3 | 26.9 | -34.6 | 0 | 0 | 0 | 112.4 | R52 F303 | R52-P301 PolarHBondContact NH2-O 2.94Å; P301-F303 HydrophobicContact CB-CZ 4.19Å; P301-F303 HydrophobicContact CG-CZ 4.3Å | ||
| 302 | S | 79.6 | Confident | 73.4 | Confident | 30 Ų | 30 | 81.7 Ų | 81.7 | 21% | 0.21 | 49% | 0.493 | C | S | . | . | trans | -135.8 | 146 | 171 | 66.9 | 0 | 0 | 0 | 0 | 109.4 | D135 K138 | D135-S302 WeakPolarHBondContact OD2-CB 3.01Å; D135-S302 PolarHBondContact OD2-OG 2.82Å; K138-S302 WeakPolarHBondContact CD-OG 3.28Å; K138-S302 WeakPolarHBondContact CE-OG 3.33Å; K138-S302 PolarHBondContact NZ-O 2.96Å; K138-S302 PolarHBondContact NZ-OG 3.45Å | ||
| 303 | F | 82.8 | Confident | 71.3 | Confident | 104 Ų | 104 | 86 Ų | 86 | 46% | 0.456 | 52% | 0.52 | S | S | . | . | trans | -116.1 | 155.3 | -168.4 | -55 | -82 | 0 | 0 | 0 | 111.9 | L133 D135 P301 | L133-F303 CarbonylContact C-O 3.5Å; D135-F303 WeakPolarHBondContact CB-O 3.5Å; D135-F303 PolarHBondContact N-O 3.47Å; P301-F303 HydrophobicContact CB-CZ 4.19Å; P301-F303 HydrophobicContact CG-CZ 4.3Å | ||
| 304 | T | 81.1 | Confident | 69.2 | Low | 41 Ų | 41 | 92.2 Ų | 92.2 | 25% | 0.252 | 54% | 0.539 | S | S | . | . | trans | -124.3 | 8.4 | 176.5 | 50.8 | 0 | 0 | 0 | 0 | 112.9 | L133 K138 G306 C307 | L133-T304 CarbonylContact O-C 3.51Å; L133-T304 VanDerWaalsContact O-C 3.3Å; L133-T304 WeakPolarHBondContact O-CA 3.2Å; K138-T304 HydrophobicContact CB-CG2 3.42Å; K138-T304 VanDerWaalsContact CB-CG2 3.42Å; K138-T304 HydrophobicContact CD-CG2 4.29Å; T304-G306 PolarHBondContact O-N 2.04Å; T304-C307 WeakPolarHBondContact O-CB 3.46Å; T304-C307 PolarHBondContact O-N 3.33Å | ||
| 305 | D | 77.6 | Confident | 67 | Low | 134 Ų | 134 | 92 Ų | 92 | 72% | 0.717 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.1 | -25.9 | -170.9 | -55.4 | -29.3 | 0 | 0 | 0 | 112.5 | L133 | L133-D305 PolarHBondContact O-N 3.08Š|
| 306 | G | 75.4 | Confident | 65.1 | Low | 46 Ų | 46 | 91.2 Ų | 91.2 | 47% | 0.474 | 54% | 0.544 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94 | 5.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | L133 T304 S308 | L133-G306 WeakPolarHBondContact O-CA 3.39Å; L133-G306 PolarHBondContact O-N 3.4Å; T304-G306 PolarHBondContact O-N 2.04Å; G306-S308 PolarHBondContact O-N 2.76Å |
| 307 | C | 81.3 | Confident | 62.8 | Low | 13 Ų | 13 | 94 Ų | 94 | 9% | 0.088 | 57% | 0.565 | C | S | . | * | trans | -78.3 | 121.3 | -178.7 | -69.8 | 0 | 0 | 0 | 0 | 112.4 | C134 S139 T304 F309 | C134-C307 WeakPolarHBondContact CA-SG 3.37Å; C134-C307 HydrophobicContact CB-CB 4.06Å; C134-C307 WeakPolarHBondContact CB-SG 3.36Å; C134-C307 WeakPolarHBondContact SG-CA 3.45Å; C134-C307 WeakPolarHBondContact SG-CB 3.46Å; C134-C307 CovalentContact SG-SG 2.04Å; C134-C307 PolarHBondContact SG-SG 3.34Å; S139-C307 VanDerWaalsContact CB-SG 3.58Å; T304-C307 WeakPolarHBondContact O-CB 3.46Å; T304-C307 PolarHBondContact O-N 3.33Å; C307-F309 HydrophobicContact CB-CE2 4.15Å; C307-F309 HydrophobicContact CB-CZ 4.16Å; C307-F309 VanDerWaalsContact O-CD2 3.32Å; C307-F309 WeakPolarHBondContact O-CD2 3.4Å; C307-F309 PolarHBondContact O-N 2.99Å | ||
| 308 | S | 70.7 | Confident | 60.9 | Low | 103 Ų | 103 | 97 Ų | 97 | 72% | 0.72 | 59% | 0.59 | S | S | * | * | trans | -69.7 | 98.3 | 163.8 | -55.7 | 0 | 0 | 0 | 0 | 109.5 | G306 A310 | G306-S308 PolarHBondContact O-N 2.76Å; S308-A310 PolarHBondContact O-N 3.32Å | ||
| 309 | F | 63.3 | Low | 58.6 | Low | 130 Ų | 130 | 102.5 Ų | 102.5 | 57% | 0.57 | 61% | 0.608 | S | S | * | * | trans | -71.8 | 123.6 | 171.2 | -64.4 | -81.5 | 0 | 0 | 0 | 109.3 | C307 N311 | C307-F309 HydrophobicContact CB-CE2 4.15Å; C307-F309 HydrophobicContact CB-CZ 4.16Å; C307-F309 VanDerWaalsContact O-CD2 3.32Å; C307-F309 WeakPolarHBondContact O-CD2 3.4Å; C307-F309 PolarHBondContact O-N 2.99Å; F309-N311 PolarHBondContact O-N 2.9Å | ||
| 310 | A | 51.1 | Low | 56.3 | Low | 103 Ų | 103 | 105.6 Ų | 105.6 | 85% | 0.851 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.9 | 7.5 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | S308 | S308-A310 PolarHBondContact O-N 3.32Š|
| 311 | N | 44.8 | Very low | 53.7 | Low | 164 Ų | 164 | 109.7 Ų | 109.7 | 88% | 0.877 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -139.5 | 49.5 | 177.5 | -89 | -17.4 | 0 | 0 | 0 | 112.3 | F309 | F309-N311 PolarHBondContact O-N 2.9Š|
| 312 | G | 43 | Very low | 51.2 | Low | 58 Ų | 58 | 114.2 Ų | 114.2 | 60% | 0.598 | 66% | 0.657 | S | S | * | * | trans | -102.3 | 89.8 | 164.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | K314 | G312-K314 PolarHBondContact O-N 3.44Š| ||
| 313 | T | 37 | Very low | 48.9 | Very low | 132 Ų | 132 | 119.1 Ų | 119.1 | 81% | 0.81 | 69% | 0.686 | S | S | * | * | trans | -59 | 108.5 | 161.8 | -39.3 | 0 | 0 | 0 | 0 | 106.5 | N315 | T313-N315 PolarHBondContact O-N 3.08Š| ||
| 314 | K | 38.7 | Very low | 46.1 | Very low | 193 Ų | 193 | 119 Ų | 119 | 84% | 0.839 | 70% | 0.698 | S | S | * | * | trans | -64.4 | 87 | 171.6 | -80.6 | -176 | 175.9 | -179.8 | 0 | 108.3 | G312 N316 | G312-K314 PolarHBondContact O-N 3.44Å; K314-N316 PolarHBondContact O-N 3.39Å; K314-N316 VanDerWaalsContact O-N 3.17Å | ||
| 315 | N | 33.6 | Very low | 43.5 | Very low | 138 Ų | 138 | 123.9 Ų | 123.9 | 74% | 0.738 | 72% | 0.721 | S | S | * | * | trans | -74.7 | 100.6 | 159.1 | -94.6 | 3 | 0 | 0 | 0 | 107 | T313 S317 | T313-N315 PolarHBondContact O-N 3.08Å; N315-S317 VanDerWaalsContact C-N 3.29Å; N315-S317 PolarHBondContact O-N 3.45Å | ||
| 316 | N | 37.2 | Very low | 41 | Very low | 163 Ų | 163 | 125.3 Ų | 125.3 | 87% | 0.872 | 73% | 0.727 | S | S | * | * | trans | -60.9 | 96.1 | 160.5 | -90.9 | -4.4 | 0 | 0 | 0 | 108.2 | K314 | K314-N316 PolarHBondContact O-N 3.39Å; K314-N316 VanDerWaalsContact O-N 3.17Å | ||
| 317 | S | 30.8 | Very low | 38.6 | Very low | 97 Ų | 97 | 127.8 Ų | 127.8 | 68% | 0.678 | 73% | 0.734 | S | S | * | * | trans | -136.6 | 104.6 | 154.1 | 27.3 | 0 | 0 | 0 | 0 | 107.9 | N315 N319 | N315-S317 VanDerWaalsContact C-N 3.29Å; N315-S317 PolarHBondContact O-N 3.45Å; S317-N319 PolarHBondContact O-N 3.09Å | ||
| 318 | S | 35.7 | Very low | 36.1 | Very low | 110 Ų | 110 | 133.1 Ų | 133.1 | 77% | 0.769 | 77% | 0.768 | S | S | * | * | trans | -44.1 | 119.5 | 159.5 | 47 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 319 | N | 26.2 | Very low | 33.8 | Very low | 164 Ų | 164 | 137.8 Ų | 137.8 | 88% | 0.877 | 78% | 0.776 | S | S | * | * | trans | -161.3 | 132.7 | 141 | -92.9 | -28.1 | 0 | 0 | 0 | 109.6 | S317 | S317-N319 PolarHBondContact O-N 3.09Š| ||
| 320 | L | 31.5 | Very low | 32.2 | Very low | 152 Ų | 152 | 139.8 Ų | 139.8 | 80% | 0.796 | 79% | 0.786 | S | S | * | * | trans | -65.3 | 156.9 | 170.3 | -75.4 | 113.8 | 0 | 0 | 0 | 110.8 | ||||
| 321 | D | 28.2 | Very low | 31.2 | Very low | 144 Ų | 144 | 140.7 Ų | 140.7 | 77% | 0.77 | 78% | 0.784 | S | S | * | * | trans | 75.8 | 106 | 160.3 | -52.9 | -32.2 | 0 | 0 | 0 | 118.6 | ||||
| 322 | E | 25.3 | Very low | 30.6 | Very low | 180 Ų | 180 | 141.8 Ų | 141.8 | 84% | 0.841 | 78% | 0.781 | S | S | * | * | -176.2 | 117.1 | 108.7 | -105.9 | -178.1 | 161.1 | 0 | 0 | 111.6 | S324 | E322-S324 PolarHBondContact O-N 3.45Š| |||
| 323 | V | 31.5 | Very low | 30.1 | Very low | 133 Ų | 133 | 148.4 Ų | 148.4 | 81% | 0.806 | 80% | 0.796 | S | S | * | * | trans | -68 | 109.4 | 167.6 | 170.3 | 0 | 0 | 0 | 0 | 108.4 | I325 | V323-I325 HydrophobicContact CG1-CD1 4.44Å; V323-I325 HydrophobicContact CG1-CG1 4.03Å | ||
| 324 | S | 23.8 | Very low | 29.8 | Very low | 101 Ų | 101 | 151.4 Ų | 151.4 | 71% | 0.706 | 80% | 0.801 | S | S | * | * | trans | -105.6 | 94.8 | 170.5 | -66.7 | 0 | 0 | 0 | 0 | 110.1 | E322 L326 | E322-S324 PolarHBondContact O-N 3.45Å; S324-L326 PolarHBondContact O-N 3.21Å | ||
| 325 | I | 26.6 | Very low | 29.4 | Very low | 143 Ų | 143 | 144.1 Ų | 144.1 | 73% | 0.733 | 78% | 0.78 | S | S | * | * | trans | -67.4 | 108.2 | 166.1 | -64.6 | 165.7 | 0 | 0 | 0 | 107.2 | V323 T327 | V323-I325 HydrophobicContact CG1-CD1 4.44Å; V323-I325 HydrophobicContact CG1-CG1 4.03Å; I325-T327 HydrophobicContact CG2-CG2 4.47Å; I325-T327 PolarHBondContact O-N 3Å | ||
| 326 | L | 24.8 | Very low | 29.3 | Very low | 164 Ų | 164 | 145.4 Ų | 145.4 | 86% | 0.859 | 79% | 0.786 | S | S | * | * | trans | -92.1 | 93.4 | 173.4 | -132.2 | 137.2 | 0 | 0 | 0 | 108.6 | S324 | S324-L326 PolarHBondContact O-N 3.21Š| ||
| 327 | T | 25.4 | Very low | 29 | Very low | 99 Ų | 99 | 141.3 Ų | 141.3 | 61% | 0.607 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -59 | 134.9 | 165.7 | 43.7 | 0 | 0 | 0 | 0 | 110.6 | I325 F329 | I325-T327 HydrophobicContact CG2-CG2 4.47Å; I325-T327 PolarHBondContact O-N 3Å; T327-F329 PolarHBondContact O-N 3.45Å |
| 328 | P | 28.1 | Very low | 29.1 | Very low | 125 Ų | 125 | 141.3 Ų | 141.3 | 81% | 0.812 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -74 | 126.3 | 170.4 | -7.7 | 23.8 | 0 | 0 | 0 | 110.2 | H330 | P328-H330 PolarHBondContact O-N 3.45Š|
| 329 | F | 24.2 | Very low | 29.1 | Very low | 200 Ų | 200 | 139.7 Ų | 139.7 | 88% | 0.877 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 118.8 | 172.8 | -109.5 | -100.6 | 0 | 0 | 0 | 110.8 | T327 | T327-F329 PolarHBondContact O-N 3.45Š|
| 330 | H | 28.4 | Very low | 29.2 | Very low | 172 Ų | 172 | 134.4 Ų | 134.4 | 80% | 0.796 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 134 | 163 | -110.9 | -65.2 | 0 | 0 | 0 | 110.2 | P328 | P328-H330 PolarHBondContact O-N 3.45Š|
| 331 | P | 30.6 | Very low | 29.2 | Very low | 123 Ų | 123 | 133 Ų | 133 | 80% | 0.799 | 72% | 0.72 | S | S | * | * | trans | -94.5 | 111 | 150.1 | 8.4 | 10.4 | 0 | 0 | 0 | 108.7 | H333 | P331-H333 PolarHBondContact O-N 3.47Š| ||
| 332 | K | 31.6 | Very low | 29.5 | Very low | 187 Ų | 187 | 131.7 Ų | 131.7 | 81% | 0.813 | 71% | 0.709 | S | S | * | * | trans | -71.5 | 115.5 | 163.4 | -84.2 | 178.3 | 174.8 | 176.1 | 0 | 108.8 | ||||
| 333 | H | 32.4 | Very low | 29.7 | Very low | 197 Ų | 197 | 129.5 Ų | 129.5 | 91% | 0.912 | 70% | 0.7 | S | S | * | * | trans | -152.6 | 87.6 | 144.8 | -90.9 | -58.9 | 0 | 0 | 0 | 108.5 | P331 | P331-H333 PolarHBondContact O-N 3.47Š| ||
| 334 | Q | 32.3 | Very low | 29.8 | Very low | 195 Ų | 195 | 130.1 Ų | 130.1 | 91% | 0.911 | 70% | 0.698 | S | S | * | * | trans | -94 | 110.5 | 167.1 | -98.8 | 168.3 | -32.9 | 0 | 0 | 107.9 | ||||
| 335 | G | 28.6 | Very low | 30.3 | Very low | 39 Ų | 39 | 128.2 Ų | 128.2 | 40% | 0.402 | 68% | 0.679 | S | S | . | * | trans | -84 | 135 | 166.4 | 0 | 0 | 0 | 0 | 0 | 110 | A337 D338 | G335-A337 PolarHBondContact O-N 3.04Å; G335-D338 PolarHBondContact O-N 3.36Å | ||
| 336 | L | 31.8 | Very low | 30.7 | Very low | 166 Ų | 166 | 127.1 Ų | 127.1 | 87% | 0.869 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.4 | -10.8 | 178.1 | -140.6 | 88.1 | 0 | 0 | 0 | 114 | ||
| 337 | A | 31.5 | Very low | 30.9 | Very low | 76 Ų | 76 | 131.8 Ų | 131.8 | 63% | 0.628 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.2 | -26.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | G335 T339 A340 F341 | G335-A337 PolarHBondContact O-N 3.04Å; A337-T339 VanDerWaalsContact C-N 3.3Å; A337-T339 PolarHBondContact O-N 3.4Å; A337-A340 PolarHBondContact O-N 3.44Å; A337-F341 PolarHBondContact O-N 3.27Å |
| 338 | D | 33.5 | Very low | 31.1 | Very low | 98 Ų | 98 | 133.4 Ų | 133.4 | 52% | 0.524 | 68% | 0.684 | S | S | . | * | H | α-helix | trans | -71.3 | -28.7 | 177.7 | -72.4 | -30.9 | 0 | 0 | 0 | 111.6 | G335 A340 F341 Q342 | G335-D338 PolarHBondContact O-N 3.36Å; D338-A340 VanDerWaalsContact C-N 3.32Å; D338-A340 PolarHBondContact O-N 2.95Å; D338-F341 PolarHBondContact O-N 3.27Å; D338-Q342 WeakPolarHBondContact O-CB 3.34Å; D338-Q342 PolarHBondContact O-N 2.98Å |
| 339 | T | 35.3 | Very low | 31.3 | Very low | 75 Ų | 75 | 133.8 Ų | 133.8 | 46% | 0.46 | 68% | 0.677 | S | S | . | * | H | α-helix | trans | -71.2 | -29.1 | 177.4 | -17.5 | 0 | 0 | 0 | 0 | 112.2 | A337 M343 | A337-T339 VanDerWaalsContact C-N 3.3Å; A337-T339 PolarHBondContact O-N 3.4Å; T339-M343 PolarHBondContact O-N 3.31Å |
| 340 | A | 28.5 | Very low | 31.7 | Very low | 54 Ų | 54 | 130.2 Ų | 130.2 | 45% | 0.446 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -76.1 | -36.6 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | A337 D338 M343 L344 | A337-A340 PolarHBondContact O-N 3.44Å; D338-A340 VanDerWaalsContact C-N 3.32Å; D338-A340 PolarHBondContact O-N 2.95Å; A340-M343 PolarHBondContact O-N 2.95Å; A340-L344 PolarHBondContact O-N 2.8Å |
| 341 | F | 31.9 | Very low | 31.9 | Very low | 123 Ų | 123 | 127.7 Ų | 127.7 | 54% | 0.539 | 66% | 0.659 | S | S | . | * | H | α-helix | trans | -71 | -35.5 | 174.8 | -154 | -103.6 | 0 | 0 | 0 | 112.1 | W282 A337 D338 M343 I345 | W282-F341 HydrophobicContact CH2-CZ 4.32Å; W282-F341 HydrophobicContact CZ2-CZ 4.28Å; A337-F341 PolarHBondContact O-N 3.27Å; D338-F341 PolarHBondContact O-N 3.27Å; F341-M343 VanDerWaalsContact C-N 3.33Å; F341-M343 PolarHBondContact O-N 3.17Å; F341-I345 HydrophobicContact CD1-CD1 3.84Å; F341-I345 HydrophobicContact CE1-CD1 3.68Å; F341-I345 HydrophobicContact CZ-CD1 4.48Å |
| 342 | Q | 33.7 | Very low | 32 | Very low | 116 Ų | 116 | 128 Ų | 128 | 54% | 0.542 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -70.8 | -19.1 | 171.5 | -99.8 | 169.4 | -19.6 | 0 | 0 | 114.3 | D338 Y346 | D338-Q342 WeakPolarHBondContact O-CB 3.34Å; D338-Q342 PolarHBondContact O-N 2.98Å; Q342-Y346 WeakPolarHBondContact O-CD2 3.32Å |
| 343 | M | 30.3 | Very low | 32 | Very low | 133 Ų | 133 | 124.1 Ų | 124.1 | 66% | 0.655 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -87.4 | -28 | 173.8 | -93.6 | -167.2 | -86.8 | 0 | 0 | 113.1 | T339 A340 F341 | T339-M343 PolarHBondContact O-N 3.31Å; A340-M343 PolarHBondContact O-N 2.95Å; F341-M343 VanDerWaalsContact C-N 3.33Å; F341-M343 PolarHBondContact O-N 3.17Å |
| 344 | L | 31.6 | Very low | 32 | Very low | 146 Ų | 146 | 118.9 Ų | 118.9 | 76% | 0.764 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -81.8 | -15.5 | -178.7 | -91.5 | 150.6 | 0 | 0 | 0 | 114.3 | A340 | A340-L344 PolarHBondContact O-N 2.8Å |
| 345 | I | 34.9 | Very low | 31.9 | Very low | 61 Ų | 61 | 113 Ų | 113 | 31% | 0.313 | 60% | 0.597 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -86.3 | -11.1 | 175.2 | -68 | 175.8 | 0 | 0 | 0 | 112.4 | W282 F341 | W282-I345 HydrophobicContact CZ2-CD1 4.08Å; W282-I345 HydrophobicContact CZ2-CG1 4.47Å; F341-I345 HydrophobicContact CD1-CD1 3.84Å; F341-I345 HydrophobicContact CE1-CD1 3.68Å; F341-I345 HydrophobicContact CZ-CD1 4.48Å |
| 346 | Y | 35.4 | Very low | 32.2 | Very low | 120 Ų | 120 | 119.2 Ų | 119.2 | 47% | 0.471 | 61% | 0.613 | S | S | . | * | trans | -115.5 | 42.6 | -174.4 | -68.7 | -95.9 | 0 | 0 | 0 | 113.3 | P62 Q342 | P62-Y346 HydrophobicContact CG-CE1 4.26Å; Q342-Y346 WeakPolarHBondContact O-CD2 3.32Å | ||
| 347 | F | 28.3 | Very low | 32.3 | Very low | 262 Ų | 262 | 114.9 Ų | 114.9 | 100% | 1.149 | 59% | 0.59 | S | S | * | * | trans | -128.1 | 0 | 158.6 | -86.9 | -74.5 | 0 | 0 | 0 | 111.1 |
Retrieved 347 of 347 residues in 190.9 ms
(Link to these results)