| 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 | 26.3 | Very low | 25.3 | Very low | 248 Ų | 248 | 101.6 Ų | 101.6 | 100% | 1.222 | 54% | 0.538 | S | S | * | . | 0 | 101.1 | 0 | -78.5 | 170.4 | 161.4 | 0 | 0 | 107.6 | |||||
| 2 | T | 20.6 | Very low | 25.4 | Very low | 140 Ų | 140 | 98.3 Ų | 98.3 | 86% | 0.859 | 54% | 0.535 | S | S | * | . | P | Polyproline II helix | trans | -87.2 | 127.6 | -178.8 | 43.8 | 0 | 0 | 0 | 0 | 109.2 | ||
| 3 | L | 23 | Very low | 25.9 | Very low | 116 Ų | 116 | 93.8 Ų | 93.8 | 61% | 0.607 | 51% | 0.51 | S | S | * | . | P | Polyproline II helix | trans | -58.6 | 142.4 | 177.6 | -71.7 | 161.3 | 0 | 0 | 0 | 110.7 | N7 | L3-N7 HydrophobicContact CB-CB 4.35Š|
| 4 | P | 21.3 | Very low | 26.3 | Very low | 59 Ų | 59 | 100.3 Ų | 100.3 | 38% | 0.383 | 52% | 0.524 | S | S | . | . | P | Polyproline II helix | trans | -57.7 | 149.4 | 174 | -18.8 | 30.1 | 0 | 0 | 0 | 111.2 | V6 N7 | P4-V6 PolarHBondContact O-N 2.98Å; P4-N7 PolarHBondContact O-N 2.95Å |
| 5 | A | 23.6 | Very low | 26.5 | Very low | 70 Ų | 70 | 95.7 Ų | 95.7 | 58% | 0.579 | 50% | 0.504 | S | S | * | . | G | 310 helix | trans | -50.2 | -25.2 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | N7 R8 | A5-N7 PolarHBondContact O-N 2.86Å; A5-N7 VanDerWaalsContact O-N 3.15Å; A5-R8 PolarHBondContact O-N 3.25Å; A5-R8 VanDerWaalsContact O-N 3.09Å |
| 6 | V | 25.4 | Very low | 26.9 | Very low | 42 Ų | 42 | 92.2 Ų | 92.2 | 26% | 0.255 | 48% | 0.484 | S | S | . | . | G | 310 helix | trans | -58.9 | -23.6 | 177.1 | -171.4 | 0 | 0 | 0 | 0 | 113 | P4 A9 E378 E382 | P4-V6 PolarHBondContact O-N 2.98Å; V6-A9 WeakPolarHBondContact O-CB 3.37Å; V6-E378 HydrophobicContact CG2-CB 4.33Å; V6-E382 HydrophobicContact CG2-CB 4.33Å |
| 7 | N | 27.6 | Very low | 27.3 | Very low | 36 Ų | 36 | 90.4 Ų | 90.4 | 19% | 0.193 | 47% | 0.474 | C | S | . | . | G | 310 helix | trans | -87.6 | -0.2 | 178.2 | -81.3 | -18.9 | 0 | 0 | 0 | 114.9 | L3 P4 A5 L10 | L3-N7 HydrophobicContact CB-CB 4.35Å; P4-N7 PolarHBondContact O-N 2.95Å; A5-N7 PolarHBondContact O-N 2.86Å; A5-N7 VanDerWaalsContact O-N 3.15Å; N7-L10 WeakPolarHBondContact OD1-CD1 3.39Å |
| 8 | R | 24.3 | Very low | 27.3 | Very low | 219 Ų | 219 | 92.9 Ų | 92.9 | 83% | 0.826 | 48% | 0.483 | S | S | * | . | G | 310 helix | trans | -74 | -19.5 | 166.9 | -76.6 | -174.1 | -173.3 | 179.5 | 2.2 | 112.4 | A5 L10 | A5-R8 PolarHBondContact O-N 3.25Å; A5-R8 VanDerWaalsContact O-N 3.09Å; R8-L10 VanDerWaalsContact C-N 3.32Å; R8-L10 PolarHBondContact O-N 3.29Å |
| 9 | A | 25.8 | Very low | 27.6 | Very low | 30 Ų | 30 | 91.6 Ų | 91.6 | 25% | 0.248 | 48% | 0.476 | C | S | . | . | G | 310 helix | trans | -75 | -17.6 | -178 | 0 | 0 | 0 | 0 | 0 | 114.9 | V6 F11 Q375 | V6-A9 WeakPolarHBondContact O-CB 3.37Å; A9-F11 PolarHBondContact O-N 2.98Å; A9-Q375 HydrophobicContact CB-CG 4.19Å |
| 10 | L | 27.4 | Very low | 27.8 | Very low | 61 Ų | 61 | 90.2 Ų | 90.2 | 32% | 0.319 | 47% | 0.466 | S | S | . | . | G | 310 helix | trans | -71.5 | -14.6 | -176.6 | -96.4 | 153.7 | 0 | 0 | 0 | 114.3 | N7 R8 T303 L307 | N7-L10 WeakPolarHBondContact OD1-CD1 3.39Å; R8-L10 VanDerWaalsContact C-N 3.32Å; R8-L10 PolarHBondContact O-N 3.29Å; L10-T303 HydrophobicContact CD1-CG2 4.15Å; L10-T303 HydrophobicContact CD2-CG2 3.47Å; L10-T303 VanDerWaalsContact CD2-CG2 3.47Å; L10-T303 HydrophobicContact CG-CG2 4.34Å; L10-L307 HydrophobicContact CD1-CD1 3.96Å; L10-L307 HydrophobicContact CD1-CD2 4.23Å; L10-L307 HydrophobicContact CD1-CG 4.49Å |
| 11 | F | 32.6 | Very low | 28 | Very low | 97 Ų | 97 | 86.9 Ų | 86.9 | 43% | 0.425 | 45% | 0.449 | S | S | . | . | G | 310 helix | trans | -127 | 8.6 | -167.7 | -64.2 | -69.9 | 0 | 0 | 0 | 114.9 | A9 A264 A265 | A9-F11 PolarHBondContact O-N 2.98Å; F11-A264 HydrophobicContact CE1-CB 3.73Å; F11-A264 VanDerWaalsContact CZ-C 3.47Å; F11-A264 HydrophobicContact CZ-CB 3.79Å; F11-A265 HydrophobicContact CD1-CB 3.73Å; F11-A265 HydrophobicContact CE1-CB 3.71Å; F11-A265 HydrophobicContact CG-CB 4.35Å; F11-A265 HydrophobicContact CZ-CB 4.3Å |
| 12 | A | 26.6 | Very low | 28.2 | Very low | 61 Ų | 61 | 76.6 Ų | 76.6 | 50% | 0.504 | 40% | 0.401 | S | S | . | . | trans | -147.4 | 45.2 | -177.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | R14 E371 | A12-R14 VanDerWaalsContact C-N 3.31Å; A12-R14 PolarHBondContact O-N 2.78Å; A12-E371 VanDerWaalsContact O-OE1 3.1Å | ||
| 13 | N | 32.2 | Very low | 28.6 | Very low | 40 Ų | 40 | 72.7 Ų | 72.7 | 21% | 0.214 | 37% | 0.373 | C | S | . | . | trans | -74.7 | 93.5 | 174.1 | -164.8 | -22.5 | 0 | 0 | 0 | 107.6 | S15 Q16 I17 E371 | N13-S15 PolarHBondContact O-N 3.15Å; N13-S15 WeakPolarHBondContact OD1-CB 3.34Å; N13-S15 PolarHBondContact OD1-N 3.16Å; N13-Q16 HydrophobicContact CB-CB 3.86Å; N13-Q16 HydrophobicContact CB-CG 4.06Å; N13-Q16 CarbonylContact O-C 3.5Å; N13-Q16 PolarHBondContact O-N 3.41Å; N13-Q16 PolarHBondContact OD1-N 3.48Å; N13-I17 WeakPolarHBondContact O-CG1 3.49Å; N13-I17 PolarHBondContact O-N 2.94Å; N13-E371 WeakPolarHBondContact CA-OE1 3.47Å | ||
| 14 | R | 31.6 | Very low | 29.1 | Very low | 185 Ų | 185 | 67.8 Ų | 67.8 | 70% | 0.698 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -64.1 | -26.2 | -175.9 | -148 | -178.5 | -171 | -166.4 | 3.7 | 110.2 | A12 I17 Q18 E371 | A12-R14 VanDerWaalsContact C-N 3.31Å; A12-R14 PolarHBondContact O-N 2.78Å; R14-I17 PolarHBondContact O-N 3.07Å; R14-Q18 WeakPolarHBondContact O-CB 3.39Å; R14-Q18 PolarHBondContact O-N 3.46Å; R14-E371 PolarHBondContact N-OE1 3.46Å; R14-E371 PolarHBondContact N-OE2 2.65Å |
| 15 | S | 29.4 | Very low | 29.6 | Very low | 32 Ų | 32 | 67.3 Ų | 67.3 | 22% | 0.224 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -73.8 | -38.8 | 172.1 | -53 | 0 | 0 | 0 | 0 | 112.6 | N13 Q18 L19 E371 | N13-S15 PolarHBondContact O-N 3.15Å; N13-S15 WeakPolarHBondContact OD1-CB 3.34Å; N13-S15 PolarHBondContact OD1-N 3.16Å; S15-Q18 CarbonylContact O-C 3.59Å; S15-Q18 PolarHBondContact O-N 3.15Å; S15-L19 WeakPolarHBondContact O-CB 3.39Å; S15-L19 PolarHBondContact O-N 3.08Å; S15-E371 WeakPolarHBondContact CB-OE2 3.49Å; S15-E371 PolarHBondContact N-OE2 2.95Å; S15-E371 VanDerWaalsContact N-OE2 3.1Å; S15-E371 PolarHBondContact OG-OE2 2.83Å |
| 16 | Q | 33.6 | Very low | 30.1 | Very low | 39 Ų | 39 | 71.5 Ų | 71.5 | 18% | 0.182 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -70.8 | -29.8 | 167.2 | -77.5 | -173.7 | 2.4 | 0 | 0 | 112.8 | N13 F20 | N13-Q16 HydrophobicContact CB-CB 3.86Å; N13-Q16 HydrophobicContact CB-CG 4.06Å; N13-Q16 CarbonylContact O-C 3.5Å; N13-Q16 PolarHBondContact O-N 3.41Å; N13-Q16 PolarHBondContact OD1-N 3.48Å; Q16-F20 WeakPolarHBondContact O-CA 3.41Å; Q16-F20 WeakPolarHBondContact O-CB 3.42Å; Q16-F20 PolarHBondContact O-N 2.92Å |
| 17 | I | 33.4 | Very low | 30.3 | Very low | 61 Ų | 61 | 74.2 Ų | 74.2 | 31% | 0.313 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -70.5 | -35.8 | 170.6 | -67.1 | 168 | 0 | 0 | 0 | 109.7 | N13 R14 I21 Y163 | N13-I17 WeakPolarHBondContact O-CG1 3.49Å; N13-I17 PolarHBondContact O-N 2.94Å; R14-I17 PolarHBondContact O-N 3.07Å; I17-I21 HydrophobicContact CG2-CD1 3.52Å; I17-I21 HydrophobicContact CG2-CG1 4.19Å; I17-I21 WeakPolarHBondContact O-CA 3.31Å; I17-I21 WeakPolarHBondContact O-CB 3.44Å; I17-I21 WeakPolarHBondContact O-CD1 3.43Å; I17-I21 WeakPolarHBondContact O-CG1 3.26Å; I17-I21 PolarHBondContact O-N 3.42Å; I17-Y163 HydrophobicContact CG2-CE1 4.24Å |
| 18 | Q | 27.7 | Very low | 30.5 | Very low | 137 Ų | 137 | 73.9 Ų | 73.9 | 64% | 0.64 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -69 | -40.3 | 172.2 | -102.2 | -169.6 | -8.7 | 0 | 0 | 112.6 | R14 S15 S22 | R14-Q18 WeakPolarHBondContact O-CB 3.39Å; R14-Q18 PolarHBondContact O-N 3.46Å; S15-Q18 CarbonylContact O-C 3.59Å; S15-Q18 PolarHBondContact O-N 3.15Å; Q18-S22 WeakPolarHBondContact O-CA 3.5Å; Q18-S22 WeakPolarHBondContact O-CB 3.45Å; Q18-S22 PolarHBondContact O-N 2.96Å |
| 19 | L | 31.3 | Very low | 31 | Very low | 67 Ų | 67 | 64.3 Ų | 64.3 | 35% | 0.351 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -66.8 | -50.1 | 172.9 | -88.2 | 155.6 | 0 | 0 | 0 | 109.9 | S15 I21 S22 E23 | S15-L19 WeakPolarHBondContact O-CB 3.39Å; S15-L19 PolarHBondContact O-N 3.08Å; L19-I21 PolarHBondContact O-N 2.99Å; L19-S22 CarbonylContact O-C 3.55Å; L19-S22 WeakPolarHBondContact O-CA 3.49Å; L19-S22 WeakPolarHBondContact O-CB 3.43Å; L19-S22 PolarHBondContact O-N 2.94Å; L19-E23 WeakPolarHBondContact O-CA 3.4Å; L19-E23 WeakPolarHBondContact O-CB 3.27Å; L19-E23 PolarHBondContact O-N 3.45Å |
| 20 | F | 32.1 | Very low | 31.4 | Very low | 64 Ų | 64 | 63.9 Ų | 63.9 | 28% | 0.281 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -58 | -46.1 | 174.6 | -173.2 | -102.1 | 0 | 0 | 0 | 111.1 | Q16 S22 E23 V24 L254 | Q16-F20 WeakPolarHBondContact O-CA 3.41Å; Q16-F20 WeakPolarHBondContact O-CB 3.42Å; Q16-F20 PolarHBondContact O-N 2.92Å; F20-S22 VanDerWaalsContact C-N 3.33Å; F20-S22 PolarHBondContact O-N 3.33Å; F20-E23 PolarHBondContact O-N 3.17Å; F20-V24 HydrophobicContact CD1-CG2 3.93Å; F20-V24 HydrophobicContact CD2-CG2 4.05Å; F20-V24 HydrophobicContact CE1-CG2 3.82Å; F20-V24 HydrophobicContact CE2-CG2 3.95Å; F20-V24 HydrophobicContact CG-CG2 4.05Å; F20-V24 HydrophobicContact CZ-CG2 3.84Å; F20-V24 WeakPolarHBondContact O-CA 3.4Å; F20-V24 WeakPolarHBondContact O-CB 3.28Å; F20-V24 WeakPolarHBondContact O-CG2 3.37Å; F20-V24 PolarHBondContact O-N 3.19Å; F20-L254 HydrophobicContact CE2-CD2 4.25Å |
| 21 | I | 32.2 | Very low | 31.6 | Very low | 21 Ų | 21 | 64.6 Ų | 64.6 | 11% | 0.108 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -66.6 | -36.8 | 174.3 | -70.5 | 171.6 | 0 | 0 | 0 | 110.6 | I17 L19 L25 Y163 V164 | I17-I21 HydrophobicContact CG2-CD1 3.52Å; I17-I21 HydrophobicContact CG2-CG1 4.19Å; I17-I21 WeakPolarHBondContact O-CA 3.31Å; I17-I21 WeakPolarHBondContact O-CB 3.44Å; I17-I21 WeakPolarHBondContact O-CD1 3.43Å; I17-I21 WeakPolarHBondContact O-CG1 3.26Å; I17-I21 PolarHBondContact O-N 3.42Å; L19-I21 PolarHBondContact O-N 2.99Å; I21-L25 HydrophobicContact CG2-CD1 3.45Å; I21-L25 VanDerWaalsContact CG2-CD1 3.45Å; I21-L25 HydrophobicContact CG2-CG 4.04Å; I21-L25 WeakPolarHBondContact O-CA 3.33Å; I21-L25 WeakPolarHBondContact O-CB 3.36Å; I21-L25 VanDerWaalsContact O-CD1 3.31Å; I21-L25 WeakPolarHBondContact O-CD1 3.36Å; I21-L25 WeakPolarHBondContact O-CG 3.15Å; I21-L25 PolarHBondContact O-N 3.09Å; I21-Y163 HydrophobicContact CD1-CD1 4.09Å; I21-Y163 HydrophobicContact CD1-CE1 4.43Å; I21-V164 HydrophobicContact CD1-CG2 3.28Å; I21-V164 HydrophobicContact CG2-CG2 4.49Å |
| 22 | S | 29.9 | Very low | 31.5 | Very low | 31 Ų | 31 | 62.8 Ų | 62.8 | 22% | 0.217 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -69.1 | -37 | 175.7 | 158.2 | 0 | 0 | 0 | 0 | 113.1 | Q18 L19 F20 R26 | Q18-S22 WeakPolarHBondContact O-CA 3.5Å; Q18-S22 WeakPolarHBondContact O-CB 3.45Å; Q18-S22 PolarHBondContact O-N 2.96Å; L19-S22 CarbonylContact O-C 3.55Å; L19-S22 WeakPolarHBondContact O-CA 3.49Å; L19-S22 WeakPolarHBondContact O-CB 3.43Å; L19-S22 PolarHBondContact O-N 2.94Å; F20-S22 VanDerWaalsContact C-N 3.33Å; F20-S22 PolarHBondContact O-N 3.33Å; S22-R26 WeakPolarHBondContact O-CB 3.39Å; S22-R26 WeakPolarHBondContact O-CD 3.48Å; S22-R26 WeakPolarHBondContact O-CG 3.33Å; S22-R26 PolarHBondContact O-N 3.39Å; S22-R26 VanDerWaalsContact O-N 3.08Å; S22-R26 PolarHBondContact O-NE 3.48Å; S22-R26 PolarHBondContact OG-NE 3.24Å; S22-R26 PolarHBondContact OG-NH2 3.15Å |
| 23 | E | 30 | Very low | 31.7 | Very low | 58 Ų | 58 | 65.2 Ų | 65.2 | 27% | 0.271 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -79.3 | -45.1 | -179 | -148.9 | 85.5 | -156.2 | 0 | 0 | 109.1 | L19 F20 R26 N27 | L19-E23 WeakPolarHBondContact O-CA 3.4Å; L19-E23 WeakPolarHBondContact O-CB 3.27Å; L19-E23 PolarHBondContact O-N 3.45Å; F20-E23 PolarHBondContact O-N 3.17Å; E23-R26 CarbonylContact O-C 3.57Å; E23-R26 WeakPolarHBondContact O-CA 3.41Å; E23-R26 WeakPolarHBondContact O-CB 3.5Å; E23-R26 PolarHBondContact O-N 3.05Å; E23-R26 VanDerWaalsContact O-N 3.08Å; E23-N27 VanDerWaalsContact O-CB 3.25Å; E23-N27 WeakPolarHBondContact O-CB 3.28Å; E23-N27 PolarHBondContact O-N 3.3Å |
| 24 | V | 32.9 | Very low | 31.8 | Very low | 14 Ų | 14 | 65 Ų | 65 | 9% | 0.085 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -66.4 | -39.9 | 173.8 | 166.2 | 0 | 0 | 0 | 0 | 111.3 | F20 R26 L28 | F20-V24 HydrophobicContact CD1-CG2 3.93Å; F20-V24 HydrophobicContact CD2-CG2 4.05Å; F20-V24 HydrophobicContact CE1-CG2 3.82Å; F20-V24 HydrophobicContact CE2-CG2 3.95Å; F20-V24 HydrophobicContact CG-CG2 4.05Å; F20-V24 HydrophobicContact CZ-CG2 3.84Å; F20-V24 WeakPolarHBondContact O-CA 3.4Å; F20-V24 WeakPolarHBondContact O-CB 3.28Å; F20-V24 WeakPolarHBondContact O-CG2 3.37Å; F20-V24 PolarHBondContact O-N 3.19Å; V24-R26 VanDerWaalsContact C-N 3.25Å; V24-R26 PolarHBondContact O-N 3.46Å; V24-L28 HydrophobicContact CB-CD1 4.44Å; V24-L28 HydrophobicContact CG1-CD1 3.96Å; V24-L28 HydrophobicContact CG2-CD1 4.25Å; V24-L28 PolarHBondContact O-N 3.17Å |
| 25 | L | 31.8 | Very low | 31.5 | Very low | 49 Ų | 49 | 63 Ų | 63 | 26% | 0.257 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -73.9 | -13.3 | 170.6 | -68.8 | 171.7 | 0 | 0 | 0 | 113.2 | I21 L157 | I21-L25 HydrophobicContact CG2-CD1 3.45Å; I21-L25 VanDerWaalsContact CG2-CD1 3.45Å; I21-L25 HydrophobicContact CG2-CG 4.04Å; I21-L25 WeakPolarHBondContact O-CA 3.33Å; I21-L25 WeakPolarHBondContact O-CB 3.36Å; I21-L25 VanDerWaalsContact O-CD1 3.31Å; I21-L25 WeakPolarHBondContact O-CD1 3.36Å; I21-L25 WeakPolarHBondContact O-CG 3.15Å; I21-L25 PolarHBondContact O-N 3.09Å; L25-L157 HydrophobicContact CD2-CD2 3.99Å |
| 26 | R | 33.8 | Very low | 31.7 | Very low | 157 Ų | 157 | 63.9 Ų | 63.9 | 59% | 0.592 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -93.2 | -39.1 | 174.5 | -87.6 | -179.7 | -122.1 | -163.2 | 0.6 | 112.7 | S22 E23 V24 | S22-R26 WeakPolarHBondContact O-CB 3.39Å; S22-R26 WeakPolarHBondContact O-CD 3.48Å; S22-R26 WeakPolarHBondContact O-CG 3.33Å; S22-R26 PolarHBondContact O-N 3.39Å; S22-R26 VanDerWaalsContact O-N 3.08Å; S22-R26 PolarHBondContact O-NE 3.48Å; S22-R26 PolarHBondContact OG-NE 3.24Å; S22-R26 PolarHBondContact OG-NH2 3.15Å; E23-R26 CarbonylContact O-C 3.57Å; E23-R26 WeakPolarHBondContact O-CA 3.41Å; E23-R26 WeakPolarHBondContact O-CB 3.5Å; E23-R26 PolarHBondContact O-N 3.05Å; E23-R26 VanDerWaalsContact O-N 3.08Å; V24-R26 VanDerWaalsContact C-N 3.25Å; V24-R26 PolarHBondContact O-N 3.46Å |
| 27 | N | 30.1 | Very low | 31.3 | Very low | 99 Ų | 99 | 71.8 Ų | 71.8 | 53% | 0.529 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -120.1 | 1 | -159.4 | -68.4 | -19.8 | 0 | 0 | 0 | 115.8 | E23 | E23-N27 VanDerWaalsContact O-CB 3.25Å; E23-N27 WeakPolarHBondContact O-CB 3.28Å; E23-N27 PolarHBondContact O-N 3.3Å |
| 28 | L | 32 | Very low | 31 | Very low | 30 Ų | 30 | 72.7 Ų | 72.7 | 16% | 0.157 | 36% | 0.362 | C | S | . | . | S | Bend | trans | -109 | 105.9 | 175.6 | -65.7 | 176.7 | 0 | 0 | 0 | 112.6 | V24 L30 E196 L254 | V24-L28 HydrophobicContact CB-CD1 4.44Å; V24-L28 HydrophobicContact CG1-CD1 3.96Å; V24-L28 HydrophobicContact CG2-CD1 4.25Å; V24-L28 PolarHBondContact O-N 3.17Å; L28-L30 PolarHBondContact O-N 3.02Å; L28-E196 WeakPolarHBondContact CB-OE2 3.34Å; L28-E196 HydrophobicContact CD1-CG 3.85Å; L28-E196 WeakPolarHBondContact CD1-OE1 3.21Å; L28-L254 HydrophobicContact CD1-CD1 3.88Å; L28-L254 HydrophobicContact CD2-CD1 3.9Å; L28-L254 HydrophobicContact CG-CD1 4.29Å |
| 29 | S | 35.2 | Very low | 30.9 | Very low | 17 Ų | 17 | 74.8 Ų | 74.8 | 12% | 0.119 | 37% | 0.372 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 34 | -32.1 | 149 | -171.9 | 0 | 0 | 0 | 0 | 122.1 | S31 S32 R33 | S29-S31 PolarHBondContact O-N 3.23Å; S29-S32 PolarHBondContact O-N 3.03Å; S29-S32 VanDerWaalsContact O-N 3.16Å; S29-S32 PolarHBondContact O-OG 2.97Å; S29-R33 PolarHBondContact O-N 2.63Å |
| 30 | L | 32.8 | Very low | 30.6 | Very low | 21 Ų | 21 | 74.7 Ų | 74.7 | 11% | 0.11 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -62.1 | -32.9 | 174.3 | -82.5 | 161.3 | 0 | 0 | 0 | 110.5 | L28 S32 R33 F34 Y153 M197 | L28-L30 PolarHBondContact O-N 3.02Å; L30-S32 PolarHBondContact O-N 3.15Å; L30-R33 PolarHBondContact O-N 2.92Å; L30-F34 VanDerWaalsContact O-CD2 3.26Å; L30-F34 WeakPolarHBondContact O-CD2 3.23Å; L30-F34 PolarHBondContact O-N 2.87Å; L30-Y153 HydrophobicContact CB-CD2 4.41Å; L30-M197 HydrophobicContact CD1-CE 3.62Å |
| 31 | S | 32.1 | Very low | 30.4 | Very low | 77 Ų | 77 | 75.2 Ų | 75.2 | 54% | 0.538 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -66.9 | -30.8 | 175.8 | 64.6 | 0 | 0 | 0 | 0 | 114.1 | S29 | S29-S31 PolarHBondContact O-N 3.23Å |
| 32 | S | 29.9 | Very low | 30 | Very low | 59 Ų | 59 | 81.3 Ų | 81.3 | 41% | 0.413 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -78.8 | -27.1 | 179.4 | 64 | 0 | 0 | 0 | 0 | 112.6 | S29 L30 | S29-S32 PolarHBondContact O-N 3.03Å; S29-S32 VanDerWaalsContact O-N 3.16Å; S29-S32 PolarHBondContact O-OG 2.97Å; L30-S32 PolarHBondContact O-N 3.15Å |
| 33 | R | 32.1 | Very low | 29.8 | Very low | 112 Ų | 112 | 83.8 Ų | 83.8 | 42% | 0.423 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -75 | -23.4 | 170.8 | -70.3 | -173.6 | -172.1 | -179.4 | 3.3 | 113.7 | S29 L30 N35 D191 | S29-R33 PolarHBondContact O-N 2.63Å; L30-R33 PolarHBondContact O-N 2.92Å; R33-N35 VanDerWaalsContact C-N 3.28Å; R33-N35 PolarHBondContact O-N 2.95Å; R33-N35 VanDerWaalsContact O-N 3.08Å; R33-D191 IonicContact CZ-OD1 3.53Å; R33-D191 VanDerWaalsContact CZ-OD1 3.31Å; R33-D191 IonicContact CZ-OD2 3.88Å; R33-D191 IonicContact NH1-OD1 2.81Å; R33-D191 PolarHBondContact NH1-OD1 3.32Å; R33-D191 IonicContact NH1-OD2 3.58Å; R33-D191 IonicContact NH2-OD1 3.58Å; R33-D191 PolarHBondContact NH2-OD1 3.14Å; R33-D191 IonicContact NH2-OD2 3.67Å; R33-D191 PolarHBondContact NH2-OD2 3.45Å |
| 34 | F | 34.1 | Very low | 29.6 | Very low | 35 Ų | 35 | 85.6 Ų | 85.6 | 15% | 0.154 | 44% | 0.438 | C | S | . | . | trans | -84.3 | 68.4 | 171.3 | -83.4 | -85.6 | 0 | 0 | 0 | 111.3 | L30 F36 Q149 Y153 | L30-F34 VanDerWaalsContact O-CD2 3.26Å; L30-F34 WeakPolarHBondContact O-CD2 3.23Å; L30-F34 PolarHBondContact O-N 2.87Å; F34-F36 HydrophobicContact CB-CD2 4.36Å; F34-F36 HydrophobicContact CB-CE2 4.31Å; F34-F36 HydrophobicContact CD1-CD2 4.29Å; F34-F36 AromaticContact CD1-CE2 3.47Å; F34-F36 HydrophobicContact CD1-CE2 3.47Å; F34-F36 VanDerWaalsContact CD1-CE2 3.47Å; F34-F36 AromaticContact CD1-CZ 3.87Å; F34-F36 HydrophobicContact CD1-CZ 3.87Å; F34-F36 HydrophobicContact CE1-CE2 4.22Å; F34-F36 HydrophobicContact CE1-CZ 4.3Å; F34-F36 HydrophobicContact CG-CE2 4.29Å; F34-F36 PolarHBondContact O-N 3.15Å; F34-Q149 HydrophobicContact CE1-CB 4.19Å; F34-Q149 HydrophobicContact CZ-CB 3.9Å; F34-Q149 WeakPolarHBondContact CZ-O 2.98Å; F34-Y153 HydrophobicContact CD2-CD2 4.23Å; F34-Y153 AromaticContact CE2-CD2 3.77Å; F34-Y153 HydrophobicContact CE2-CD2 3.77Å; F34-Y153 AromaticContact CE2-CG 3.75Å; F34-Y153 HydrophobicContact CE2-CG 3.75Å; F34-Y153 VanDerWaalsContact CZ-CB 3.47Å; F34-Y153 HydrophobicContact CZ-CD2 4.41Å; F34-Y153 AromaticContact CZ-CG 3.93Å; F34-Y153 HydrophobicContact CZ-CG 3.93Å | ||
| 35 | N | 25.7 | Very low | 29.2 | Very low | 143 Ų | 143 | 93 Ų | 93 | 77% | 0.765 | 47% | 0.469 | S | S | * | . | trans | -71.4 | 78.3 | 166.4 | -106 | -38.7 | 0 | 0 | 0 | 109.9 | R33 K37 | R33-N35 VanDerWaalsContact C-N 3.28Å; R33-N35 PolarHBondContact O-N 2.95Å; R33-N35 VanDerWaalsContact O-N 3.08Å; N35-K37 PolarHBondContact O-N 3.34Å; N35-K37 VanDerWaalsContact O-N 3.12Å | ||
| 36 | F | 32.3 | Very low | 28.8 | Very low | 50 Ų | 50 | 94.1 Ų | 94.1 | 22% | 0.219 | 48% | 0.478 | C | S | . | . | trans | -70.1 | 104.3 | 163.5 | -79.5 | -65.4 | 0 | 0 | 0 | 108.4 | F34 T38 L41 E109 I113 | F34-F36 HydrophobicContact CB-CD2 4.36Å; F34-F36 HydrophobicContact CB-CE2 4.31Å; F34-F36 HydrophobicContact CD1-CD2 4.29Å; F34-F36 AromaticContact CD1-CE2 3.47Å; F34-F36 HydrophobicContact CD1-CE2 3.47Å; F34-F36 VanDerWaalsContact CD1-CE2 3.47Å; F34-F36 AromaticContact CD1-CZ 3.87Å; F34-F36 HydrophobicContact CD1-CZ 3.87Å; F34-F36 HydrophobicContact CE1-CE2 4.22Å; F34-F36 HydrophobicContact CE1-CZ 4.3Å; F34-F36 HydrophobicContact CG-CE2 4.29Å; F34-F36 PolarHBondContact O-N 3.15Å; F36-T38 PolarHBondContact O-N 3.03Å; F36-L41 HydrophobicContact CB-CD1 4.06Å; F36-L41 WeakPolarHBondContact O-CD1 3.35Å; F36-E109 HydrophobicContact CE1-CG 3.65Å; F36-E109 VanDerWaalsContact CE1-OE1 3.28Å; F36-E109 WeakPolarHBondContact CE1-OE1 3.45Å; F36-E109 HydrophobicContact CZ-CG 4.25Å; F36-I113 HydrophobicContact CD1-CD1 3.26Å; F36-I113 HydrophobicContact CD1-CG1 4.11Å; F36-I113 HydrophobicContact CD2-CD1 4.03Å; F36-I113 HydrophobicContact CD2-CG1 4.17Å; F36-I113 HydrophobicContact CE1-CD1 3.07Å; F36-I113 HydrophobicContact CE1-CG1 3.54Å; F36-I113 HydrophobicContact CE2-CD1 3.82Å; F36-I113 HydrophobicContact CE2-CG1 3.55Å; F36-I113 HydrophobicContact CG-CD1 3.77Å; F36-I113 HydrophobicContact CG-CG1 4.41Å; F36-I113 HydrophobicContact CZ-CD1 3.36Å; F36-I113 HydrophobicContact CZ-CG1 3.21Å | ||
| 37 | K | 25.3 | Very low | 28.4 | Very low | 205 Ų | 205 | 90.5 Ų | 90.5 | 89% | 0.891 | 47% | 0.473 | S | S | * | . | trans | -66.5 | 82.4 | 171.7 | -86.3 | -177.8 | 175.1 | 176.8 | 0 | 110.2 | N35 | N35-K37 PolarHBondContact O-N 3.34Å; N35-K37 VanDerWaalsContact O-N 3.12Å | ||
| 38 | T | 27.9 | Very low | 28.2 | Very low | 80 Ų | 80 | 89.9 Ų | 89.9 | 49% | 0.491 | 47% | 0.473 | S | S | . | . | S | Bend | trans | -144.9 | 136.9 | 160.9 | 49.9 | 0 | 0 | 0 | 0 | 110.5 | F36 S40 L41 | F36-T38 PolarHBondContact O-N 3.03Å; T38-S40 PolarHBondContact O-N 3.48Å; T38-S40 PolarHBondContact OG1-OG 3.36Å; T38-L41 PolarHBondContact O-N 2.95Å |
| 39 | Q | 24.4 | Very low | 27.8 | Very low | 182 Ų | 182 | 92.1 Ų | 92.1 | 85% | 0.85 | 49% | 0.491 | S | S | * | . | G | 310 helix | trans | -51.9 | -13.3 | 179.9 | -89 | 167.7 | -27.7 | 0 | 0 | 115 | L41 Q42 | Q39-L41 PolarHBondContact O-N 2.96Å; Q39-Q42 PolarHBondContact O-N 3.45Å |
| 40 | S | 25.6 | Very low | 27.2 | Very low | 64 Ų | 64 | 98.7 Ų | 98.7 | 45% | 0.448 | 52% | 0.52 | S | S | . | . | G | 310 helix | trans | -62.6 | -18.6 | 174.7 | 72.7 | 0 | 0 | 0 | 0 | 115.4 | T38 C43 | T38-S40 PolarHBondContact O-N 3.48Å; T38-S40 PolarHBondContact OG1-OG 3.36Å; S40-C43 PolarHBondContact O-N 3.14Å |
| 41 | L | 27.5 | Very low | 26.7 | Very low | 75 Ų | 75 | 101 Ų | 101 | 39% | 0.393 | 54% | 0.538 | S | S | . | . | G | 310 helix | trans | -80.5 | -17.3 | -179.5 | -83.1 | 153.2 | 0 | 0 | 0 | 114.5 | F36 T38 Q39 C43 L44 K45 | F36-L41 HydrophobicContact CB-CD1 4.06Å; F36-L41 WeakPolarHBondContact O-CD1 3.35Å; T38-L41 PolarHBondContact O-N 2.95Å; Q39-L41 PolarHBondContact O-N 2.96Å; L41-C43 PolarHBondContact O-N 3.13Å; L41-L44 HydrophobicContact CD2-CD1 4.16Å; L41-L44 PolarHBondContact O-N 3.22Å; L41-L44 VanDerWaalsContact O-N 3.15Å; L41-K45 PolarHBondContact O-N 3.47Å |
| 42 | Q | 24.1 | Very low | 26.4 | Very low | 150 Ų | 150 | 104.4 Ų | 104.4 | 70% | 0.701 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -64.9 | -30.2 | 169.8 | -93.4 | 177.9 | -24.5 | 0 | 0 | 111.8 | Q39 L44 T46 | Q39-Q42 PolarHBondContact O-N 3.45Å; Q42-L44 VanDerWaalsContact C-N 3.31Å; Q42-L44 PolarHBondContact O-N 3.02Å; Q42-T46 PolarHBondContact O-N 3.01Å; Q42-T46 PolarHBondContact O-OG1 3.44Å |
| 43 | C | 25.5 | Very low | 26.2 | Very low | 83 Ų | 83 | 105.2 Ų | 105.2 | 56% | 0.561 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -69.1 | -25.3 | 173.1 | -86.9 | 0 | 0 | 0 | 0 | 113.2 | S40 L41 T46 V47 | S40-C43 PolarHBondContact O-N 3.14Å; L41-C43 PolarHBondContact O-N 3.13Å; C43-T46 WeakPolarHBondContact CA-OG1 3.49Å; C43-T46 PolarHBondContact O-OG1 3.39Å; C43-V47 WeakPolarHBondContact O-CB 3.49Å; C43-V47 WeakPolarHBondContact O-CG2 3.41Å; C43-V47 PolarHBondContact O-N 2.94Å |
| 44 | L | 26.7 | Very low | 25.7 | Very low | 95 Ų | 95 | 105.4 Ų | 105.4 | 50% | 0.497 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -77 | -37.9 | 177.3 | -100.3 | 141.3 | 0 | 0 | 0 | 111.8 | L41 Q42 T46 V47 T48 | L41-L44 HydrophobicContact CD2-CD1 4.16Å; L41-L44 PolarHBondContact O-N 3.22Å; L41-L44 VanDerWaalsContact O-N 3.15Å; Q42-L44 VanDerWaalsContact C-N 3.31Å; Q42-L44 PolarHBondContact O-N 3.02Å; L44-T46 VanDerWaalsContact C-N 3.3Å; L44-T46 PolarHBondContact O-N 3.09Å; L44-V47 PolarHBondContact O-N 3.15Å; L44-T48 WeakPolarHBondContact O-CB 3.29Å; L44-T48 WeakPolarHBondContact O-CG2 3.23Å; L44-T48 PolarHBondContact O-N 2.98Å; L44-T48 PolarHBondContact O-OG1 3.26Å |
| 45 | K | 24.5 | Very low | 25.2 | Very low | 171 Ų | 171 | 109.5 Ų | 109.5 | 74% | 0.743 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -63.6 | -34.2 | 172.5 | -73.2 | -171.7 | 176.4 | -173.6 | 0 | 112.6 | L41 T48 S49 | L41-K45 PolarHBondContact O-N 3.47Å; K45-T48 PolarHBondContact O-OG1 3.25Å; K45-S49 PolarHBondContact O-N 3.11Å |
| 46 | T | 23.3 | Very low | 25.3 | Very low | 72 Ų | 72 | 108.6 Ų | 108.6 | 44% | 0.442 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -84.7 | -29.1 | 178.5 | 48.2 | 0 | 0 | 0 | 0 | 113.7 | Q42 C43 L44 S49 Q50 | Q42-T46 PolarHBondContact O-N 3.01Å; Q42-T46 PolarHBondContact O-OG1 3.44Å; C43-T46 WeakPolarHBondContact CA-OG1 3.49Å; C43-T46 PolarHBondContact O-OG1 3.39Å; L44-T46 VanDerWaalsContact C-N 3.3Å; L44-T46 PolarHBondContact O-N 3.09Å; T46-S49 PolarHBondContact O-OG 3.18Å; T46-Q50 WeakPolarHBondContact O-CB 3.42Å; T46-Q50 WeakPolarHBondContact O-CG 3.27Å; T46-Q50 PolarHBondContact O-N 3.5Å; T46-Q50 VanDerWaalsContact O-N 3.1Å |
| 47 | V | 25 | Very low | 25.1 | Very low | 81 Ų | 81 | 114.4 Ų | 114.4 | 49% | 0.491 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -76.4 | -32.1 | 173.9 | 172.2 | 0 | 0 | 0 | 0 | 111.5 | C43 L44 Q50 S51 | C43-V47 WeakPolarHBondContact O-CB 3.49Å; C43-V47 WeakPolarHBondContact O-CG2 3.41Å; C43-V47 PolarHBondContact O-N 2.94Å; L44-V47 PolarHBondContact O-N 3.15Å; V47-Q50 PolarHBondContact O-N 3.49Å; V47-S51 PolarHBondContact O-N 3.39Å; V47-S51 VanDerWaalsContact O-N 3.13Å; V47-S51 PolarHBondContact O-OG 3.31Å |
| 48 | T | 25.5 | Very low | 25.1 | Very low | 86 Ų | 86 | 115.4 Ų | 115.4 | 53% | 0.528 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -71.9 | -29.9 | 172.5 | 53 | 0 | 0 | 0 | 0 | 112.9 | L44 K45 | L44-T48 WeakPolarHBondContact O-CB 3.29Å; L44-T48 WeakPolarHBondContact O-CG2 3.23Å; L44-T48 PolarHBondContact O-N 2.98Å; L44-T48 PolarHBondContact O-OG1 3.26Å; K45-T48 PolarHBondContact O-OG1 3.25Å |
| 49 | S | 23.4 | Very low | 25 | Very low | 77 Ų | 77 | 122.6 Ų | 122.6 | 54% | 0.538 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -77.3 | -28 | 172.2 | 85 | 0 | 0 | 0 | 0 | 113.3 | K45 T46 S51 | K45-S49 PolarHBondContact O-N 3.11Å; T46-S49 PolarHBondContact O-OG 3.18Å; S49-S51 VanDerWaalsContact C-N 3.34Å |
| 50 | Q | 22.8 | Very low | 25.2 | Very low | 154 Ų | 154 | 118.5 Ų | 118.5 | 72% | 0.72 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -84.9 | -4 | 175.7 | -73 | -175 | -1.7 | 0 | 0 | 114.4 | T46 V47 N52 | T46-Q50 WeakPolarHBondContact O-CB 3.42Å; T46-Q50 WeakPolarHBondContact O-CG 3.27Å; T46-Q50 PolarHBondContact O-N 3.5Å; T46-Q50 VanDerWaalsContact O-N 3.1Å; V47-Q50 PolarHBondContact O-N 3.49Å; Q50-N52 VanDerWaalsContact C-N 3.28Å |
| 51 | S | 23.7 | Very low | 25.3 | Very low | 71 Ų | 71 | 122.3 Ų | 122.3 | 50% | 0.497 | 65% | 0.647 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -83.6 | -3.1 | 174.1 | -60.2 | 0 | 0 | 0 | 0 | 113.3 | V47 S49 A53 | V47-S51 PolarHBondContact O-N 3.39Å; V47-S51 VanDerWaalsContact O-N 3.13Å; V47-S51 PolarHBondContact O-OG 3.31Å; S49-S51 VanDerWaalsContact C-N 3.34Å; S51-A53 PolarHBondContact O-N 2.92Å |
| 52 | N | 25.9 | Very low | 25.3 | Very low | 147 Ų | 147 | 124.5 Ų | 124.5 | 79% | 0.786 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.9 | 17.3 | 175.5 | -73.6 | -2.7 | 0 | 0 | 0 | 114.2 | Q50 | Q50-N52 VanDerWaalsContact C-N 3.28Š|
| 53 | A | 24.8 | Very low | 25.5 | Very low | 77 Ų | 77 | 126.5 Ų | 126.5 | 64% | 0.636 | 66% | 0.661 | S | S | * | * | trans | -147.6 | 76.7 | 174 | 0 | 0 | 0 | 0 | 0 | 111.4 | S51 | S51-A53 PolarHBondContact O-N 2.92Š| ||
| 54 | V | 22.8 | Very low | 25.5 | Very low | 115 Ų | 115 | 131.4 Ų | 131.4 | 70% | 0.697 | 67% | 0.668 | S | S | * | * | trans | -99.7 | 71.6 | 166.7 | -174.1 | 0 | 0 | 0 | 0 | 108.8 | V56 | V54-V56 VanDerWaalsContact C-N 3.29Å; V54-V56 HydrophobicContact CG1-CB 4.28Å; V54-V56 HydrophobicContact CG1-CG2 3.41Å; V54-V56 VanDerWaalsContact CG1-CG2 3.41Å; V54-V56 PolarHBondContact O-N 3.28Å | ||
| 55 | T | 23.4 | Very low | 25.5 | Very low | 122 Ų | 122 | 135.7 Ų | 135.7 | 75% | 0.748 | 68% | 0.677 | S | S | * | * | trans | -82.1 | 79.3 | 157.4 | -29.9 | 0 | 0 | 0 | 0 | 108 | H57 | T55-H57 PolarHBondContact O-N 3.41Š| ||
| 56 | V | 28 | Very low | 25.8 | Very low | 123 Ų | 123 | 133.6 Ų | 133.6 | 75% | 0.745 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.1 | 68.9 | 169.9 | 175.9 | 0 | 0 | 0 | 0 | 108.6 | V54 | V54-V56 VanDerWaalsContact C-N 3.29Å; V54-V56 HydrophobicContact CG1-CB 4.28Å; V54-V56 HydrophobicContact CG1-CG2 3.41Å; V54-V56 VanDerWaalsContact CG1-CG2 3.41Å; V54-V56 PolarHBondContact O-N 3.28Å |
| 57 | H | 26.2 | Very low | 26.1 | Very low | 173 Ų | 173 | 135.4 Ų | 135.4 | 80% | 0.801 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -155 | 22.2 | 157.5 | -138 | 62.7 | 0 | 0 | 0 | 116 | T55 | T55-H57 PolarHBondContact O-N 3.41Š|
| 58 | R | 26.5 | Very low | 26.3 | Very low | 226 Ų | 226 | 139.2 Ų | 139.2 | 85% | 0.853 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -142.1 | 33.3 | 176.3 | -108.2 | -171.1 | -172 | -163.7 | 4.7 | 115.6 | ||
| 59 | R | 25.3 | Very low | 26.4 | Very low | 230 Ų | 230 | 139.1 Ų | 139.1 | 87% | 0.868 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -113.1 | -3.1 | 173.9 | -96.6 | -179.3 | 168.1 | 173.1 | -2.9 | 115.8 | ||
| 60 | S | 28.1 | Very low | 26.6 | Very low | 96 Ų | 96 | 143.1 Ų | 143.1 | 67% | 0.671 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.3 | -12.2 | 176.6 | 63.8 | 0 | 0 | 0 | 0 | 114.8 | ||
| 61 | Q | 28.1 | Very low | 26.7 | Very low | 145 Ų | 145 | 139 Ų | 139 | 68% | 0.678 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.4 | -17 | 177.1 | -68.9 | -161.5 | -2.7 | 0 | 0 | 114.5 | ||
| 62 | L | 28.2 | Very low | 26.9 | Very low | 121 Ų | 121 | 143.1 Ų | 143.1 | 63% | 0.634 | 73% | 0.733 | S | S | * | * | H | α-helix | trans | -83.6 | -28.5 | 178.1 | -143.9 | 79.7 | 0 | 0 | 0 | 112.6 | ||
| 63 | Y | 27.3 | Very low | 27 | Very low | 192 Ų | 192 | 144.9 Ų | 144.9 | 75% | 0.753 | 74% | 0.736 | S | S | * | * | H | α-helix | trans | -77.1 | -21.8 | 173.4 | -107.8 | -87.9 | 0 | 0 | 0 | 113.4 | ||
| 64 | R | 26.5 | Very low | 27.2 | Very low | 185 Ų | 185 | 148.6 Ų | 148.6 | 70% | 0.698 | 75% | 0.746 | S | S | * | * | H | α-helix | trans | -82.6 | -23.1 | 174.8 | -159.4 | 176.5 | -86.3 | 164.5 | -7.6 | 112.6 | ||
| 65 | R | 27.3 | Very low | 27.4 | Very low | 185 Ų | 185 | 147.8 Ų | 147.8 | 70% | 0.698 | 75% | 0.745 | S | S | * | * | H | α-helix | trans | -81.7 | -19.7 | 175.5 | -84.5 | -170.9 | -169 | 174.9 | 4.3 | 115.2 | C67 | R65-C67 VanDerWaalsContact C-N 3.33Å |
| 66 | I | 29.9 | Very low | 27.7 | Very low | 127 Ų | 127 | 153.1 Ų | 153.1 | 65% | 0.651 | 75% | 0.752 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.9 | -15.3 | 177.9 | -64.6 | 172.4 | 0 | 0 | 0 | 111.4 | ||
| 67 | C | 29.4 | Very low | 28.4 | Very low | 110 Ų | 110 | 152 Ų | 152 | 74% | 0.743 | 76% | 0.755 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100 | 5.4 | 176.1 | -67.1 | 0 | 0 | 0 | 0 | 114.7 | R65 | R65-C67 VanDerWaalsContact C-N 3.33Š|
| 68 | E | 29.6 | Very low | 28.8 | Very low | 162 Ų | 162 | 150 Ų | 150 | 76% | 0.757 | 76% | 0.755 | S | S | * | * | S | Bend | trans | -127.1 | 12.6 | -178.4 | -78.1 | -179.2 | 175.4 | 0 | 0 | 114.8 | ||
| 69 | S | 28.2 | Very low | 29.6 | Very low | 83 Ų | 83 | 142.8 Ų | 142.8 | 58% | 0.58 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -125.1 | 90.1 | 164.7 | 78.9 | 0 | 0 | 0 | 0 | 111 | ||
| 70 | N | 26.2 | Very low | 30.4 | Very low | 162 Ų | 162 | 139.2 Ų | 139.2 | 87% | 0.866 | 74% | 0.738 | S | S | * | * | 172.9 | 83.1 | 129.7 | -81.7 | -12.7 | 0 | 0 | 0 | 107.9 | |||||
| 71 | G | 26.2 | Very low | 30.7 | Very low | 66 Ų | 66 | 145.2 Ų | 145.2 | 68% | 0.68 | 75% | 0.746 | S | S | * | * | trans | -81.3 | 132.5 | 151.4 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 72 | D | 26.5 | Very low | 31.2 | Very low | 159 Ų | 159 | 141.2 Ų | 141.2 | 85% | 0.85 | 73% | 0.732 | S | S | * | * | trans | 72.5 | 124.3 | 161.3 | -55 | -26.6 | 0 | 0 | 0 | 115.9 | ||||
| 73 | E | 29.2 | Very low | 31.9 | Very low | 183 Ų | 183 | 144.4 Ų | 144.4 | 86% | 0.855 | 74% | 0.736 | S | S | * | * | cis | -153.2 | 142.9 | 29.8 | -72.7 | -174.1 | 141.7 | 0 | 0 | 112.6 | ||||
| 74 | N | 27.6 | Very low | 32.9 | Very low | 155 Ų | 155 | 138.2 Ų | 138.2 | 83% | 0.829 | 73% | 0.725 | S | S | * | * | trans | 66 | 99.6 | 138.7 | -131.7 | 0.6 | 0 | 0 | 0 | 121.4 | ||||
| 75 | S | 28.8 | Very low | 33.5 | Very low | 99 Ų | 99 | 134.3 Ų | 134.3 | 69% | 0.692 | 72% | 0.716 | S | S | * | * | 145.2 | 132.2 | 110.5 | 66.9 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 76 | R | 29.7 | Very low | 34.1 | Very low | 233 Ų | 233 | 133.9 Ų | 133.9 | 88% | 0.879 | 72% | 0.715 | S | S | * | * | trans | 72.9 | 94.6 | 162.5 | -67.4 | -177.1 | 175.4 | 127.1 | -0.7 | 118.9 | T78 | R76-T78 PolarHBondContact O-N 3.34Š| ||
| 77 | A | 41.9 | Very low | 35 | Very low | 100 Ų | 100 | 131 Ų | 131 | 83% | 0.826 | 71% | 0.705 | S | S | * | * | trans | -60.5 | 119 | 151.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 78 | T | 34.9 | Very low | 35.8 | Very low | 130 Ų | 130 | 128.8 Ų | 128.8 | 80% | 0.798 | 70% | 0.696 | S | S | * | * | trans | -163.2 | 126.9 | 146.2 | 42.3 | 0 | 0 | 0 | 0 | 111.5 | R76 | R76-T78 PolarHBondContact O-N 3.34Š| ||
| 79 | S | 42.7 | Very low | 36.5 | Very low | 75 Ų | 75 | 124.1 Ų | 124.1 | 52% | 0.524 | 68% | 0.675 | S | S | . | * | trans | 87.6 | 63.3 | 152.2 | 77.8 | 0 | 0 | 0 | 0 | 121.1 | T82 | S79-T82 PolarHBondContact O-OG1 2.98Š| ||
| 80 | N | 41.8 | Very low | 37.3 | Very low | 155 Ų | 155 | 123.1 Ų | 123.1 | 83% | 0.829 | 67% | 0.671 | S | S | * | * | S | Bend | trans | -87.1 | -9.4 | 159.1 | -89.5 | -5.9 | 0 | 0 | 0 | 114.2 | ||
| 81 | W | 34.2 | Very low | 38.1 | Very low | 223 Ų | 223 | 124.2 Ų | 124.2 | 85% | 0.845 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -83.5 | -21.3 | -179.4 | -120.1 | 61.9 | 0 | 0 | 0 | 113.6 | M85 | W81-M85 PolarHBondContact O-N 3.44Å |
| 82 | T | 39.2 | Very low | 38.8 | Very low | 61 Ų | 61 | 125 Ų | 125 | 37% | 0.374 | 66% | 0.664 | S | S | . | * | H | α-helix | trans | -74.3 | -41.5 | 178.8 | 47.8 | 0 | 0 | 0 | 0 | 111.1 | S79 A84 M85 W86 | S79-T82 PolarHBondContact O-OG1 2.98Å; T82-A84 PolarHBondContact O-N 3.15Å; T82-M85 PolarHBondContact O-N 2.72Å; T82-W86 PolarHBondContact O-N 3.07Å |
| 83 | Y | 43.4 | Very low | 39.5 | Very low | 187 Ų | 187 | 123.8 Ų | 123.8 | 73% | 0.733 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -66.7 | -37.3 | -180 | -100.9 | -87 | 0 | 0 | 0 | 114.2 | M85 S87 | Y83-M85 VanDerWaalsContact C-N 3.33Å; Y83-S87 WeakPolarHBondContact O-CB 3.32Å; Y83-S87 PolarHBondContact O-N 2.89Å; Y83-S87 PolarHBondContact O-OG 3.03Å |
| 84 | A | 47.5 | Very low | 40.1 | Very low | 63 Ų | 63 | 124.4 Ų | 124.4 | 52% | 0.521 | 66% | 0.657 | S | S | . | * | H | α-helix | trans | -68.3 | -33.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112 | T82 S87 A88 | T82-A84 PolarHBondContact O-N 3.15Å; A84-S87 WeakPolarHBondContact CA-OG 3.47Å; A84-S87 PolarHBondContact O-OG 3.44Å; A84-A88 PolarHBondContact O-N 3.39Å |
| 85 | M | 38.8 | Very low | 40.9 | Very low | 103 Ų | 103 | 121.7 Ų | 121.7 | 51% | 0.507 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -76.4 | -37.7 | 178.1 | -158.5 | 165.4 | 80.1 | 0 | 0 | 112.1 | W81 T82 Y83 I89 | W81-M85 PolarHBondContact O-N 3.44Å; T82-M85 PolarHBondContact O-N 2.72Å; Y83-M85 VanDerWaalsContact C-N 3.33Å; M85-I89 HydrophobicContact CG-CD1 4.09Å; M85-I89 WeakPolarHBondContact O-CB 3.39Å; M85-I89 WeakPolarHBondContact O-CD1 3.42Å; M85-I89 VanDerWaalsContact O-CG1 3.24Å; M85-I89 WeakPolarHBondContact O-CG1 3.49Å; M85-I89 PolarHBondContact O-N 2.99Å |
| 86 | W | 40.2 | Very low | 41.5 | Very low | 176 Ų | 176 | 126.1 Ų | 126.1 | 67% | 0.667 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -71.7 | -29.4 | 175 | -78.9 | 105.7 | 0 | 0 | 0 | 113.4 | T82 A90 | T82-W86 PolarHBondContact O-N 3.07Å; W86-A90 WeakPolarHBondContact O-CB 3.35Å; W86-A90 PolarHBondContact O-N 3.08Å |
| 87 | S | 48.5 | Very low | 42.5 | Very low | 65 Ų | 65 | 119.5 Ų | 119.5 | 46% | 0.455 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -72.4 | -37.8 | 173.3 | 46.5 | 0 | 0 | 0 | 0 | 112.5 | Y83 A84 F91 | Y83-S87 WeakPolarHBondContact O-CB 3.32Å; Y83-S87 PolarHBondContact O-N 2.89Å; Y83-S87 PolarHBondContact O-OG 3.03Å; A84-S87 WeakPolarHBondContact CA-OG 3.47Å; A84-S87 PolarHBondContact O-OG 3.44Å; S87-F91 PolarHBondContact O-N 3.22Å |
| 88 | A | 45.7 | Very low | 43.1 | Very low | 65 Ų | 65 | 123.8 Ų | 123.8 | 54% | 0.537 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -66.7 | -39.7 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | A84 S92 | A84-A88 PolarHBondContact O-N 3.39Å; A88-S92 PolarHBondContact O-N 3.36Å; A88-S92 PolarHBondContact O-OG 3.42Å |
| 89 | I | 45.3 | Very low | 44.3 | Very low | 64 Ų | 64 | 126.1 Ų | 126.1 | 33% | 0.328 | 66% | 0.657 | S | S | . | * | H | α-helix | trans | -72.8 | -37 | 178.8 | -68.6 | 168.2 | 0 | 0 | 0 | 111.7 | M85 F91 S92 L93 | M85-I89 HydrophobicContact CG-CD1 4.09Å; M85-I89 WeakPolarHBondContact O-CB 3.39Å; M85-I89 WeakPolarHBondContact O-CD1 3.42Å; M85-I89 VanDerWaalsContact O-CG1 3.24Å; M85-I89 WeakPolarHBondContact O-CG1 3.49Å; M85-I89 PolarHBondContact O-N 2.99Å; I89-F91 VanDerWaalsContact C-N 3.34Å; I89-F91 PolarHBondContact O-N 3.34Å; I89-S92 VanDerWaalsContact CA-OG 3.32Å; I89-S92 WeakPolarHBondContact CA-OG 3.39Å; I89-S92 PolarHBondContact O-N 2.88Å; I89-S92 VanDerWaalsContact O-N 3.15Å; I89-S92 PolarHBondContact O-OG 3.29Å; I89-L93 HydrophobicContact CG2-CD1 3.46Å; I89-L93 VanDerWaalsContact CG2-CD1 3.46Å; I89-L93 HydrophobicContact CG2-CG 4.28Å; I89-L93 PolarHBondContact O-N 3.43Å |
| 90 | A | 44.6 | Very low | 45.6 | Very low | 61 Ų | 61 | 126 Ų | 126 | 50% | 0.504 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -65.8 | -31.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | W86 | W86-A90 WeakPolarHBondContact O-CB 3.35Å; W86-A90 PolarHBondContact O-N 3.08Å |
| 91 | F | 42.8 | Very low | 47.2 | Very low | 186 Ų | 186 | 125 Ų | 125 | 82% | 0.816 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -75 | -26.8 | 171.9 | -96 | -83.9 | 0 | 0 | 0 | 113.3 | S87 I89 | S87-F91 PolarHBondContact O-N 3.22Å; I89-F91 VanDerWaalsContact C-N 3.34Å; I89-F91 PolarHBondContact O-N 3.34Å |
| 92 | S | 42.3 | Very low | 49.4 | Very low | 82 Ų | 82 | 119.6 Ų | 119.6 | 57% | 0.573 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -85.8 | -22.6 | 177.5 | 57.5 | 0 | 0 | 0 | 0 | 114.9 | A88 I89 | A88-S92 PolarHBondContact O-N 3.36Å; A88-S92 PolarHBondContact O-OG 3.42Å; I89-S92 VanDerWaalsContact CA-OG 3.32Å; I89-S92 WeakPolarHBondContact CA-OG 3.39Å; I89-S92 PolarHBondContact O-N 2.88Å; I89-S92 VanDerWaalsContact O-N 3.15Å; I89-S92 PolarHBondContact O-OG 3.29Å |
| 93 | L | 40.4 | Very low | 51.7 | Low | 133 Ų | 133 | 120.2 Ų | 120.2 | 70% | 0.696 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -94.9 | -7.9 | -177.5 | -80.5 | 167.8 | 0 | 0 | 0 | 114.8 | I89 | I89-L93 HydrophobicContact CG2-CD1 3.46Å; I89-L93 VanDerWaalsContact CG2-CD1 3.46Å; I89-L93 HydrophobicContact CG2-CG 4.28Å; I89-L93 PolarHBondContact O-N 3.43Å |
| 94 | F | 42.3 | Very low | 53.7 | Low | 196 Ų | 196 | 117 Ų | 117 | 86% | 0.86 | 63% | 0.625 | S | S | * | * | S | Bend | trans | -116 | 20.8 | 173.4 | -114.7 | -89.9 | 0 | 0 | 0 | 113.3 | K96 | F94-K96 PolarHBondContact O-N 2.9Š|
| 95 | S | 42.9 | Very low | 55.4 | Low | 98 Ų | 98 | 117.2 Ų | 117.2 | 69% | 0.685 | 63% | 0.627 | S | S | * | * | trans | -89.4 | 63.6 | 161.7 | -179.3 | 0 | 0 | 0 | 0 | 108.9 | A97 | S95-A97 PolarHBondContact O-N 3.32Š| ||
| 96 | K | 43.3 | Very low | 57.7 | Low | 192 Ų | 192 | 116.5 Ų | 116.5 | 84% | 0.835 | 62% | 0.622 | S | S | * | * | trans | -73.3 | 115.2 | 155.3 | -135.9 | 176.6 | -174.4 | 179.5 | 0 | 103.6 | F94 E98 | F94-K96 PolarHBondContact O-N 2.9Å; K96-E98 VanDerWaalsContact C-N 3.28Å; K96-E98 PolarHBondContact O-N 3.02Å | ||
| 97 | A | 49.4 | Very low | 60 | Low | 95 Ų | 95 | 111.6 Ų | 111.6 | 79% | 0.785 | 61% | 0.606 | S | S | * | * | trans | -54.1 | 97.8 | 173.8 | 0 | 0 | 0 | 0 | 0 | 107.9 | S95 E99 | S95-A97 PolarHBondContact O-N 3.32Å; A97-E99 PolarHBondContact O-N 3.37Å | ||
| 98 | E | 54.5 | Low | 62 | Low | 189 Ų | 189 | 111.3 Ų | 111.3 | 88% | 0.883 | 60% | 0.596 | S | S | * | * | trans | -59.8 | 119.6 | 166.9 | -79 | -177.7 | 160.3 | 0 | 0 | 105.8 | K96 D100 | K96-E98 VanDerWaalsContact C-N 3.28Å; K96-E98 PolarHBondContact O-N 3.02Å; E98-D100 PolarHBondContact O-N 3.06Å; E98-D100 VanDerWaalsContact O-N 3.16Å | ||
| 99 | E | 61.1 | Low | 64 | Low | 179 Ų | 179 | 111.5 Ų | 111.5 | 84% | 0.836 | 59% | 0.586 | S | S | * | * | trans | -59.9 | 119.5 | 178.8 | -161.7 | 167.9 | -162.7 | 0 | 0 | 107.8 | A97 T101 | A97-E99 PolarHBondContact O-N 3.37Å; E99-T101 WeakPolarHBondContact O-CG2 3.48Å; E99-T101 PolarHBondContact O-N 3.18Å | ||
| 100 | D | 68.4 | Low | 66.1 | Low | 73 Ų | 73 | 111 Ų | 111 | 39% | 0.39 | 58% | 0.584 | S | S | . | * | trans | -66.7 | 93.6 | -175.7 | -174.7 | -0.4 | 0 | 0 | 0 | 109.9 | E98 R102 K107 | E98-D100 PolarHBondContact O-N 3.06Å; E98-D100 VanDerWaalsContact O-N 3.16Å; D100-R102 PolarHBondContact O-N 3.33Å; D100-R102 WeakPolarHBondContact OD1-CB 3.34Å; D100-R102 WeakPolarHBondContact OD1-CG 3.49Å; D100-R102 IonicContact OD1-CZ 3.17Å; D100-R102 PolarHBondContact OD1-N 3.34Å; D100-R102 IonicContact OD1-NE 3.84Å; D100-R102 PolarHBondContact OD1-NE 3.45Å; D100-R102 IonicContact OD1-NH2 2.94Å; D100-R102 PolarHBondContact OD1-NH2 3.46Å; D100-R102 IonicContact OD2-CZ 3.54Å; D100-R102 IonicContact OD2-NE 2.83Å; D100-R102 IonicContact OD2-NH2 3.22Å; D100-R102 PolarHBondContact OD2-NH2 2.87Å; D100-K107 VanDerWaalsContact OD2-CE 3.24Å; D100-K107 WeakPolarHBondContact OD2-CE 3.36Å; D100-K107 IonicContact OD2-NZ 3.29Å | ||
| 101 | T | 76 | Confident | 68.5 | Low | 134 Ų | 134 | 112.7 Ų | 112.7 | 82% | 0.822 | 58% | 0.582 | S | S | * | * | trans | -70.9 | -2.1 | -176 | 55.2 | 0 | 0 | 0 | 0 | 114.2 | E99 | E99-T101 WeakPolarHBondContact O-CG2 3.48Å; E99-T101 PolarHBondContact O-N 3.18Å | ||
| 102 | R | 81.1 | Confident | 70.8 | Confident | 109 Ų | 109 | 104 Ų | 104 | 41% | 0.411 | 54% | 0.544 | S | S | . | . | trans | -69.8 | 139.4 | -179.2 | -68.4 | 176.7 | -68.1 | 174.6 | 1.1 | 111.8 | D100 Q106 K107 D110 | D100-R102 PolarHBondContact O-N 3.33Å; D100-R102 WeakPolarHBondContact OD1-CB 3.34Å; D100-R102 WeakPolarHBondContact OD1-CG 3.49Å; D100-R102 IonicContact OD1-CZ 3.17Å; D100-R102 PolarHBondContact OD1-N 3.34Å; D100-R102 IonicContact OD1-NE 3.84Å; D100-R102 PolarHBondContact OD1-NE 3.45Å; D100-R102 IonicContact OD1-NH2 2.94Å; D100-R102 PolarHBondContact OD1-NH2 3.46Å; D100-R102 IonicContact OD2-CZ 3.54Å; D100-R102 IonicContact OD2-NE 2.83Å; D100-R102 IonicContact OD2-NH2 3.22Å; D100-R102 PolarHBondContact OD2-NH2 2.87Å; R102-Q106 HydrophobicContact CB-CB 4.24Å; R102-K107 HydrophobicContact CB-CG 3.97Å; R102-K107 VanDerWaalsContact O-CE 3.24Å; R102-K107 WeakPolarHBondContact O-CE 3.41Å; R102-D110 VanDerWaalsContact CD-OD2 3.3Å; R102-D110 WeakPolarHBondContact CD-OD2 3.45Å; R102-D110 IonicContact CZ-OD2 2.7Å; R102-D110 IonicContact NE-OD2 2.68Å; R102-D110 IonicContact NH1-OD2 3.81Å; R102-D110 PolarHBondContact NH1-OD2 2.98Å | ||
| 103 | T | 87.8 | Confident | 73.1 | Confident | 74 Ų | 74 | 101.2 Ų | 101.2 | 45% | 0.454 | 52% | 0.522 | S | S | . | . | trans | -67.1 | 156.4 | 171 | 63 | 0 | 0 | 0 | 0 | 111.2 | A105 Q106 K107 | T103-A105 PolarHBondContact O-N 3.08Å; T103-Q106 WeakPolarHBondContact O-CB 3.35Å; T103-Q106 PolarHBondContact O-N 3.37Å; T103-Q106 WeakPolarHBondContact OG1-CB 3.48Å; T103-Q106 VanDerWaalsContact OG1-CD 3.23Å; T103-Q106 VanDerWaalsContact OG1-CG 3.24Å; T103-Q106 WeakPolarHBondContact OG1-CG 3.47Å; T103-Q106 PolarHBondContact OG1-N 3.15Å; T103-Q106 PolarHBondContact OG1-OE1 3.2Å; T103-K107 WeakPolarHBondContact O-CG 3.49Å; T103-K107 PolarHBondContact O-N 3.34Å | ||
| 104 | E | 85.5 | Confident | 75.5 | Confident | 119 Ų | 119 | 98.8 Ų | 98.8 | 56% | 0.556 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -57.6 | -35 | 176.1 | -174.2 | 58.3 | -158 | 0 | 0 | 112.5 | K107 K108 | E104-K107 PolarHBondContact O-N 3.29Å; E104-K108 WeakPolarHBondContact O-CG 3.37Å; E104-K108 PolarHBondContact O-N 3.29Å; E104-K108 VanDerWaalsContact O-N 3.12Å; E104-K108 VanDerWaalsContact OE1-CE 3.32Å; E104-K108 WeakPolarHBondContact OE1-CE 3.46Å |
| 105 | A | 83.3 | Confident | 78.1 | Confident | 68 Ų | 68 | 89.8 Ų | 89.8 | 56% | 0.562 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -64.5 | -45.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | T103 K107 K108 E109 | T103-A105 PolarHBondContact O-N 3.08Å; A105-K107 VanDerWaalsContact C-N 3.35Å; A105-K107 PolarHBondContact O-N 3.07Å; A105-K108 PolarHBondContact O-N 3.29Å; A105-E109 WeakPolarHBondContact O-CB 3.43Å; A105-E109 PolarHBondContact O-N 3.48Å |
| 106 | Q | 85.3 | Confident | 80.2 | Confident | 88 Ų | 88 | 85.7 Ų | 85.7 | 41% | 0.411 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -64.4 | -38.2 | 176.3 | -75.5 | 162.6 | -21.9 | 0 | 0 | 112 | R102 T103 E109 D110 | R102-Q106 HydrophobicContact CB-CB 4.24Å; T103-Q106 WeakPolarHBondContact O-CB 3.35Å; T103-Q106 PolarHBondContact O-N 3.37Å; T103-Q106 WeakPolarHBondContact OG1-CB 3.48Å; T103-Q106 VanDerWaalsContact OG1-CD 3.23Å; T103-Q106 VanDerWaalsContact OG1-CG 3.24Å; T103-Q106 WeakPolarHBondContact OG1-CG 3.47Å; T103-Q106 PolarHBondContact OG1-N 3.15Å; T103-Q106 PolarHBondContact OG1-OE1 3.2Å; Q106-E109 PolarHBondContact O-N 3.48Å; Q106-D110 WeakPolarHBondContact O-CB 3.36Å; Q106-D110 VanDerWaalsContact O-CG 3.31Å; Q106-D110 PolarHBondContact O-N 2.97Å |
| 107 | K | 89.5 | Confident | 82.2 | Confident | 73 Ų | 73 | 81.7 Ų | 81.7 | 32% | 0.317 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -62 | -44.8 | 176.4 | -70.3 | 178.1 | -176.6 | 179.3 | 0 | 111.7 | D100 R102 T103 E104 A105 E109 D110 E111 | D100-K107 VanDerWaalsContact OD2-CE 3.24Å; D100-K107 WeakPolarHBondContact OD2-CE 3.36Å; D100-K107 IonicContact OD2-NZ 3.29Å; R102-K107 HydrophobicContact CB-CG 3.97Å; R102-K107 VanDerWaalsContact O-CE 3.24Å; R102-K107 WeakPolarHBondContact O-CE 3.41Å; T103-K107 WeakPolarHBondContact O-CG 3.49Å; T103-K107 PolarHBondContact O-N 3.34Å; E104-K107 PolarHBondContact O-N 3.29Å; A105-K107 VanDerWaalsContact C-N 3.35Å; A105-K107 PolarHBondContact O-N 3.07Å; K107-E109 VanDerWaalsContact C-N 3.34Å; K107-D110 PolarHBondContact O-N 2.91Å; K107-E111 WeakPolarHBondContact O-CB 3.41Å; K107-E111 PolarHBondContact O-N 3.39Å |
| 108 | K | 89.6 | Confident | 84.2 | Confident | 59 Ų | 59 | 82.9 Ų | 82.9 | 26% | 0.257 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -64.2 | -40.1 | 175.2 | -71.4 | 178 | -178.3 | -179 | 0 | 112 | E104 A105 E111 I112 | E104-K108 WeakPolarHBondContact O-CG 3.37Å; E104-K108 PolarHBondContact O-N 3.29Å; E104-K108 VanDerWaalsContact O-N 3.12Å; E104-K108 VanDerWaalsContact OE1-CE 3.32Å; E104-K108 WeakPolarHBondContact OE1-CE 3.46Å; A105-K108 PolarHBondContact O-N 3.29Å; K108-E111 PolarHBondContact O-N 3.31Å; K108-I112 WeakPolarHBondContact O-CD1 3.35Å; K108-I112 VanDerWaalsContact O-CG1 3.23Å; K108-I112 WeakPolarHBondContact O-CG1 3.38Å; K108-I112 PolarHBondContact O-N 3.2Å |
| 109 | E | 88.6 | Confident | 85.8 | Confident | 69 Ų | 69 | 73.9 Ų | 73.9 | 32% | 0.322 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -63.5 | -46.6 | 176.3 | -172.1 | 171.8 | -155.9 | 0 | 0 | 111.7 | F36 A105 Q106 K107 E111 I112 I113 | F36-E109 HydrophobicContact CE1-CG 3.65Å; F36-E109 VanDerWaalsContact CE1-OE1 3.28Å; F36-E109 WeakPolarHBondContact CE1-OE1 3.45Å; F36-E109 HydrophobicContact CZ-CG 4.25Å; A105-E109 WeakPolarHBondContact O-CB 3.43Å; A105-E109 PolarHBondContact O-N 3.48Å; Q106-E109 PolarHBondContact O-N 3.48Å; K107-E109 VanDerWaalsContact C-N 3.34Å; E109-E111 VanDerWaalsContact C-N 3.28Å; E109-E111 PolarHBondContact O-N 2.95Å; E109-I112 WeakPolarHBondContact O-CB 3.44Å; E109-I112 PolarHBondContact O-N 2.92Å; E109-I113 HydrophobicContact CG-CD1 4.48Å; E109-I113 VanDerWaalsContact O-CG1 3.24Å; E109-I113 WeakPolarHBondContact O-CG1 3.45Å; E109-I113 PolarHBondContact O-N 3.28Å |
| 110 | D | 90 | Very high | 86.7 | Confident | 54 Ų | 54 | 69.1 Ų | 69.1 | 29% | 0.289 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -58.4 | -39.8 | 174.5 | -75 | -22.2 | 0 | 0 | 0 | 112.2 | R102 Q106 K107 I113 L114 | R102-D110 VanDerWaalsContact CD-OD2 3.3Å; R102-D110 WeakPolarHBondContact CD-OD2 3.45Å; R102-D110 IonicContact CZ-OD2 2.7Å; R102-D110 IonicContact NE-OD2 2.68Å; R102-D110 IonicContact NH1-OD2 3.81Å; R102-D110 PolarHBondContact NH1-OD2 2.98Å; Q106-D110 WeakPolarHBondContact O-CB 3.36Å; Q106-D110 VanDerWaalsContact O-CG 3.31Å; Q106-D110 PolarHBondContact O-N 2.97Å; K107-D110 PolarHBondContact O-N 2.91Å; D110-I113 PolarHBondContact O-N 3.48Å; D110-L114 WeakPolarHBondContact O-CB 3.47Å; D110-L114 PolarHBondContact O-N 3.4Å |
| 111 | E | 94.5 | Very high | 87.3 | Confident | 97 Ų | 97 | 70 Ų | 70 | 45% | 0.453 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -65.9 | -45.1 | 176.1 | -172.1 | 176.5 | -172.5 | 0 | 0 | 111.9 | K107 K108 E109 I113 L114 L115 L141 | K107-E111 WeakPolarHBondContact O-CB 3.41Å; K107-E111 PolarHBondContact O-N 3.39Å; K108-E111 PolarHBondContact O-N 3.31Å; E109-E111 VanDerWaalsContact C-N 3.28Å; E109-E111 PolarHBondContact O-N 2.95Å; E111-I113 VanDerWaalsContact C-N 3.33Å; E111-I113 PolarHBondContact O-N 3.29Å; E111-L114 WeakPolarHBondContact O-CB 3.37Å; E111-L114 PolarHBondContact O-N 3.33Å; E111-L115 HydrophobicContact CG-CD1 4.33Å; E111-L115 WeakPolarHBondContact O-CG 3.37Å; E111-L115 PolarHBondContact O-N 3.4Å; E111-L141 HydrophobicContact CB-CD1 4.32Å; E111-L141 VanDerWaalsContact CD-CD1 3.49Å; E111-L141 HydrophobicContact CG-CD1 3.71Å |
| 112 | I | 91.6 | Very high | 87.8 | Confident | 4 Ų | 4 | 64.1 Ų | 64.1 | 2% | 0.021 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -57 | -48.2 | 174.1 | -69.5 | 161.2 | 0 | 0 | 0 | 110.1 | K108 E109 L114 L115 L116 L141 A142 A150 | K108-I112 WeakPolarHBondContact O-CD1 3.35Å; K108-I112 VanDerWaalsContact O-CG1 3.23Å; K108-I112 WeakPolarHBondContact O-CG1 3.38Å; K108-I112 PolarHBondContact O-N 3.2Å; E109-I112 WeakPolarHBondContact O-CB 3.44Å; E109-I112 PolarHBondContact O-N 2.92Å; I112-L114 VanDerWaalsContact C-N 3.3Å; I112-L114 PolarHBondContact O-N 2.67Å; I112-L115 PolarHBondContact O-N 3.48Å; I112-L116 HydrophobicContact CG2-CD1 3.65Å; I112-L116 HydrophobicContact CG2-CG 4.24Å; I112-L116 VanDerWaalsContact O-CG 3.23Å; I112-L116 WeakPolarHBondContact O-CG 3.49Å; I112-L116 PolarHBondContact O-N 3.02Å; I112-L141 HydrophobicContact CD1-CB 4.04Å; I112-L141 HydrophobicContact CG1-CB 3.6Å; I112-L141 HydrophobicContact CG1-CD1 4.39Å; I112-A142 HydrophobicContact CD1-CB 4.21Å; I112-A150 HydrophobicContact CG2-CB 4.04Å |
| 113 | I | 89.3 | Confident | 87.6 | Confident | 22 Ų | 22 | 60.9 Ų | 60.9 | 11% | 0.113 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -57.2 | -45.7 | 177.5 | -64.2 | 162.8 | 0 | 0 | 0 | 111 | F36 E109 D110 E111 L115 L116 K117 | F36-I113 HydrophobicContact CD1-CD1 3.26Å; F36-I113 HydrophobicContact CD1-CG1 4.11Å; F36-I113 HydrophobicContact CD2-CD1 4.03Å; F36-I113 HydrophobicContact CD2-CG1 4.17Å; F36-I113 HydrophobicContact CE1-CD1 3.07Å; F36-I113 HydrophobicContact CE1-CG1 3.54Å; F36-I113 HydrophobicContact CE2-CD1 3.82Å; F36-I113 HydrophobicContact CE2-CG1 3.55Å; F36-I113 HydrophobicContact CG-CD1 3.77Å; F36-I113 HydrophobicContact CG-CG1 4.41Å; F36-I113 HydrophobicContact CZ-CD1 3.36Å; F36-I113 HydrophobicContact CZ-CG1 3.21Å; E109-I113 HydrophobicContact CG-CD1 4.48Å; E109-I113 VanDerWaalsContact O-CG1 3.24Å; E109-I113 WeakPolarHBondContact O-CG1 3.45Å; E109-I113 PolarHBondContact O-N 3.28Å; D110-I113 PolarHBondContact O-N 3.48Å; E111-I113 VanDerWaalsContact C-N 3.33Å; E111-I113 PolarHBondContact O-N 3.29Å; I113-L115 VanDerWaalsContact C-N 3.34Å; I113-L115 PolarHBondContact O-N 3.39Å; I113-L116 PolarHBondContact O-N 3.4Å; I113-K117 HydrophobicContact CG2-CD 3.9Å; I113-K117 VanDerWaalsContact CG2-CE 3.48Å; I113-K117 HydrophobicContact CG2-CG 4.35Å; I113-K117 WeakPolarHBondContact O-CB 3.47Å; I113-K117 VanDerWaalsContact O-CG 3.32Å; I113-K117 WeakPolarHBondContact O-CG 3.45Å; I113-K117 PolarHBondContact O-N 2.66Å |
| 114 | L | 91.9 | Very high | 87.1 | Confident | 82 Ų | 82 | 64.1 Ų | 64.1 | 43% | 0.429 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -61.4 | -44.2 | -179.6 | 179 | 62.1 | 0 | 0 | 0 | 111.2 | D110 E111 I112 K117 R118 | D110-L114 WeakPolarHBondContact O-CB 3.47Å; D110-L114 PolarHBondContact O-N 3.4Å; E111-L114 WeakPolarHBondContact O-CB 3.37Å; E111-L114 PolarHBondContact O-N 3.33Å; I112-L114 VanDerWaalsContact C-N 3.3Å; I112-L114 PolarHBondContact O-N 2.67Å; L114-K117 PolarHBondContact O-N 2.93Å; L114-R118 WeakPolarHBondContact O-CG 3.38Å; L114-R118 PolarHBondContact O-N 3.32Å |
| 115 | L | 95.9 | Very high | 86.8 | Confident | 7 Ų | 7 | 67 Ų | 67 | 4% | 0.037 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -63.1 | -45.3 | 176.7 | -70.2 | 168 | 0 | 0 | 0 | 111.7 | E111 I112 I113 K117 R118 A119 F134 Q137 A138 L141 | E111-L115 HydrophobicContact CG-CD1 4.33Å; E111-L115 WeakPolarHBondContact O-CG 3.37Å; E111-L115 PolarHBondContact O-N 3.4Å; I112-L115 PolarHBondContact O-N 3.48Å; I113-L115 VanDerWaalsContact C-N 3.34Å; I113-L115 PolarHBondContact O-N 3.39Å; L115-K117 VanDerWaalsContact C-N 3.34Å; L115-K117 PolarHBondContact O-N 3.1Å; L115-R118 PolarHBondContact O-N 2.62Å; L115-A119 WeakPolarHBondContact O-CB 3.48Å; L115-A119 PolarHBondContact O-N 3.42Å; L115-F134 HydrophobicContact CD2-CD1 3.95Å; L115-Q137 HydrophobicContact CD1-CB 3.78Å; L115-Q137 HydrophobicContact CD2-CB 4.13Å; L115-A138 HydrophobicContact CB-CB 3.92Å; L115-A138 HydrophobicContact CD1-CB 4.33Å; L115-L141 HydrophobicContact CD1-CD1 3.64Å |
| 116 | L | 87.2 | Confident | 86.6 | Confident | 13 Ų | 13 | 66.4 Ų | 66.4 | 7% | 0.068 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -62.4 | -40.2 | 177.3 | -66 | 167.9 | 0 | 0 | 0 | 112 | I112 I113 A119 K120 L135 A138 Y153 T154 L157 | I112-L116 HydrophobicContact CG2-CD1 3.65Å; I112-L116 HydrophobicContact CG2-CG 4.24Å; I112-L116 VanDerWaalsContact O-CG 3.23Å; I112-L116 WeakPolarHBondContact O-CG 3.49Å; I112-L116 PolarHBondContact O-N 3.02Å; I113-L116 PolarHBondContact O-N 3.4Å; L116-A119 PolarHBondContact O-N 2.97Å; L116-K120 WeakPolarHBondContact O-CB 3.32Å; L116-K120 PolarHBondContact O-N 3.42Å; L116-L135 HydrophobicContact CD2-CD2 4.04Å; L116-A138 HydrophobicContact CD2-CB 3.94Å; L116-A138 HydrophobicContact CG-CB 4.15Å; L116-Y153 HydrophobicContact CB-CE1 4.36Å; L116-Y153 HydrophobicContact CD1-CD1 3.69Å; L116-Y153 HydrophobicContact CD1-CE1 3.94Å; L116-Y153 HydrophobicContact CD2-CD1 4.05Å; L116-Y153 HydrophobicContact CD2-CE1 4.19Å; L116-Y153 HydrophobicContact CG-CD1 4.4Å; L116-Y153 HydrophobicContact CG-CE1 4.4Å; L116-T154 HydrophobicContact CD2-CG2 4.05Å; L116-T154 WeakPolarHBondContact CD2-OG1 3.48Å; L116-L157 HydrophobicContact CD2-CD1 3.89Å |
| 117 | K | 86 | Confident | 86.7 | Confident | 108 Ų | 108 | 67.1 Ų | 67.1 | 47% | 0.47 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -63 | -43.8 | 174.1 | -75.9 | 175.2 | 179 | 173.2 | 0 | 111.7 | I113 L114 L115 K120 L121 | I113-K117 HydrophobicContact CG2-CD 3.9Å; I113-K117 VanDerWaalsContact CG2-CE 3.48Å; I113-K117 HydrophobicContact CG2-CG 4.35Å; I113-K117 WeakPolarHBondContact O-CB 3.47Å; I113-K117 VanDerWaalsContact O-CG 3.32Å; I113-K117 WeakPolarHBondContact O-CG 3.45Å; I113-K117 PolarHBondContact O-N 2.66Å; L114-K117 PolarHBondContact O-N 2.93Å; L115-K117 VanDerWaalsContact C-N 3.34Å; L115-K117 PolarHBondContact O-N 3.1Å; K117-K120 PolarHBondContact O-N 3.1Å; K117-L121 WeakPolarHBondContact O-CB 3.46Å; K117-L121 WeakPolarHBondContact O-CG 3.15Å; K117-L121 PolarHBondContact O-N 3.37Å |
| 118 | R | 91.1 | Very high | 86.4 | Confident | 120 Ų | 120 | 65.7 Ų | 65.7 | 45% | 0.453 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -62.7 | -44.8 | 175.7 | -74.6 | 176.4 | 175.8 | 178.2 | -0.1 | 111.5 | L114 L115 K120 L121 S122 F134 | L114-R118 WeakPolarHBondContact O-CG 3.38Å; L114-R118 PolarHBondContact O-N 3.32Å; L115-R118 PolarHBondContact O-N 2.62Å; R118-K120 PolarHBondContact O-N 3.38Å; R118-L121 PolarHBondContact O-N 3Å; R118-S122 WeakPolarHBondContact O-CB 3.32Å; R118-S122 PolarHBondContact O-N 2.74Å; R118-S122 PolarHBondContact O-OG 2.91Å; R118-F134 HydrophobicContact CB-CD1 4.04Å; R118-F134 HydrophobicContact CB-CD2 3.78Å; R118-F134 HydrophobicContact CB-CE1 4.13Å; R118-F134 HydrophobicContact CB-CE2 3.87Å; R118-F134 HydrophobicContact CB-CG 3.88Å; R118-F134 HydrophobicContact CB-CZ 4.05Å |
| 119 | A | 88 | Confident | 86.1 | Confident | 0 Ų | 0 | 70.6 Ų | 70.6 | 0% | 0 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -56.2 | -51.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | L115 L116 L121 S122 I123 F134 L135 | L115-A119 WeakPolarHBondContact O-CB 3.48Å; L115-A119 PolarHBondContact O-N 3.42Å; L116-A119 PolarHBondContact O-N 2.97Å; A119-L121 PolarHBondContact O-N 3.32Å; A119-S122 PolarHBondContact O-N 3Å; A119-S122 VanDerWaalsContact O-N 3.15Å; A119-I123 WeakPolarHBondContact O-CG1 3.09Å; A119-I123 PolarHBondContact O-N 3.18Å; A119-F134 HydrophobicContact CB-CB 3.86Å; A119-L135 HydrophobicContact CB-CD1 4.47Å; A119-L135 HydrophobicContact CB-CD2 3.6Å; A119-L135 HydrophobicContact CB-CG 3.68Å |
| 120 | K | 80.4 | Confident | 86 | Confident | 79 Ų | 79 | 69.1 Ų | 69.1 | 34% | 0.343 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -59 | -44.7 | 179.1 | -171 | 171.5 | -176.3 | 170.6 | 0 | 111.9 | L116 K117 R118 S122 I123 M124 | L116-K120 WeakPolarHBondContact O-CB 3.32Å; L116-K120 PolarHBondContact O-N 3.42Å; K117-K120 PolarHBondContact O-N 3.1Å; R118-K120 PolarHBondContact O-N 3.38Å; K120-S122 PolarHBondContact O-N 2.92Å; K120-I123 PolarHBondContact O-N 3Å; K120-M124 HydrophobicContact CG-SD 4.41Å; K120-M124 VanDerWaalsContact O-CG 3.3Å; K120-M124 WeakPolarHBondContact O-CG 3.46Å; K120-M124 PolarHBondContact O-N 2.85Å |
| 121 | L | 81.8 | Confident | 86 | Confident | 90 Ų | 90 | 66.5 Ų | 66.5 | 47% | 0.471 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -63 | -40.1 | 176.1 | -75.8 | 169.9 | 0 | 0 | 0 | 112.6 | K117 R118 A119 M124 R125 | K117-L121 WeakPolarHBondContact O-CB 3.46Å; K117-L121 WeakPolarHBondContact O-CG 3.15Å; K117-L121 PolarHBondContact O-N 3.37Å; R118-L121 PolarHBondContact O-N 3Å; A119-L121 PolarHBondContact O-N 3.32Å; L121-M124 PolarHBondContact O-N 3.31Å; L121-R125 WeakPolarHBondContact O-CG 3.45Å; L121-R125 PolarHBondContact O-N 3.47Å; L121-R125 VanDerWaalsContact O-N 3.12Å |
| 122 | S | 84.7 | Confident | 85.7 | Confident | 11 Ų | 11 | 64 Ų | 64 | 8% | 0.077 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -64.2 | -41.8 | 174.8 | -73.3 | 0 | 0 | 0 | 0 | 111.8 | R118 A119 K120 R125 G126 Q127 | R118-S122 WeakPolarHBondContact O-CB 3.32Å; R118-S122 PolarHBondContact O-N 2.74Å; R118-S122 PolarHBondContact O-OG 2.91Å; A119-S122 PolarHBondContact O-N 3Å; A119-S122 VanDerWaalsContact O-N 3.15Å; K120-S122 PolarHBondContact O-N 2.92Å; S122-R125 PolarHBondContact O-N 2.96Å; S122-G126 PolarHBondContact O-N 3.17Å; S122-Q127 WeakPolarHBondContact O-CA 3.42Å; S122-Q127 WeakPolarHBondContact O-CB 3.5Å; S122-Q127 PolarHBondContact O-N 2.83Å |
| 123 | I | 78.6 | Confident | 85.9 | Confident | 41 Ų | 41 | 65.3 Ų | 65.3 | 21% | 0.21 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -59.6 | -47.9 | 174 | -66.3 | 168.7 | 0 | 0 | 0 | 110.4 | A119 K120 R125 G126 A131 L161 | A119-I123 WeakPolarHBondContact O-CG1 3.09Å; A119-I123 PolarHBondContact O-N 3.18Å; K120-I123 PolarHBondContact O-N 3Å; I123-R125 PolarHBondContact O-N 2.99Å; I123-G126 PolarHBondContact O-N 3.24Å; I123-A131 HydrophobicContact CD1-CB 4.22Å; I123-A131 HydrophobicContact CG1-CB 3.51Å; I123-L161 HydrophobicContact CD1-CB 4.5Å; I123-L161 HydrophobicContact CD1-CD1 4.39Å; I123-L161 HydrophobicContact CD1-CD2 4.36Å; I123-L161 HydrophobicContact CG1-CD1 4.17Å |
| 124 | M | 75.8 | Confident | 86.2 | Confident | 143 Ų | 143 | 66.8 Ų | 66.8 | 70% | 0.704 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -60.5 | -26.5 | 178.4 | -70.1 | 174.4 | 71.4 | 0 | 0 | 113.3 | K120 L121 G126 | K120-M124 HydrophobicContact CG-SD 4.41Å; K120-M124 VanDerWaalsContact O-CG 3.3Å; K120-M124 WeakPolarHBondContact O-CG 3.46Å; K120-M124 PolarHBondContact O-N 2.85Å; L121-M124 PolarHBondContact O-N 3.31Å; M124-G126 VanDerWaalsContact C-N 3.34Å |
| 125 | R | 80.3 | Confident | 86.4 | Confident | 180 Ų | 180 | 62.9 Ų | 62.9 | 68% | 0.679 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89 | 3 | 176.1 | -69.4 | 172.8 | 176.8 | 177 | -1.1 | 113.5 | L121 S122 I123 Q127 | L121-R125 WeakPolarHBondContact O-CG 3.45Å; L121-R125 PolarHBondContact O-N 3.47Å; L121-R125 VanDerWaalsContact O-N 3.12Å; S122-R125 PolarHBondContact O-N 2.96Å; I123-R125 PolarHBondContact O-N 2.99Å; R125-Q127 HydrophobicContact CB-CG 4.09Å; R125-Q127 PolarHBondContact O-N 3.27Å |
| 126 | G | 78.1 | Confident | 86.4 | Confident | 54 Ų | 54 | 67.6 Ų | 67.6 | 56% | 0.557 | 34% | 0.342 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 72 | 9.3 | -173.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | S122 I123 M124 L128 | S122-G126 PolarHBondContact O-N 3.17Å; I123-G126 PolarHBondContact O-N 3.24Å; M124-G126 VanDerWaalsContact C-N 3.34Å; G126-L128 PolarHBondContact O-N 2.88Å |
| 127 | Q | 87.4 | Confident | 86.9 | Confident | 103 Ų | 103 | 72 Ų | 72 | 48% | 0.481 | 36% | 0.362 | S | S | . | . | trans | -85.1 | 62.8 | -179.4 | -62.8 | 177.3 | -27.5 | 0 | 0 | 110.8 | S122 R125 H129 G130 A131 | S122-Q127 WeakPolarHBondContact O-CA 3.42Å; S122-Q127 WeakPolarHBondContact O-CB 3.5Å; S122-Q127 PolarHBondContact O-N 2.83Å; R125-Q127 HydrophobicContact CB-CG 4.09Å; R125-Q127 PolarHBondContact O-N 3.27Å; Q127-H129 VanDerWaalsContact C-N 3.34Å; Q127-H129 PolarHBondContact O-N 3.39Å; Q127-G130 PolarHBondContact O-N 3.33Å; Q127-A131 PolarHBondContact O-N 3.43Å; Q127-A131 VanDerWaalsContact O-N 3.08Å | ||
| 128 | L | 83.3 | Confident | 87.4 | Confident | 44 Ų | 44 | 66.9 Ų | 66.9 | 23% | 0.23 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -61.1 | -39.4 | -169.9 | -54.5 | -173.6 | 0 | 0 | 0 | 113 | G126 A131 N132 L161 V164 Q165 | G126-L128 PolarHBondContact O-N 2.88Å; L128-A131 WeakPolarHBondContact O-CB 3.39Å; L128-A131 PolarHBondContact O-N 3.13Å; L128-N132 PolarHBondContact O-N 3.03Å; L128-L161 HydrophobicContact CB-CD1 4.06Å; L128-L161 HydrophobicContact CD2-CD1 3.75Å; L128-L161 HydrophobicContact CG-CD1 4.33Å; L128-V164 HydrophobicContact CD1-CG1 4.45Å; L128-Q165 HydrophobicContact CD1-CG 3.83Å |
| 129 | H | 84.5 | Confident | 87.7 | Confident | 161 Ų | 161 | 61.9 Ų | 61.9 | 75% | 0.745 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -67.5 | -39.1 | 178.6 | -71.1 | 33 | 0 | 0 | 0 | 112.4 | Q127 A131 N132 | Q127-H129 VanDerWaalsContact C-N 3.34Å; Q127-H129 PolarHBondContact O-N 3.39Å; H129-A131 VanDerWaalsContact C-N 3.3Å; H129-A131 PolarHBondContact O-N 3.13Å; H129-N132 PolarHBondContact O-N 2.77Å |
| 130 | G | 86.6 | Confident | 88.2 | Confident | 38 Ų | 38 | 64.1 Ų | 64.1 | 39% | 0.392 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -64.8 | -36.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112 | Q127 G133 F134 | Q127-G130 PolarHBondContact O-N 3.33Å; G130-G133 PolarHBondContact O-N 3.12Å; G130-F134 WeakPolarHBondContact O-CD2 3.45Å; G130-F134 PolarHBondContact O-N 3.11Å |
| 131 | A | 88.3 | Confident | 88.9 | Confident | 0 Ų | 0 | 61.6 Ų | 61.6 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -62.7 | -41.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | I123 Q127 L128 H129 G133 F134 L135 L161 | I123-A131 HydrophobicContact CD1-CB 4.22Å; I123-A131 HydrophobicContact CG1-CB 3.51Å; Q127-A131 PolarHBondContact O-N 3.43Å; Q127-A131 VanDerWaalsContact O-N 3.08Å; L128-A131 WeakPolarHBondContact O-CB 3.39Å; L128-A131 PolarHBondContact O-N 3.13Å; H129-A131 VanDerWaalsContact C-N 3.3Å; H129-A131 PolarHBondContact O-N 3.13Å; A131-G133 VanDerWaalsContact C-N 3.3Å; A131-G133 PolarHBondContact O-N 3.27Å; A131-F134 PolarHBondContact O-N 2.84Å; A131-L135 WeakPolarHBondContact O-CG 3.46Å; A131-L135 PolarHBondContact O-N 3.16Å; A131-L161 HydrophobicContact CB-CD2 3.9Å |
| 132 | N | 90.1 | Very high | 89.6 | Confident | 43 Ų | 43 | 57.3 Ų | 57.3 | 23% | 0.23 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -56.2 | -43.6 | 177.1 | -88.2 | -20.2 | 0 | 0 | 0 | 112.1 | L128 H129 F134 L135 H136 L161 | L128-N132 PolarHBondContact O-N 3.03Å; H129-N132 PolarHBondContact O-N 2.77Å; N132-F134 VanDerWaalsContact C-N 3.35Å; N132-F134 PolarHBondContact O-N 3.02Å; N132-L135 PolarHBondContact O-N 3.22Å; N132-H136 PolarHBondContact O-CD2 3.25Å; N132-H136 PolarHBondContact O-N 2.97Å; N132-L161 WeakPolarHBondContact OD1-CD2 3.21Å |
| 133 | G | 93.9 | Very high | 90.1 | Very high | 33 Ų | 33 | 60.4 Ų | 60.4 | 34% | 0.34 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -58.2 | -44.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113 | G130 A131 Q137 | G130-G133 PolarHBondContact O-N 3.12Å; A131-G133 VanDerWaalsContact C-N 3.3Å; A131-G133 PolarHBondContact O-N 3.27Å; G133-Q137 WeakPolarHBondContact O-CG 3.46Å; G133-Q137 PolarHBondContact O-N 2.79Å |
| 134 | F | 95.9 | Very high | 90.9 | Very high | 52 Ų | 52 | 64.7 Ų | 64.7 | 23% | 0.228 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -66.6 | -40.1 | 177.3 | -64.1 | -53.1 | 0 | 0 | 0 | 112.7 | L115 R118 A119 G130 A131 N132 Q137 A138 | L115-F134 HydrophobicContact CD2-CD1 3.95Å; R118-F134 HydrophobicContact CB-CD1 4.04Å; R118-F134 HydrophobicContact CB-CD2 3.78Å; R118-F134 HydrophobicContact CB-CE1 4.13Å; R118-F134 HydrophobicContact CB-CE2 3.87Å; R118-F134 HydrophobicContact CB-CG 3.88Å; R118-F134 HydrophobicContact CB-CZ 4.05Å; A119-F134 HydrophobicContact CB-CB 3.86Å; G130-F134 WeakPolarHBondContact O-CD2 3.45Å; G130-F134 PolarHBondContact O-N 3.11Å; A131-F134 PolarHBondContact O-N 2.84Å; N132-F134 VanDerWaalsContact C-N 3.35Å; N132-F134 PolarHBondContact O-N 3.02Å; F134-Q137 PolarHBondContact O-N 3.43Å; F134-A138 WeakPolarHBondContact O-CB 3.38Å; F134-A138 PolarHBondContact O-N 3.25Å |
| 135 | L | 96.4 | Very high | 91.7 | Very high | 0 Ų | 0 | 59.7 Ų | 59.7 | 0% | 0 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -67.1 | -39.8 | 179.2 | -67.7 | 172.2 | 0 | 0 | 0 | 112.3 | L116 A119 A131 N132 Q137 A138 I139 T154 L157 M158 L161 | L116-L135 HydrophobicContact CD2-CD2 4.04Å; A119-L135 HydrophobicContact CB-CD1 4.47Å; A119-L135 HydrophobicContact CB-CD2 3.6Å; A119-L135 HydrophobicContact CB-CG 3.68Å; A131-L135 WeakPolarHBondContact O-CG 3.46Å; A131-L135 PolarHBondContact O-N 3.16Å; N132-L135 PolarHBondContact O-N 3.22Å; L135-Q137 VanDerWaalsContact C-N 3.33Å; L135-Q137 PolarHBondContact O-N 3.02Å; L135-A138 PolarHBondContact O-N 2.91Å; L135-I139 WeakPolarHBondContact O-CG2 3.33Å; L135-I139 PolarHBondContact O-N 3.33Å; L135-T154 HydrophobicContact CD2-CG2 4.25Å; L135-T154 WeakPolarHBondContact O-CG2 3.29Å; L135-L157 HydrophobicContact CD1-CB 4.46Å; L135-L157 HydrophobicContact CD2-CB 3.85Å; L135-L157 HydrophobicContact CD2-CD1 4.05Å; L135-M158 HydrophobicContact CB-CG 3.67Å; L135-M158 HydrophobicContact CB-SD 4.34Å; L135-M158 HydrophobicContact CD1-CG 3.85Å; L135-M158 HydrophobicContact CG-CG 4.23Å; L135-L161 HydrophobicContact CD1-CD2 3.76Å |
| 136 | H | 96.6 | Very high | 92.3 | Very high | 107 Ų | 107 | 61.7 Ų | 61.7 | 50% | 0.495 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -64.1 | -36.2 | 175.3 | -77.1 | -61.3 | 0 | 0 | 0 | 112.9 | N132 I139 A140 M158 | N132-H136 PolarHBondContact O-CD2 3.25Å; N132-H136 PolarHBondContact O-N 2.97Å; H136-I139 VanDerWaalsContact O-CG2 3.28Å; H136-I139 WeakPolarHBondContact O-CG2 3.36Å; H136-A140 PolarHBondContact O-N 3Å; H136-M158 VanDerWaalsContact CE1-CE 3.47Å; H136-M158 WeakPolarHBondContact CE1-CE 3.34Å |
| 137 | Q | 97 | Very high | 92.9 | Very high | 106 Ų | 106 | 60.9 Ų | 60.9 | 50% | 0.495 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -68 | -44.4 | 172.8 | -68.6 | 172.1 | 25.6 | 0 | 0 | 111.1 | L115 G133 F134 L135 I139 A140 L141 | L115-Q137 HydrophobicContact CD1-CB 3.78Å; L115-Q137 HydrophobicContact CD2-CB 4.13Å; G133-Q137 WeakPolarHBondContact O-CG 3.46Å; G133-Q137 PolarHBondContact O-N 2.79Å; F134-Q137 PolarHBondContact O-N 3.43Å; L135-Q137 VanDerWaalsContact C-N 3.33Å; L135-Q137 PolarHBondContact O-N 3.02Å; Q137-I139 PolarHBondContact O-N 3.45Å; Q137-A140 PolarHBondContact O-N 3Å; Q137-L141 PolarHBondContact O-N 2.78Å; Q137-L141 VanDerWaalsContact O-N 3.11Å |
| 138 | A | 97.3 | Very high | 93.2 | Very high | 0 Ų | 0 | 58.7 Ų | 58.7 | 0% | 0 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -61 | -45 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112 | L115 L116 F134 L135 A140 L141 A142 T154 | L115-A138 HydrophobicContact CB-CB 3.92Å; L115-A138 HydrophobicContact CD1-CB 4.33Å; L116-A138 HydrophobicContact CD2-CB 3.94Å; L116-A138 HydrophobicContact CG-CB 4.15Å; F134-A138 WeakPolarHBondContact O-CB 3.38Å; F134-A138 PolarHBondContact O-N 3.25Å; L135-A138 PolarHBondContact O-N 2.91Å; A138-A140 PolarHBondContact O-N 3.28Å; A138-L141 PolarHBondContact O-N 3.32Å; A138-A142 VanDerWaalsContact O-CB 3.32Å; A138-A142 WeakPolarHBondContact O-CB 3.18Å; A138-A142 PolarHBondContact O-N 3.33Å; A138-T154 HydrophobicContact CB-CG2 4Å |
| 139 | I | 97.6 | Very high | 93.4 | Very high | 15 Ų | 15 | 60.9 Ų | 60.9 | 8% | 0.077 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -67.4 | -37.1 | -179 | -169.8 | 59.1 | 0 | 0 | 0 | 111.6 | L135 H136 Q137 A142 H143 I151 T154 Y155 M158 | L135-I139 WeakPolarHBondContact O-CG2 3.33Å; L135-I139 PolarHBondContact O-N 3.33Å; H136-I139 VanDerWaalsContact O-CG2 3.28Å; H136-I139 WeakPolarHBondContact O-CG2 3.36Å; Q137-I139 PolarHBondContact O-N 3.45Å; I139-A142 PolarHBondContact O-N 3.16Å; I139-H143 PolarHBondContact O-CD2 2.95Å; I139-H143 PolarHBondContact O-N 2.95Å; I139-I151 HydrophobicContact CD1-CB 4.3Å; I139-I151 HydrophobicContact CD1-CG1 4.33Å; I139-I151 HydrophobicContact CD1-CG2 4.06Å; I139-T154 HydrophobicContact CB-CG2 3.72Å; I139-T154 HydrophobicContact CD1-CG2 4.4Å; I139-Y155 HydrophobicContact CD1-CD1 4.36Å; I139-Y155 HydrophobicContact CD1-CD2 4.1Å; I139-Y155 HydrophobicContact CD1-CE1 4.19Å; I139-Y155 HydrophobicContact CD1-CE2 3.93Å; I139-Y155 HydrophobicContact CD1-CG 4.31Å; I139-Y155 HydrophobicContact CG1-CE1 4.12Å; I139-M158 HydrophobicContact CB-SD 4.39Å; I139-M158 HydrophobicContact CG2-SD 4.26Å |
| 140 | A | 97.3 | Very high | 93.7 | Very high | 47 Ų | 47 | 53.4 Ų | 53.4 | 39% | 0.388 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -62 | -46.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | H136 Q137 A138 H143 Q144 | H136-A140 PolarHBondContact O-N 3Å; Q137-A140 PolarHBondContact O-N 3Å; A138-A140 PolarHBondContact O-N 3.28Å; A140-H143 PolarHBondContact O-N 3.45Å; A140-Q144 VanDerWaalsContact O-CG 3.29Å; A140-Q144 WeakPolarHBondContact O-CG 3.48Å; A140-Q144 PolarHBondContact O-N 3.01Å |
| 141 | L | 95.8 | Very high | 94.1 | Very high | 26 Ų | 26 | 51.8 Ų | 51.8 | 14% | 0.136 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -65.7 | -37.2 | 175.7 | -70.9 | 174.8 | 0 | 0 | 0 | 112.5 | E111 I112 L115 Q137 A138 H143 Q144 S145 | E111-L141 HydrophobicContact CB-CD1 4.32Å; E111-L141 VanDerWaalsContact CD-CD1 3.49Å; E111-L141 HydrophobicContact CG-CD1 3.71Å; I112-L141 HydrophobicContact CD1-CB 4.04Å; I112-L141 HydrophobicContact CG1-CB 3.6Å; I112-L141 HydrophobicContact CG1-CD1 4.39Å; L115-L141 HydrophobicContact CD1-CD1 3.64Å; Q137-L141 PolarHBondContact O-N 2.78Å; Q137-L141 VanDerWaalsContact O-N 3.11Å; A138-L141 PolarHBondContact O-N 3.32Å; L141-H143 PolarHBondContact O-N 2.84Å; L141-Q144 PolarHBondContact O-N 2.94Å; L141-S145 WeakPolarHBondContact O-CB 3.5Å; L141-S145 PolarHBondContact O-N 2.87Å; L141-S145 PolarHBondContact O-OG 3.25Å |
| 142 | A | 95.9 | Very high | 94.2 | Very high | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -63 | -42 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | I112 A138 I139 S145 R146 N147 A150 I151 | I112-A142 HydrophobicContact CD1-CB 4.21Å; A138-A142 VanDerWaalsContact O-CB 3.32Å; A138-A142 WeakPolarHBondContact O-CB 3.18Å; A138-A142 PolarHBondContact O-N 3.33Å; I139-A142 PolarHBondContact O-N 3.16Å; A142-S145 PolarHBondContact O-OG 3.4Å; A142-S145 VanDerWaalsContact O-OG 3.13Å; A142-R146 PolarHBondContact O-N 3.5Å; A142-R146 VanDerWaalsContact O-N 3.09Å; A142-N147 PolarHBondContact O-N 3.35Å; A142-A150 HydrophobicContact CB-CB 3.77Å; A142-I151 HydrophobicContact CB-CG1 3.75Å |
| 143 | H | 96.3 | Very high | 94.2 | Very high | 76 Ų | 76 | 52.5 Ų | 52.5 | 35% | 0.352 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -66.1 | -44 | 172.8 | -79.3 | -65 | 0 | 0 | 0 | 112.5 | I139 A140 L141 S145 R146 I151 Y155 F181 | I139-H143 PolarHBondContact O-CD2 2.95Å; I139-H143 PolarHBondContact O-N 2.95Å; A140-H143 PolarHBondContact O-N 3.45Å; L141-H143 PolarHBondContact O-N 2.84Å; H143-S145 VanDerWaalsContact C-N 3.28Å; H143-S145 PolarHBondContact O-N 2.93Å; H143-R146 PolarHBondContact O-N 3.38Å; H143-R146 VanDerWaalsContact O-N 3.07Å; H143-I151 WeakPolarHBondContact ND1-CD1 3.49Å; H143-Y155 AromaticContact NE2-CZ 3.92Å; H143-Y155 PolarHBondContact NE2-OH 3.4Å; H143-F181 AromaticContact CE1-CZ 3.83Å |
| 144 | Q | 94.9 | Very high | 94.1 | Very high | 130 Ų | 130 | 50.9 Ų | 50.9 | 61% | 0.607 | 25% | 0.245 | S | C | * | . | H | α-helix | trans | -61.6 | -36.1 | 177.7 | -73.2 | 175.4 | 11.5 | 0 | 0 | 112.9 | A140 L141 R146 | A140-Q144 VanDerWaalsContact O-CG 3.29Å; A140-Q144 WeakPolarHBondContact O-CG 3.48Å; A140-Q144 PolarHBondContact O-N 3.01Å; L141-Q144 PolarHBondContact O-N 2.94Å; Q144-R146 VanDerWaalsContact C-N 3.32Å |
| 145 | S | 92.3 | Very high | 94.1 | Very high | 39 Ų | 39 | 50.7 Ų | 50.7 | 27% | 0.273 | 24% | 0.243 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -85.1 | -3.2 | 176.9 | 57.2 | 0 | 0 | 0 | 0 | 113.6 | L141 A142 H143 N147 | L141-S145 WeakPolarHBondContact O-CB 3.5Å; L141-S145 PolarHBondContact O-N 2.87Å; L141-S145 PolarHBondContact O-OG 3.25Å; A142-S145 PolarHBondContact O-OG 3.4Å; A142-S145 VanDerWaalsContact O-OG 3.13Å; H143-S145 VanDerWaalsContact C-N 3.28Å; H143-S145 PolarHBondContact O-N 2.93Å; S145-N147 PolarHBondContact O-N 3.09Å |
| 146 | R | 92.4 | Very high | 93.7 | Very high | 222 Ų | 222 | 50.9 Ų | 50.9 | 84% | 0.838 | 24% | 0.244 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 51.7 | 32.8 | -173.9 | -56.8 | -178.5 | 179.6 | -175.5 | -0.6 | 112.6 | A142 H143 Q144 T148 | A142-R146 PolarHBondContact O-N 3.5Å; A142-R146 VanDerWaalsContact O-N 3.09Å; H143-R146 PolarHBondContact O-N 3.38Å; H143-R146 VanDerWaalsContact O-N 3.07Å; Q144-R146 VanDerWaalsContact C-N 3.32Å; R146-T148 PolarHBondContact O-N 3.08Å |
| 147 | N | 91.8 | Very high | 93.3 | Very high | 36 Ų | 36 | 46.1 Ų | 46.1 | 19% | 0.193 | 22% | 0.222 | C | C | . | . | trans | -86.5 | 89.6 | 179.2 | -173.7 | -27.3 | 0 | 0 | 0 | 109.3 | A142 S145 Q149 A150 I151 | A142-N147 PolarHBondContact O-N 3.35Å; S145-N147 PolarHBondContact O-N 3.09Å; N147-Q149 PolarHBondContact O-N 3.48Å; N147-Q149 PolarHBondContact OD1-N 2.91Å; N147-A150 HydrophobicContact CB-CB 3.92Å; N147-A150 PolarHBondContact O-N 2.91Å; N147-A150 VanDerWaalsContact O-N 3.15Å; N147-A150 PolarHBondContact OD1-N 3Å; N147-I151 WeakPolarHBondContact O-CG1 3.47Å; N147-I151 PolarHBondContact O-N 3.1Å | ||
| 148 | T | 92.1 | Very high | 93.2 | Very high | 58 Ų | 58 | 41.8 Ų | 41.8 | 36% | 0.356 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -56.3 | -37.3 | -177.7 | -53.5 | 0 | 0 | 0 | 0 | 113 | R146 I151 I152 F181 | R146-T148 PolarHBondContact O-N 3.08Å; T148-I151 WeakPolarHBondContact O-CB 3.4Å; T148-I151 PolarHBondContact O-N 3.31Å; T148-I152 HydrophobicContact CG2-CD1 3.91Å; T148-I152 HydrophobicContact CG2-CG1 4.46Å; T148-I152 WeakPolarHBondContact O-CD1 3.46Å; T148-I152 VanDerWaalsContact O-CG1 3.29Å; T148-I152 WeakPolarHBondContact O-CG1 3.33Å; T148-I152 PolarHBondContact O-N 3.29Å; T148-F181 HydrophobicContact CG2-CB 4.37Å; T148-F181 HydrophobicContact CG2-CD1 4.11Å |
| 149 | Q | 89.4 | Confident | 92.8 | Very high | 90 Ų | 90 | 41.8 Ų | 41.8 | 42% | 0.421 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -64.3 | -49.2 | 177.6 | -64.8 | -58.3 | -35.8 | 0 | 0 | 110.6 | F34 N147 I151 I152 Y153 | F34-Q149 HydrophobicContact CE1-CB 4.19Å; F34-Q149 HydrophobicContact CZ-CB 3.9Å; F34-Q149 WeakPolarHBondContact CZ-O 2.98Å; N147-Q149 PolarHBondContact O-N 3.48Å; N147-Q149 PolarHBondContact OD1-N 2.91Å; Q149-I151 VanDerWaalsContact C-N 3.26Å; Q149-I151 PolarHBondContact O-N 3.49Å; Q149-I152 PolarHBondContact O-N 3.18Å; Q149-Y153 WeakPolarHBondContact O-CB 3.3Å; Q149-Y153 PolarHBondContact O-N 3.25Å |
| 150 | A | 90.6 | Very high | 92.2 | Very high | 3 Ų | 3 | 42.1 Ų | 42.1 | 3% | 0.025 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -60.1 | -36.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | I112 A142 N147 T154 | I112-A150 HydrophobicContact CG2-CB 4.04Å; A142-A150 HydrophobicContact CB-CB 3.77Å; N147-A150 HydrophobicContact CB-CB 3.92Å; N147-A150 PolarHBondContact O-N 2.91Å; N147-A150 VanDerWaalsContact O-N 3.15Å; N147-A150 PolarHBondContact OD1-N 3Å; A150-T154 VanDerWaalsContact O-CB 3.27Å; A150-T154 WeakPolarHBondContact O-CB 3.3Å; A150-T154 PolarHBondContact O-N 3.29Å; A150-T154 PolarHBondContact O-OG1 3.05Å |
| 151 | I | 94.6 | Very high | 91.7 | Very high | 5 Ų | 5 | 40 Ų | 40 | 3% | 0.026 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -60.9 | -53.5 | 174.4 | -69 | 166 | 0 | 0 | 0 | 110.6 | I139 A142 H143 N147 T148 Q149 Y153 T154 Y155 F181 | I139-I151 HydrophobicContact CD1-CB 4.3Å; I139-I151 HydrophobicContact CD1-CG1 4.33Å; I139-I151 HydrophobicContact CD1-CG2 4.06Å; A142-I151 HydrophobicContact CB-CG1 3.75Å; H143-I151 WeakPolarHBondContact ND1-CD1 3.49Å; N147-I151 WeakPolarHBondContact O-CG1 3.47Å; N147-I151 PolarHBondContact O-N 3.1Å; T148-I151 WeakPolarHBondContact O-CB 3.4Å; T148-I151 PolarHBondContact O-N 3.31Å; Q149-I151 VanDerWaalsContact C-N 3.26Å; Q149-I151 PolarHBondContact O-N 3.49Å; I151-Y153 VanDerWaalsContact C-N 3.34Å; I151-Y153 PolarHBondContact O-N 3.42Å; I151-T154 PolarHBondContact O-N 2.97Å; I151-Y155 HydrophobicContact CG2-CD2 3.63Å; I151-Y155 HydrophobicContact CG2-CE2 3.5Å; I151-Y155 WeakPolarHBondContact O-CD2 3.29Å; I151-Y155 PolarHBondContact O-N 3.18Å; I151-F181 HydrophobicContact CD1-CE1 4.39Å; I151-F181 HydrophobicContact CG2-CD1 4.16Å; I151-F181 HydrophobicContact CG2-CD2 3.72Å; I151-F181 HydrophobicContact CG2-CE1 4.13Å; I151-F181 HydrophobicContact CG2-CE2 3.73Å; I151-F181 HydrophobicContact CG2-CG 3.97Å; I151-F181 HydrophobicContact CG2-CZ 3.93Å |
| 152 | I | 90.1 | Very high | 91.3 | Very high | 4 Ų | 4 | 38.9 Ų | 38.9 | 2% | 0.021 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -57.7 | -48 | -179.9 | -67.5 | 159.6 | 0 | 0 | 0 | 110.4 | T148 Q149 Y155 S156 A178 F181 M182 | T148-I152 HydrophobicContact CG2-CD1 3.91Å; T148-I152 HydrophobicContact CG2-CG1 4.46Å; T148-I152 WeakPolarHBondContact O-CD1 3.46Å; T148-I152 VanDerWaalsContact O-CG1 3.29Å; T148-I152 WeakPolarHBondContact O-CG1 3.33Å; T148-I152 PolarHBondContact O-N 3.29Å; Q149-I152 PolarHBondContact O-N 3.18Å; I152-Y155 PolarHBondContact O-N 3.01Å; I152-S156 WeakPolarHBondContact O-CB 3.49Å; I152-S156 PolarHBondContact O-N 2.86Å; I152-S156 PolarHBondContact O-OG 3.05Å; I152-A178 HydrophobicContact CG2-CB 4.42Å; I152-F181 HydrophobicContact CD1-CB 4.1Å; I152-F181 HydrophobicContact CG1-CB 3.54Å; I152-M182 HydrophobicContact CD1-CG 3.73Å; I152-M182 HydrophobicContact CG1-CG 4.09Å; I152-M182 HydrophobicContact CG2-CG 3.84Å; I152-M182 HydrophobicContact CG2-SD 4.08Å |
| 153 | Y | 89.1 | Confident | 90.7 | Very high | 53 Ų | 53 | 41.8 Ų | 41.8 | 21% | 0.208 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -64.9 | -43.5 | -178.5 | -174.7 | -102.3 | 0 | 0 | 0 | 112.5 | L30 F34 L116 Q149 I151 S156 L157 | L30-Y153 HydrophobicContact CB-CD2 4.41Å; F34-Y153 HydrophobicContact CD2-CD2 4.23Å; F34-Y153 AromaticContact CE2-CD2 3.77Å; F34-Y153 HydrophobicContact CE2-CD2 3.77Å; F34-Y153 AromaticContact CE2-CG 3.75Å; F34-Y153 HydrophobicContact CE2-CG 3.75Å; F34-Y153 VanDerWaalsContact CZ-CB 3.47Å; F34-Y153 HydrophobicContact CZ-CD2 4.41Å; F34-Y153 AromaticContact CZ-CG 3.93Å; F34-Y153 HydrophobicContact CZ-CG 3.93Å; L116-Y153 HydrophobicContact CB-CE1 4.36Å; L116-Y153 HydrophobicContact CD1-CD1 3.69Å; L116-Y153 HydrophobicContact CD1-CE1 3.94Å; L116-Y153 HydrophobicContact CD2-CD1 4.05Å; L116-Y153 HydrophobicContact CD2-CE1 4.19Å; L116-Y153 HydrophobicContact CG-CD1 4.4Å; L116-Y153 HydrophobicContact CG-CE1 4.4Å; Q149-Y153 WeakPolarHBondContact O-CB 3.3Å; Q149-Y153 PolarHBondContact O-N 3.25Å; I151-Y153 VanDerWaalsContact C-N 3.34Å; I151-Y153 PolarHBondContact O-N 3.42Å; Y153-S156 PolarHBondContact O-N 2.94Å; Y153-L157 HydrophobicContact CD1-CD1 3.97Å; Y153-L157 HydrophobicContact CD1-CG 4.41Å; Y153-L157 HydrophobicContact CE1-CD1 3.35Å; Y153-L157 HydrophobicContact CE1-CG 4.01Å; Y153-L157 PolarHBondContact O-N 3.38Å |
| 154 | T | 92.2 | Very high | 89.9 | Confident | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -66.3 | -43.7 | 179.7 | -50.9 | 0 | 0 | 0 | 0 | 110.9 | L116 L135 A138 I139 A150 I151 S156 L157 M158 | L116-T154 HydrophobicContact CD2-CG2 4.05Å; L116-T154 WeakPolarHBondContact CD2-OG1 3.48Å; L135-T154 HydrophobicContact CD2-CG2 4.25Å; L135-T154 WeakPolarHBondContact O-CG2 3.29Å; A138-T154 HydrophobicContact CB-CG2 4Å; I139-T154 HydrophobicContact CB-CG2 3.72Å; I139-T154 HydrophobicContact CD1-CG2 4.4Å; A150-T154 VanDerWaalsContact O-CB 3.27Å; A150-T154 WeakPolarHBondContact O-CB 3.3Å; A150-T154 PolarHBondContact O-N 3.29Å; A150-T154 PolarHBondContact O-OG1 3.05Å; I151-T154 PolarHBondContact O-N 2.97Å; T154-S156 VanDerWaalsContact C-N 3.32Å; T154-S156 PolarHBondContact O-N 3.14Å; T154-L157 PolarHBondContact O-N 3.34Å; T154-M158 HydrophobicContact CG2-SD 4.22Å; T154-M158 VanDerWaalsContact O-CG 3.28Å; T154-M158 WeakPolarHBondContact O-CG 3.45Å; T154-M158 PolarHBondContact O-N 3.35Å |
| 155 | Y | 96.9 | Very high | 89.3 | Confident | 47 Ų | 47 | 36.5 Ų | 36.5 | 18% | 0.184 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -59.9 | -42.3 | 173.2 | -80.7 | -48.8 | 0 | 0 | 0 | 112.3 | I139 H143 I151 I152 L157 M158 A159 L174 A177 F181 | I139-Y155 HydrophobicContact CD1-CD1 4.36Å; I139-Y155 HydrophobicContact CD1-CD2 4.1Å; I139-Y155 HydrophobicContact CD1-CE1 4.19Å; I139-Y155 HydrophobicContact CD1-CE2 3.93Å; I139-Y155 HydrophobicContact CD1-CG 4.31Å; I139-Y155 HydrophobicContact CG1-CE1 4.12Å; H143-Y155 AromaticContact NE2-CZ 3.92Å; H143-Y155 PolarHBondContact NE2-OH 3.4Å; I151-Y155 HydrophobicContact CG2-CD2 3.63Å; I151-Y155 HydrophobicContact CG2-CE2 3.5Å; I151-Y155 WeakPolarHBondContact O-CD2 3.29Å; I151-Y155 PolarHBondContact O-N 3.18Å; I152-Y155 PolarHBondContact O-N 3.01Å; Y155-L157 VanDerWaalsContact C-N 3.34Å; Y155-L157 PolarHBondContact O-N 3.24Å; Y155-M158 HydrophobicContact CD1-SD 4.46Å; Y155-M158 PolarHBondContact O-N 2.98Å; Y155-A159 WeakPolarHBondContact O-CB 3.33Å; Y155-A159 PolarHBondContact O-N 3.47Å; Y155-L174 HydrophobicContact CD1-CD2 3.69Å; Y155-L174 HydrophobicContact CE1-CD2 4.12Å; Y155-A177 HydrophobicContact CD2-CB 4.33Å; Y155-A177 HydrophobicContact CE2-CB 4.33Å; Y155-A177 HydrophobicContact CG-CB 4.47Å; Y155-F181 HydrophobicContact CD2-CD2 4.28Å; Y155-F181 HydrophobicContact CD2-CE2 4.41Å; Y155-F181 HydrophobicContact CE2-CD2 4.02Å; Y155-F181 AromaticContact CE2-CE2 3.71Å; Y155-F181 HydrophobicContact CE2-CE2 3.71Å |
| 156 | S | 88.4 | Confident | 88.8 | Confident | 5 Ų | 5 | 37.2 Ų | 37.2 | 4% | 0.035 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -61.6 | -40.9 | 177.4 | -57 | 0 | 0 | 0 | 0 | 111.8 | I152 Y153 T154 A159 N160 M197 | I152-S156 WeakPolarHBondContact O-CB 3.49Å; I152-S156 PolarHBondContact O-N 2.86Å; I152-S156 PolarHBondContact O-OG 3.05Å; Y153-S156 PolarHBondContact O-N 2.94Å; T154-S156 VanDerWaalsContact C-N 3.32Å; T154-S156 PolarHBondContact O-N 3.14Å; S156-A159 PolarHBondContact O-N 3.19Å; S156-N160 VanDerWaalsContact O-CG 3.31Å; S156-N160 PolarHBondContact O-N 2.82Å; S156-N160 PolarHBondContact O-ND2 3.49Å; S156-M197 VanDerWaalsContact OG-CE 3.27Å; S156-M197 WeakPolarHBondContact OG-CE 3.3Å |
| 157 | L | 87.9 | Confident | 88.7 | Confident | 6 Ų | 6 | 30.7 Ų | 30.7 | 3% | 0.031 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -67 | -41.9 | 174.5 | -77 | -177.6 | 0 | 0 | 0 | 112.8 | L25 L116 L135 Y153 T154 Y155 A159 N160 L161 | L25-L157 HydrophobicContact CD2-CD2 3.99Å; L116-L157 HydrophobicContact CD2-CD1 3.89Å; L135-L157 HydrophobicContact CD1-CB 4.46Å; L135-L157 HydrophobicContact CD2-CB 3.85Å; L135-L157 HydrophobicContact CD2-CD1 4.05Å; Y153-L157 HydrophobicContact CD1-CD1 3.97Å; Y153-L157 HydrophobicContact CD1-CG 4.41Å; Y153-L157 HydrophobicContact CE1-CD1 3.35Å; Y153-L157 HydrophobicContact CE1-CG 4.01Å; Y153-L157 PolarHBondContact O-N 3.38Å; T154-L157 PolarHBondContact O-N 3.34Å; Y155-L157 VanDerWaalsContact C-N 3.34Å; Y155-L157 PolarHBondContact O-N 3.24Å; L157-A159 VanDerWaalsContact C-N 3.3Å; L157-A159 PolarHBondContact O-N 3.3Å; L157-N160 PolarHBondContact O-N 3.31Å; L157-L161 WeakPolarHBondContact O-CB 3.33Å; L157-L161 PolarHBondContact O-N 2.82Å |
| 158 | M | 94.3 | Very high | 88.5 | Confident | 16 Ų | 16 | 30.9 Ų | 30.9 | 8% | 0.079 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -61.7 | -40.8 | 174.6 | -68.2 | 173.3 | 70.7 | 0 | 0 | 111.1 | L135 H136 I139 T154 Y155 L161 A162 L174 | L135-M158 HydrophobicContact CB-CG 3.67Å; L135-M158 HydrophobicContact CB-SD 4.34Å; L135-M158 HydrophobicContact CD1-CG 3.85Å; L135-M158 HydrophobicContact CG-CG 4.23Å; H136-M158 VanDerWaalsContact CE1-CE 3.47Å; H136-M158 WeakPolarHBondContact CE1-CE 3.34Å; I139-M158 HydrophobicContact CB-SD 4.39Å; I139-M158 HydrophobicContact CG2-SD 4.26Å; T154-M158 HydrophobicContact CG2-SD 4.22Å; T154-M158 VanDerWaalsContact O-CG 3.28Å; T154-M158 WeakPolarHBondContact O-CG 3.45Å; T154-M158 PolarHBondContact O-N 3.35Å; Y155-M158 HydrophobicContact CD1-SD 4.46Å; Y155-M158 PolarHBondContact O-N 2.98Å; M158-L161 PolarHBondContact O-N 3.35Å; M158-A162 WeakPolarHBondContact O-CB 3.16Å; M158-A162 PolarHBondContact O-N 3.25Å; M158-L174 HydrophobicContact CB-CD1 3.89Å; M158-L174 HydrophobicContact CB-CD2 4.24Å; M158-L174 HydrophobicContact CE-CD2 4.24Å |
| 159 | A | 89.8 | Confident | 88.7 | Confident | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -65.1 | -44.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y155 S156 L157 L161 A162 Y163 A171 L174 F175 | Y155-A159 WeakPolarHBondContact O-CB 3.33Å; Y155-A159 PolarHBondContact O-N 3.47Å; S156-A159 PolarHBondContact O-N 3.19Å; L157-A159 VanDerWaalsContact C-N 3.3Å; L157-A159 PolarHBondContact O-N 3.3Å; A159-L161 VanDerWaalsContact C-N 3.31Å; A159-L161 PolarHBondContact O-N 3.05Å; A159-A162 PolarHBondContact O-N 3.44Å; A159-Y163 WeakPolarHBondContact O-CB 3.41Å; A159-Y163 PolarHBondContact O-N 2.91Å; A159-A171 WeakPolarHBondContact O-CB 3.34Å; A159-L174 HydrophobicContact CB-CB 3.55Å; A159-L174 HydrophobicContact CB-CD1 4.5Å; A159-F175 HydrophobicContact CB-CD1 3.73Å; A159-F175 HydrophobicContact CB-CD2 3.51Å; A159-F175 HydrophobicContact CB-CE1 3.65Å; A159-F175 HydrophobicContact CB-CE2 3.44Å; A159-F175 VanDerWaalsContact CB-CE2 3.44Å; A159-F175 HydrophobicContact CB-CG 3.65Å; A159-F175 HydrophobicContact CB-CZ 3.5Å; A159-F175 VanDerWaalsContact CB-CZ 3.5Å |
| 160 | N | 85 | Confident | 89 | Confident | 21 Ų | 21 | 31.9 Ų | 31.9 | 11% | 0.112 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -59.6 | -42.2 | 173.4 | -74.2 | -42.1 | 0 | 0 | 0 | 111.7 | S156 L157 Y163 V164 F175 | S156-N160 VanDerWaalsContact O-CG 3.31Å; S156-N160 PolarHBondContact O-N 2.82Å; S156-N160 PolarHBondContact O-ND2 3.49Å; L157-N160 PolarHBondContact O-N 3.31Å; N160-Y163 WeakPolarHBondContact O-CB 3.26Å; N160-Y163 PolarHBondContact O-N 2.95Å; N160-V164 WeakPolarHBondContact O-CG2 3.46Å; N160-V164 PolarHBondContact O-N 3.42Å; N160-F175 WeakPolarHBondContact OD1-CZ 3.33Å |
| 161 | L | 86.4 | Confident | 89 | Confident | 3 Ų | 3 | 31.7 Ų | 31.7 | 2% | 0.016 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -64.5 | -46.9 | 177.9 | -179.3 | 53.5 | 0 | 0 | 0 | 111.6 | I123 L128 A131 N132 L135 L157 M158 A159 Y163 V164 Q165 | I123-L161 HydrophobicContact CD1-CB 4.5Å; I123-L161 HydrophobicContact CD1-CD1 4.39Å; I123-L161 HydrophobicContact CD1-CD2 4.36Å; I123-L161 HydrophobicContact CG1-CD1 4.17Å; L128-L161 HydrophobicContact CB-CD1 4.06Å; L128-L161 HydrophobicContact CD2-CD1 3.75Å; L128-L161 HydrophobicContact CG-CD1 4.33Å; A131-L161 HydrophobicContact CB-CD2 3.9Å; N132-L161 WeakPolarHBondContact OD1-CD2 3.21Å; L135-L161 HydrophobicContact CD1-CD2 3.76Å; L157-L161 WeakPolarHBondContact O-CB 3.33Å; L157-L161 PolarHBondContact O-N 2.82Å; M158-L161 PolarHBondContact O-N 3.35Å; A159-L161 VanDerWaalsContact C-N 3.31Å; A159-L161 PolarHBondContact O-N 3.05Å; L161-Y163 VanDerWaalsContact C-N 3.29Å; L161-Y163 PolarHBondContact O-N 3.17Å; L161-V164 PolarHBondContact O-N 3.1Å; L161-Q165 HydrophobicContact CD1-CG 4.45Å; L161-Q165 VanDerWaalsContact O-CG 3.32Å; L161-Q165 WeakPolarHBondContact O-CG 3.46Å; L161-Q165 PolarHBondContact O-N 3.21Å; L161-Q165 PolarHBondContact O-OE1 3.19Å |
| 162 | A | 87.9 | Confident | 89 | Confident | 2 Ų | 2 | 32.6 Ų | 32.6 | 2% | 0.017 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -58.1 | -42.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | M158 A159 Q165 G166 E167 N170 A171 L174 | M158-A162 WeakPolarHBondContact O-CB 3.16Å; M158-A162 PolarHBondContact O-N 3.25Å; A159-A162 PolarHBondContact O-N 3.44Å; A162-Q165 CarbonylContact O-C 3.59Å; A162-Q165 PolarHBondContact O-N 3.42Å; A162-G166 PolarHBondContact O-N 3.32Å; A162-E167 HydrophobicContact CB-CB 4.15Å; A162-E167 WeakPolarHBondContact O-CB 3.21Å; A162-E167 PolarHBondContact O-N 3.32Å; A162-N170 HydrophobicContact CB-CB 4.15Å; A162-A171 HydrophobicContact CB-CB 4.06Å; A162-L174 HydrophobicContact CB-CD1 4.26Å |
| 163 | Y | 82.9 | Confident | 89.4 | Confident | 61 Ų | 61 | 39.4 Ų | 39.4 | 24% | 0.239 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -60.2 | -47.4 | 176.3 | -176.1 | -93.7 | 0 | 0 | 0 | 112.1 | I17 I21 A159 N160 L161 Q165 G166 L168 I204 | I17-Y163 HydrophobicContact CG2-CE1 4.24Å; I21-Y163 HydrophobicContact CD1-CD1 4.09Å; I21-Y163 HydrophobicContact CD1-CE1 4.43Å; A159-Y163 WeakPolarHBondContact O-CB 3.41Å; A159-Y163 PolarHBondContact O-N 2.91Å; N160-Y163 WeakPolarHBondContact O-CB 3.26Å; N160-Y163 PolarHBondContact O-N 2.95Å; L161-Y163 VanDerWaalsContact C-N 3.29Å; L161-Y163 PolarHBondContact O-N 3.17Å; Y163-Q165 PolarHBondContact O-N 3.01Å; Y163-G166 PolarHBondContact O-N 3.01Å; Y163-L168 HydrophobicContact CD2-CD2 3.67Å; Y163-L168 HydrophobicContact CE2-CD2 3.79Å; Y163-I204 HydrophobicContact CD2-CD1 4.26Å; Y163-I204 HydrophobicContact CD2-CG1 3.67Å; Y163-I204 HydrophobicContact CE2-CG1 3.8Å |
| 164 | V | 78.6 | Confident | 89.8 | Confident | 46 Ų | 46 | 37.8 Ų | 37.8 | 28% | 0.279 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -60.4 | -33.9 | 176 | 172.5 | 0 | 0 | 0 | 0 | 112.1 | I21 L128 N160 L161 G166 | I21-V164 HydrophobicContact CD1-CG2 3.28Å; I21-V164 HydrophobicContact CG2-CG2 4.49Å; L128-V164 HydrophobicContact CD1-CG1 4.45Å; N160-V164 WeakPolarHBondContact O-CG2 3.46Å; N160-V164 PolarHBondContact O-N 3.42Å; L161-V164 PolarHBondContact O-N 3.1Å; V164-G166 PolarHBondContact O-N 3.08Å |
| 165 | Q | 83.1 | Confident | 90 | Very high | 50 Ų | 50 | 37.9 Ų | 37.9 | 23% | 0.234 | 20% | 0.197 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.8 | -7 | 177.2 | -68.4 | 176.3 | -57.7 | 0 | 0 | 113.1 | L128 L161 A162 Y163 E167 | L128-Q165 HydrophobicContact CD1-CG 3.83Å; L161-Q165 HydrophobicContact CD1-CG 4.45Å; L161-Q165 VanDerWaalsContact O-CG 3.32Å; L161-Q165 WeakPolarHBondContact O-CG 3.46Å; L161-Q165 PolarHBondContact O-N 3.21Å; L161-Q165 PolarHBondContact O-OE1 3.19Å; A162-Q165 CarbonylContact O-C 3.59Å; A162-Q165 PolarHBondContact O-N 3.42Å; Y163-Q165 PolarHBondContact O-N 3.01Å; Q165-E167 VanDerWaalsContact C-N 3.29Å; Q165-E167 HydrophobicContact CB-CG 4.14Å |
| 166 | G | 82.3 | Confident | 90 | Very high | 54 Ų | 54 | 39.5 Ų | 39.5 | 56% | 0.557 | 21% | 0.205 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 79.9 | 9.1 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | A162 Y163 V164 L168 | A162-G166 PolarHBondContact O-N 3.32Å; Y163-G166 PolarHBondContact O-N 3.01Å; V164-G166 PolarHBondContact O-N 3.08Å; G166-L168 PolarHBondContact O-N 2.84Å |
| 167 | E | 90.3 | Very high | 90.5 | Very high | 85 Ų | 85 | 40.7 Ų | 40.7 | 40% | 0.397 | 22% | 0.216 | S | C | . | . | trans | -81.6 | 63.1 | 177.9 | -59.7 | 179.7 | -171.7 | 0 | 0 | 110.7 | A162 Q165 D169 N170 A171 | A162-E167 HydrophobicContact CB-CB 4.15Å; A162-E167 WeakPolarHBondContact O-CB 3.21Å; A162-E167 PolarHBondContact O-N 3.32Å; Q165-E167 VanDerWaalsContact C-N 3.29Å; Q165-E167 HydrophobicContact CB-CG 4.14Å; E167-D169 VanDerWaalsContact C-N 3.31Å; E167-D169 PolarHBondContact O-N 2.93Å; E167-N170 HydrophobicContact CB-CB 3.94Å; E167-N170 WeakPolarHBondContact O-CB 3.49Å; E167-N170 PolarHBondContact O-N 3.17Å; E167-N170 PolarHBondContact OE2-ND2 3.37Å; E167-A171 PolarHBondContact O-N 3.3Å | ||
| 168 | L | 87 | Confident | 90.8 | Very high | 40 Ų | 40 | 40.4 Ų | 40.4 | 21% | 0.209 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -58.2 | -38.7 | -171 | -61.5 | -174.6 | 0 | 0 | 0 | 113.3 | Y163 G166 N170 A171 E172 I204 Q208 | Y163-L168 HydrophobicContact CD2-CD2 3.67Å; Y163-L168 HydrophobicContact CE2-CD2 3.79Å; G166-L168 PolarHBondContact O-N 2.84Å; L168-N170 VanDerWaalsContact C-N 3.31Å; L168-N170 PolarHBondContact O-N 2.76Å; L168-A171 PolarHBondContact O-N 3.18Å; L168-E172 WeakPolarHBondContact O-CB 3.47Å; L168-E172 PolarHBondContact O-N 3.06Å; L168-I204 HydrophobicContact CB-CG2 4.34Å; L168-Q208 HydrophobicContact CB-CG 3.88Å; L168-Q208 HydrophobicContact CD1-CG 4.02Å |
| 169 | D | 96.4 | Very high | 90.9 | Very high | 102 Ų | 102 | 41.3 Ų | 41.3 | 55% | 0.545 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -66.4 | -33.2 | 177.4 | -65.6 | -23.5 | 0 | 0 | 0 | 112.8 | E167 K173 Q208 | E167-D169 VanDerWaalsContact C-N 3.31Å; E167-D169 PolarHBondContact O-N 2.93Å; D169-K173 VanDerWaalsContact O-CG 3.3Å; D169-K173 WeakPolarHBondContact O-CG 3.48Å; D169-K173 PolarHBondContact O-N 3.39Å; D169-Q208 PolarHBondContact OD1-NE2 3.42Å |
| 170 | N | 96.2 | Very high | 91.3 | Very high | 66 Ų | 66 | 44.7 Ų | 44.7 | 35% | 0.353 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -74.7 | -44.8 | 177 | -169.6 | 20.5 | 0 | 0 | 0 | 110 | A162 E167 L168 E172 K173 L174 | A162-N170 HydrophobicContact CB-CB 4.15Å; E167-N170 HydrophobicContact CB-CB 3.94Å; E167-N170 WeakPolarHBondContact O-CB 3.49Å; E167-N170 PolarHBondContact O-N 3.17Å; E167-N170 PolarHBondContact OE2-ND2 3.37Å; L168-N170 VanDerWaalsContact C-N 3.31Å; L168-N170 PolarHBondContact O-N 2.76Å; N170-E172 VanDerWaalsContact C-N 3.31Å; N170-E172 PolarHBondContact O-N 3.37Å; N170-K173 PolarHBondContact O-N 3.14Å; N170-L174 WeakPolarHBondContact O-CD1 3.35Å; N170-L174 VanDerWaalsContact O-CG 3.29Å; N170-L174 WeakPolarHBondContact O-CG 3.38Å; N170-L174 PolarHBondContact O-N 3.08Å |
| 171 | A | 90.3 | Very high | 91.8 | Very high | 0 Ų | 0 | 46.5 Ų | 46.5 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -56.4 | -45.1 | 174 | 0 | 0 | 0 | 0 | 0 | 111.8 | A159 A162 E167 L168 K173 L174 F175 I204 | A159-A171 WeakPolarHBondContact O-CB 3.34Å; A162-A171 HydrophobicContact CB-CB 4.06Å; E167-A171 PolarHBondContact O-N 3.3Å; L168-A171 PolarHBondContact O-N 3.18Å; A171-K173 PolarHBondContact O-N 3.29Å; A171-L174 PolarHBondContact O-N 3.14Å; A171-F175 WeakPolarHBondContact O-CD2 3.47Å; A171-F175 PolarHBondContact O-N 3.4Å; A171-I204 HydrophobicContact CB-CD1 3.83Å |
| 172 | E | 94.8 | Very high | 92.2 | Very high | 23 Ų | 23 | 46.7 Ų | 46.7 | 11% | 0.107 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -55.5 | -50.4 | 175.9 | -173.4 | -170.3 | 152.2 | 0 | 0 | 111.6 | L168 N170 L174 F175 K176 L201 I204 Y205 Q208 K210 | L168-E172 WeakPolarHBondContact O-CB 3.47Å; L168-E172 PolarHBondContact O-N 3.06Å; N170-E172 VanDerWaalsContact C-N 3.31Å; N170-E172 PolarHBondContact O-N 3.37Å; E172-L174 PolarHBondContact O-N 3.12Å; E172-F175 PolarHBondContact O-N 3.34Å; E172-K176 HydrophobicContact CG-CD 4.22Å; E172-K176 WeakPolarHBondContact O-CB 3.46Å; E172-K176 WeakPolarHBondContact O-CG 3.42Å; E172-K176 PolarHBondContact O-N 2.89Å; E172-K176 IonicContact OE1-NZ 3.73Å; E172-K176 PolarHBondContact OE1-NZ 3.48Å; E172-L201 HydrophobicContact CG-CD2 4.1Å; E172-I204 HydrophobicContact CB-CG2 4.03Å; E172-Y205 HydrophobicContact CG-CE1 3.95Å; E172-Q208 PolarHBondContact OE2-NE2 2.85Å; E172-Q208 PolarHBondContact OE2-OE1 2.99Å; E172-Q208 VanDerWaalsContact OE2-OE1 3.12Å; E172-K210 IonicContact OE1-NZ 2.67Å; E172-K210 IonicContact OE2-NZ 3.4Å; E172-K210 PolarHBondContact OE2-NZ 3.31Å |
| 173 | K | 98.3 | Very high | 92.6 | Very high | 147 Ų | 147 | 49.8 Ų | 49.8 | 64% | 0.639 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -62 | -43.7 | -179.6 | -71.9 | 169.3 | -172.7 | 172.9 | 0 | 111.8 | D169 N170 A171 K176 A177 | D169-K173 VanDerWaalsContact O-CG 3.3Å; D169-K173 WeakPolarHBondContact O-CG 3.48Å; D169-K173 PolarHBondContact O-N 3.39Å; N170-K173 PolarHBondContact O-N 3.14Å; A171-K173 PolarHBondContact O-N 3.29Å; K173-K176 PolarHBondContact O-N 2.67Å; K173-A177 WeakPolarHBondContact O-CB 3.44Å; K173-A177 PolarHBondContact O-N 2.88Å |
| 174 | L | 97.3 | Very high | 93.2 | Very high | 19 Ų | 19 | 51.4 Ų | 51.4 | 10% | 0.099 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -68.8 | -40.5 | -177.8 | -68.2 | 163.7 | 0 | 0 | 0 | 111.7 | Y155 M158 A159 A162 N170 A171 E172 A177 A178 | Y155-L174 HydrophobicContact CD1-CD2 3.69Å; Y155-L174 HydrophobicContact CE1-CD2 4.12Å; M158-L174 HydrophobicContact CB-CD1 3.89Å; M158-L174 HydrophobicContact CB-CD2 4.24Å; M158-L174 HydrophobicContact CE-CD2 4.24Å; A159-L174 HydrophobicContact CB-CB 3.55Å; A159-L174 HydrophobicContact CB-CD1 4.5Å; A162-L174 HydrophobicContact CB-CD1 4.26Å; N170-L174 WeakPolarHBondContact O-CD1 3.35Å; N170-L174 VanDerWaalsContact O-CG 3.29Å; N170-L174 WeakPolarHBondContact O-CG 3.38Å; N170-L174 PolarHBondContact O-N 3.08Å; A171-L174 PolarHBondContact O-N 3.14Å; E172-L174 PolarHBondContact O-N 3.12Å; L174-A177 PolarHBondContact O-N 3.22Å; L174-A178 PolarHBondContact O-N 2.75Å |
| 175 | F | 95.9 | Very high | 93.9 | Very high | 2 Ų | 2 | 52 Ų | 52 | 1% | 0.009 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -66.9 | -40.9 | 173.4 | -81 | -53.6 | 0 | 0 | 0 | 112.7 | A159 N160 A171 E172 A177 A178 M179 M197 K200 L201 I204 | A159-F175 HydrophobicContact CB-CD1 3.73Å; A159-F175 HydrophobicContact CB-CD2 3.51Å; A159-F175 HydrophobicContact CB-CE1 3.65Å; A159-F175 HydrophobicContact CB-CE2 3.44Å; A159-F175 VanDerWaalsContact CB-CE2 3.44Å; A159-F175 HydrophobicContact CB-CG 3.65Å; A159-F175 HydrophobicContact CB-CZ 3.5Å; A159-F175 VanDerWaalsContact CB-CZ 3.5Å; N160-F175 WeakPolarHBondContact OD1-CZ 3.33Å; A171-F175 WeakPolarHBondContact O-CD2 3.47Å; A171-F175 PolarHBondContact O-N 3.4Å; E172-F175 PolarHBondContact O-N 3.34Å; F175-A177 VanDerWaalsContact C-N 3.29Å; F175-A177 PolarHBondContact O-N 3Å; F175-A178 PolarHBondContact O-N 2.73Å; F175-M179 WeakPolarHBondContact O-CB 3.44Å; F175-M179 PolarHBondContact O-N 3.12Å; F175-M197 HydrophobicContact CD1-SD 3.48Å; F175-M197 WeakPolarHBondContact CD1-SD 3.44Å; F175-M197 HydrophobicContact CE1-SD 3.84Å; F175-K200 HydrophobicContact CD1-CD 4.18Å; F175-K200 HydrophobicContact CD2-CB 4.31Å; F175-K200 HydrophobicContact CE1-CB 4.46Å; F175-K200 HydrophobicContact CE1-CD 3.37Å; F175-K200 HydrophobicContact CE2-CB 4.07Å; F175-K200 HydrophobicContact CE2-CD 4.05Å; F175-K200 HydrophobicContact CZ-CB 4.16Å; F175-K200 HydrophobicContact CZ-CD 3.3Å; F175-K200 HydrophobicContact CZ-CG 4.29Å; F175-L201 HydrophobicContact CB-CD2 3.81Å; F175-L201 HydrophobicContact CB-CG 4.05Å; F175-I204 HydrophobicContact CD2-CD1 3.5Å; F175-I204 VanDerWaalsContact CD2-CD1 3.5Å; F175-I204 HydrophobicContact CE2-CD1 3.85Å |
| 176 | K | 97.9 | Very high | 94.4 | Very high | 81 Ų | 81 | 52.5 Ų | 52.5 | 35% | 0.352 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -59.6 | -41 | 172.6 | -77 | 176.9 | 174.9 | 175.1 | 0 | 111.8 | E172 K173 S180 L201 Y205 | E172-K176 HydrophobicContact CG-CD 4.22Å; E172-K176 WeakPolarHBondContact O-CB 3.46Å; E172-K176 WeakPolarHBondContact O-CG 3.42Å; E172-K176 PolarHBondContact O-N 2.89Å; E172-K176 IonicContact OE1-NZ 3.73Å; E172-K176 PolarHBondContact OE1-NZ 3.48Å; K173-K176 PolarHBondContact O-N 2.67Å; K176-S180 VanDerWaalsContact O-CB 3.31Å; K176-S180 WeakPolarHBondContact O-CB 3.08Å; K176-S180 PolarHBondContact O-N 3.45Å; K176-L201 HydrophobicContact CG-CD1 4.16Å; K176-L201 HydrophobicContact CG-CD2 4.12Å; K176-Y205 WeakPolarHBondContact CE-OH 3.43Å; K176-Y205 PolarHBondContact NZ-OH 3.34Å |
| 177 | A | 97.8 | Very high | 95 | Very high | 31 Ų | 31 | 51.4 Ų | 51.4 | 26% | 0.256 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -62.7 | -49 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y155 K173 L174 F175 M179 S180 F181 | Y155-A177 HydrophobicContact CD2-CB 4.33Å; Y155-A177 HydrophobicContact CE2-CB 4.33Å; Y155-A177 HydrophobicContact CG-CB 4.47Å; K173-A177 WeakPolarHBondContact O-CB 3.44Å; K173-A177 PolarHBondContact O-N 2.88Å; L174-A177 PolarHBondContact O-N 3.22Å; F175-A177 VanDerWaalsContact C-N 3.29Å; F175-A177 PolarHBondContact O-N 3Å; A177-M179 PolarHBondContact O-N 3.43Å; A177-S180 WeakPolarHBondContact O-CB 3.49Å; A177-S180 PolarHBondContact O-N 2.89Å; A177-F181 VanDerWaalsContact O-CD2 3.31Å; A177-F181 WeakPolarHBondContact O-CD2 3.41Å; A177-F181 PolarHBondContact O-N 3.2Å; A177-F181 VanDerWaalsContact O-N 3.1Å |
| 178 | A | 95.8 | Very high | 95.2 | Very high | 0 Ų | 0 | 50.7 Ų | 50.7 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -56.7 | -49.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | I152 L174 F175 S180 F181 M182 | I152-A178 HydrophobicContact CG2-CB 4.42Å; L174-A178 PolarHBondContact O-N 2.75Å; F175-A178 PolarHBondContact O-N 2.73Å; A178-S180 VanDerWaalsContact C-N 3.33Å; A178-S180 PolarHBondContact O-N 3.39Å; A178-F181 WeakPolarHBondContact O-CB 3.38Å; A178-F181 PolarHBondContact O-N 3.39Å; A178-F181 VanDerWaalsContact O-N 3.14Å; A178-M182 WeakPolarHBondContact O-CG 3.01Å; A178-M182 PolarHBondContact O-N 3.3Å; A178-M182 VanDerWaalsContact O-N 3.08Å |
| 179 | M | 95.4 | Very high | 95.5 | Very high | 35 Ų | 35 | 55 Ų | 55 | 17% | 0.172 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -63.2 | -37.3 | 178.7 | -172.1 | 171.4 | 60.2 | 0 | 0 | 112.3 | F175 A177 F181 M182 L183 V194 M197 L201 | F175-M179 WeakPolarHBondContact O-CB 3.44Å; F175-M179 PolarHBondContact O-N 3.12Å; A177-M179 PolarHBondContact O-N 3.43Å; M179-F181 VanDerWaalsContact C-N 3.32Å; M179-F181 PolarHBondContact O-N 2.85Å; M179-M182 WeakPolarHBondContact O-CB 3.41Å; M179-M182 PolarHBondContact O-N 3.21Å; M179-M182 VanDerWaalsContact O-N 3.13Å; M179-L183 HydrophobicContact CG-CD1 4.19Å; M179-L183 HydrophobicContact CG-CG 4.49Å; M179-L183 WeakPolarHBondContact O-CG 3.04Å; M179-L183 PolarHBondContact O-N 2.99Å; M179-V194 HydrophobicContact CG-CG1 4.48Å; M179-M197 HydrophobicContact CB-CB 4.29Å; M179-M197 HydrophobicContact CG-CB 4.38Å; M179-M197 HydrophobicContact SD-CB 4.19Å; M179-L201 HydrophobicContact CE-CD1 3.44Å; M179-L201 VanDerWaalsContact CE-CD1 3.44Å; M179-L201 HydrophobicContact SD-CD1 4.18Å |
| 180 | S | 97.6 | Very high | 95.3 | Very high | 71 Ų | 71 | 53 Ų | 53 | 50% | 0.497 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -61.7 | -38.3 | 173.8 | -175.2 | 0 | 0 | 0 | 0 | 112.4 | K176 A177 A178 S184 | K176-S180 VanDerWaalsContact O-CB 3.31Å; K176-S180 WeakPolarHBondContact O-CB 3.08Å; K176-S180 PolarHBondContact O-N 3.45Å; A177-S180 WeakPolarHBondContact O-CB 3.49Å; A177-S180 PolarHBondContact O-N 2.89Å; A178-S180 VanDerWaalsContact C-N 3.33Å; A178-S180 PolarHBondContact O-N 3.39Å; S180-S184 VanDerWaalsContact O-CB 3.26Å; S180-S184 WeakPolarHBondContact O-CB 3.38Å; S180-S184 PolarHBondContact O-N 3.41Å; S180-S184 PolarHBondContact O-OG 2.92Å |
| 181 | F | 96.1 | Very high | 95.1 | Very high | 59 Ų | 59 | 51 Ų | 51 | 26% | 0.259 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -68 | -34.8 | 173.6 | -85.6 | -77.7 | 0 | 0 | 0 | 112.2 | H143 T148 I151 I152 Y155 A177 A178 M179 S184 G185 | H143-F181 AromaticContact CE1-CZ 3.83Å; T148-F181 HydrophobicContact CG2-CB 4.37Å; T148-F181 HydrophobicContact CG2-CD1 4.11Å; I151-F181 HydrophobicContact CD1-CE1 4.39Å; I151-F181 HydrophobicContact CG2-CD1 4.16Å; I151-F181 HydrophobicContact CG2-CD2 3.72Å; I151-F181 HydrophobicContact CG2-CE1 4.13Å; I151-F181 HydrophobicContact CG2-CE2 3.73Å; I151-F181 HydrophobicContact CG2-CG 3.97Å; I151-F181 HydrophobicContact CG2-CZ 3.93Å; I152-F181 HydrophobicContact CD1-CB 4.1Å; I152-F181 HydrophobicContact CG1-CB 3.54Å; Y155-F181 HydrophobicContact CD2-CD2 4.28Å; Y155-F181 HydrophobicContact CD2-CE2 4.41Å; Y155-F181 HydrophobicContact CE2-CD2 4.02Å; Y155-F181 AromaticContact CE2-CE2 3.71Å; Y155-F181 HydrophobicContact CE2-CE2 3.71Å; A177-F181 VanDerWaalsContact O-CD2 3.31Å; A177-F181 WeakPolarHBondContact O-CD2 3.41Å; A177-F181 PolarHBondContact O-N 3.2Å; A177-F181 VanDerWaalsContact O-N 3.1Å; A178-F181 WeakPolarHBondContact O-CB 3.38Å; A178-F181 PolarHBondContact O-N 3.39Å; A178-F181 VanDerWaalsContact O-N 3.14Å; M179-F181 VanDerWaalsContact C-N 3.32Å; M179-F181 PolarHBondContact O-N 2.85Å; F181-S184 PolarHBondContact O-OG 3.05Å; F181-G185 PolarHBondContact O-N 3.43Å; F181-G185 VanDerWaalsContact O-N 3.08Å |
| 182 | M | 94.2 | Very high | 95.1 | Very high | 6 Ų | 6 | 51.2 Ų | 51.2 | 3% | 0.03 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -63.9 | -51.8 | 175 | -64.7 | 175.5 | 72.9 | 0 | 0 | 111.4 | I152 A178 M179 G185 G186 T187 V194 M197 | I152-M182 HydrophobicContact CD1-CG 3.73Å; I152-M182 HydrophobicContact CG1-CG 4.09Å; I152-M182 HydrophobicContact CG2-CG 3.84Å; I152-M182 HydrophobicContact CG2-SD 4.08Å; A178-M182 WeakPolarHBondContact O-CG 3.01Å; A178-M182 PolarHBondContact O-N 3.3Å; A178-M182 VanDerWaalsContact O-N 3.08Å; M179-M182 WeakPolarHBondContact O-CB 3.41Å; M179-M182 PolarHBondContact O-N 3.21Å; M179-M182 VanDerWaalsContact O-N 3.13Å; M182-G185 PolarHBondContact O-N 3.21Å; M182-G186 PolarHBondContact O-N 3.47Å; M182-T187 HydrophobicContact CE-CG2 4.29Å; M182-T187 WeakPolarHBondContact O-CB 2.95Å; M182-T187 PolarHBondContact O-N 3.28Å; M182-T187 PolarHBondContact O-OG1 3.16Å; M182-V194 HydrophobicContact CB-CG2 4.32Å; M182-V194 HydrophobicContact CE-CG2 3.78Å; M182-M197 HydrophobicContact SD-CG 3.9Å |
| 183 | L | 96.3 | Very high | 94.8 | Very high | 68 Ų | 68 | 50.3 Ų | 50.3 | 36% | 0.356 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -67.9 | -45.8 | -176.9 | -65.9 | 173.2 | 0 | 0 | 0 | 112.1 | M179 G185 G186 E189 V194 | M179-L183 HydrophobicContact CG-CD1 4.19Å; M179-L183 HydrophobicContact CG-CG 4.49Å; M179-L183 WeakPolarHBondContact O-CG 3.04Å; M179-L183 PolarHBondContact O-N 2.99Å; L183-G185 PolarHBondContact O-N 3.15Å; L183-G186 PolarHBondContact O-N 3.46Å; L183-E189 HydrophobicContact CD2-CG 3.93Å; L183-V194 HydrophobicContact CD2-CG1 4.21Å; L183-V194 HydrophobicContact CD2-CG2 4.3Å |
| 184 | S | 96.2 | Very high | 94.6 | Very high | 95 Ų | 95 | 43.5 Ų | 43.5 | 66% | 0.664 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -65.2 | -24.2 | 175.6 | 61.1 | 0 | 0 | 0 | 0 | 113 | S180 F181 G186 | S180-S184 VanDerWaalsContact O-CB 3.26Å; S180-S184 WeakPolarHBondContact O-CB 3.38Å; S180-S184 PolarHBondContact O-N 3.41Å; S180-S184 PolarHBondContact O-OG 2.92Å; F181-S184 PolarHBondContact O-OG 3.05Å; S184-G186 PolarHBondContact O-N 3.38Å |
| 185 | G | 92.6 | Very high | 94.4 | Very high | 58 Ų | 58 | 42.6 Ų | 42.6 | 60% | 0.598 | 27% | 0.267 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.1 | 1.8 | 171.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | F181 M182 L183 | F181-G185 PolarHBondContact O-N 3.43Å; F181-G185 VanDerWaalsContact O-N 3.08Å; M182-G185 PolarHBondContact O-N 3.21Å; L183-G185 PolarHBondContact O-N 3.15Å |
| 186 | G | 94.6 | Very high | 94.2 | Very high | 61 Ų | 61 | 42.9 Ų | 42.9 | 63% | 0.629 | 27% | 0.269 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 84.5 | 14.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | M182 L183 S184 P188 | M182-G186 PolarHBondContact O-N 3.47Å; L183-G186 PolarHBondContact O-N 3.46Å; S184-G186 PolarHBondContact O-N 3.38Å; G186-P188 WeakPolarHBondContact O-CD 3.39Å |
| 187 | T | 93.9 | Very high | 93.7 | Very high | 30 Ų | 30 | 39.1 Ų | 39.1 | 18% | 0.184 | 25% | 0.252 | C | S | . | . | trans | -67.9 | 127.2 | 172.8 | -48.8 | 0 | 0 | 0 | 0 | 109 | M182 D191 V194 | M182-T187 HydrophobicContact CE-CG2 4.29Å; M182-T187 WeakPolarHBondContact O-CB 2.95Å; M182-T187 PolarHBondContact O-N 3.28Å; M182-T187 PolarHBondContact O-OG1 3.16Å; T187-D191 HydrophobicContact CG2-CB 3.61Å; T187-D191 WeakPolarHBondContact CG2-OD1 3.19Å; T187-V194 HydrophobicContact CG2-CG2 3.75Å | ||
| 188 | P | 94.3 | Very high | 93.6 | Very high | 70 Ų | 70 | 38.4 Ų | 38.4 | 46% | 0.455 | 25% | 0.245 | S | C | . | . | trans | -59.4 | 149.4 | 178.1 | -24.8 | 34.5 | 0 | 0 | 0 | 112.9 | G186 D190 D191 V194 | G186-P188 WeakPolarHBondContact O-CD 3.39Å; P188-D190 VanDerWaalsContact C-N 3.25Å; P188-D190 VanDerWaalsContact CB-OD1 3.31Å; P188-D190 WeakPolarHBondContact CB-OD1 3.4Å; P188-D190 PolarHBondContact O-N 3.28Å; P188-D191 HydrophobicContact CB-CB 4.48Å; P188-D191 WeakPolarHBondContact O-CB 3.49Å; P188-D191 PolarHBondContact O-N 3.36Å; P188-D191 VanDerWaalsContact O-N 3.11Å; P188-V194 WeakPolarHBondContact O-CG2 3.47Å | ||
| 189 | E | 93.8 | Very high | 93.6 | Very high | 132 Ų | 132 | 38.9 Ų | 38.9 | 62% | 0.617 | 25% | 0.248 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -64.8 | -30.5 | 177.1 | -67.7 | -177.8 | 177.4 | 0 | 0 | 112.7 | L183 D191 | L183-E189 HydrophobicContact CD2-CG 3.93Å; E189-D191 VanDerWaalsContact C-N 3.27Å; E189-D191 PolarHBondContact O-N 2.82Å |
| 190 | D | 91.8 | Very high | 93.3 | Very high | 60 Ų | 60 | 38.7 Ų | 38.7 | 32% | 0.321 | 25% | 0.246 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -86.6 | 9.5 | 175.9 | 70.3 | -13 | 0 | 0 | 0 | 113.3 | P188 K228 K231 | P188-D190 VanDerWaalsContact C-N 3.25Å; P188-D190 VanDerWaalsContact CB-OD1 3.31Å; P188-D190 WeakPolarHBondContact CB-OD1 3.4Å; P188-D190 PolarHBondContact O-N 3.28Å; D190-K228 WeakPolarHBondContact O-CD 3.36Å; D190-K228 PolarHBondContact O-NZ 2.91Å; D190-K231 IonicContact OD2-NZ 3.51Å |
| 191 | D | 93.1 | Very high | 93.2 | Very high | 22 Ų | 22 | 35.7 Ų | 35.7 | 12% | 0.118 | 22% | 0.224 | C | C | . | . | S | Bend | trans | -68.1 | 138.3 | 171.9 | -173.9 | -114.8 | 0 | 0 | 0 | 111 | R33 T187 P188 E189 G193 V194 I195 | R33-D191 IonicContact CZ-OD1 3.53Å; R33-D191 VanDerWaalsContact CZ-OD1 3.31Å; R33-D191 IonicContact CZ-OD2 3.88Å; R33-D191 IonicContact NH1-OD1 2.81Å; R33-D191 PolarHBondContact NH1-OD1 3.32Å; R33-D191 IonicContact NH1-OD2 3.58Å; R33-D191 IonicContact NH2-OD1 3.58Å; R33-D191 PolarHBondContact NH2-OD1 3.14Å; R33-D191 IonicContact NH2-OD2 3.67Å; R33-D191 PolarHBondContact NH2-OD2 3.45Å; T187-D191 HydrophobicContact CG2-CB 3.61Å; T187-D191 WeakPolarHBondContact CG2-OD1 3.19Å; P188-D191 HydrophobicContact CB-CB 4.48Å; P188-D191 WeakPolarHBondContact O-CB 3.49Å; P188-D191 PolarHBondContact O-N 3.36Å; P188-D191 VanDerWaalsContact O-N 3.11Å; E189-D191 VanDerWaalsContact C-N 3.27Å; E189-D191 PolarHBondContact O-N 2.82Å; D191-G193 PolarHBondContact O-N 3.05Å; D191-G193 VanDerWaalsContact O-N 3.12Å; D191-G193 PolarHBondContact OD1-N 3.36Å; D191-V194 HydrophobicContact CB-CB 4.5Å; D191-V194 HydrophobicContact CB-CG2 4.22Å; D191-V194 PolarHBondContact O-N 3.18Å; D191-I195 WeakPolarHBondContact O-CG1 3.42Å; D191-I195 PolarHBondContact O-N 3.32Å |
| 192 | N | 90.1 | Very high | 93.1 | Very high | 6 Ų | 6 | 32.9 Ų | 32.9 | 3% | 0.032 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -59.2 | -32.8 | -176.4 | -70.3 | 10.3 | 0 | 0 | 0 | 111.6 | E196 K228 T248 L251 | N192-E196 WeakPolarHBondContact O-CB 3.41Å; N192-E196 PolarHBondContact O-N 3.16Å; N192-K228 PolarHBondContact OD1-NZ 3.04Å; N192-T248 PolarHBondContact ND2-OG1 3.05Å; N192-T248 PolarHBondContact OD1-OG1 3.47Å; N192-L251 HydrophobicContact CB-CD2 3.88Å; N192-L251 WeakPolarHBondContact O-CD2 3.49Å |
| 193 | G | 88.4 | Confident | 92.9 | Very high | 4 Ų | 4 | 34.2 Ų | 34.2 | 4% | 0.041 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -68.2 | -37.8 | 176 | 0 | 0 | 0 | 0 | 0 | 113.1 | D191 E196 M197 | D191-G193 PolarHBondContact O-N 3.05Å; D191-G193 VanDerWaalsContact O-N 3.12Å; D191-G193 PolarHBondContact OD1-N 3.36Å; G193-E196 PolarHBondContact O-N 3.46Å; G193-M197 WeakPolarHBondContact O-CG 3.45Å; G193-M197 PolarHBondContact O-N 3.36Å; G193-M197 VanDerWaalsContact O-N 3.09Å |
| 194 | V | 93 | Very high | 92.5 | Very high | 3 Ų | 3 | 31 Ų | 31 | 2% | 0.018 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -70.1 | -41.5 | 176.9 | 176.1 | 0 | 0 | 0 | 0 | 110.4 | M179 M182 L183 T187 P188 D191 E196 M197 S198 | M179-V194 HydrophobicContact CG-CG1 4.48Å; M182-V194 HydrophobicContact CB-CG2 4.32Å; M182-V194 HydrophobicContact CE-CG2 3.78Å; L183-V194 HydrophobicContact CD2-CG1 4.21Å; L183-V194 HydrophobicContact CD2-CG2 4.3Å; T187-V194 HydrophobicContact CG2-CG2 3.75Å; P188-V194 WeakPolarHBondContact O-CG2 3.47Å; D191-V194 HydrophobicContact CB-CB 4.5Å; D191-V194 HydrophobicContact CB-CG2 4.22Å; D191-V194 PolarHBondContact O-N 3.18Å; V194-E196 VanDerWaalsContact C-N 3.32Å; V194-E196 PolarHBondContact O-N 2.99Å; V194-M197 PolarHBondContact O-N 2.94Å; V194-S198 WeakPolarHBondContact O-CB 2.91Å; V194-S198 PolarHBondContact O-N 3.15Å; V194-S198 PolarHBondContact O-OG 2.65Å |
| 195 | I | 94 | Very high | 92.4 | Very high | 0 Ų | 0 | 27.8 Ų | 27.8 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -63.4 | -40.7 | 175 | -62.5 | 170 | 0 | 0 | 0 | 110.5 | D191 M197 S198 L199 F220 C221 L225 L251 | D191-I195 WeakPolarHBondContact O-CG1 3.42Å; D191-I195 PolarHBondContact O-N 3.32Å; I195-M197 PolarHBondContact O-N 3Å; I195-S198 CarbonylContact O-C 3.5Å; I195-S198 WeakPolarHBondContact O-CB 3.44Å; I195-S198 PolarHBondContact O-N 2.82Å; I195-S198 VanDerWaalsContact O-N 3.14Å; I195-L199 PolarHBondContact O-N 2.94Å; I195-F220 HydrophobicContact CG1-CE1 4.48Å; I195-C221 HydrophobicContact CG2-CB 3.92Å; I195-L225 HydrophobicContact CD1-CD2 3.7Å; I195-L225 HydrophobicContact CD1-CG 4.02Å; I195-L225 HydrophobicContact CG2-CD1 3.89Å; I195-L225 HydrophobicContact CG2-CD2 4.06Å; I195-L225 HydrophobicContact CG2-CG 3.89Å; I195-L251 HydrophobicContact CB-CD2 4.27Å; I195-L251 HydrophobicContact CG2-CD2 4.18Å |
| 196 | E | 90.9 | Very high | 92.1 | Very high | 9 Ų | 9 | 26 Ų | 26 | 4% | 0.042 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -60.5 | -43.1 | 175 | -166.8 | -163 | 154.6 | 0 | 0 | 112 | L28 N192 G193 V194 S198 L199 K200 L251 | L28-E196 WeakPolarHBondContact CB-OE2 3.34Å; L28-E196 HydrophobicContact CD1-CG 3.85Å; L28-E196 WeakPolarHBondContact CD1-OE1 3.21Å; N192-E196 WeakPolarHBondContact O-CB 3.41Å; N192-E196 PolarHBondContact O-N 3.16Å; G193-E196 PolarHBondContact O-N 3.46Å; V194-E196 VanDerWaalsContact C-N 3.32Å; V194-E196 PolarHBondContact O-N 2.99Å; E196-S198 VanDerWaalsContact C-N 3.29Å; E196-S198 PolarHBondContact O-N 2.9Å; E196-L199 PolarHBondContact O-N 2.7Å; E196-K200 WeakPolarHBondContact O-CG 3.49Å; E196-K200 PolarHBondContact O-N 2.89Å; E196-K200 WeakPolarHBondContact OE1-CE 3.43Å; E196-K200 IonicContact OE1-NZ 2.73Å; E196-K200 PolarHBondContact OE1-NZ 3.3Å; E196-L251 HydrophobicContact CB-CD1 4.4Å; E196-L251 HydrophobicContact CG-CD1 4.45Å |
| 197 | M | 88.8 | Confident | 91.7 | Very high | 1 Ų | 1 | 25.3 Ų | 25.3 | 1% | 0.005 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -62.6 | -39.5 | 174.6 | -67.7 | -61.4 | 154.7 | 0 | 0 | 111.7 | L30 S156 F175 M179 M182 G193 V194 I195 K200 L201 | L30-M197 HydrophobicContact CD1-CE 3.62Å; S156-M197 VanDerWaalsContact OG-CE 3.27Å; S156-M197 WeakPolarHBondContact OG-CE 3.3Å; F175-M197 HydrophobicContact CD1-SD 3.48Å; F175-M197 WeakPolarHBondContact CD1-SD 3.44Å; F175-M197 HydrophobicContact CE1-SD 3.84Å; M179-M197 HydrophobicContact CB-CB 4.29Å; M179-M197 HydrophobicContact CG-CB 4.38Å; M179-M197 HydrophobicContact SD-CB 4.19Å; M182-M197 HydrophobicContact SD-CG 3.9Å; G193-M197 WeakPolarHBondContact O-CG 3.45Å; G193-M197 PolarHBondContact O-N 3.36Å; G193-M197 VanDerWaalsContact O-N 3.09Å; V194-M197 PolarHBondContact O-N 2.94Å; I195-M197 PolarHBondContact O-N 3Å; M197-K200 PolarHBondContact O-N 3.37Å; M197-L201 WeakPolarHBondContact O-CG 2.95Å; M197-L201 PolarHBondContact O-N 3.35Å |
| 198 | S | 95.3 | Very high | 91.4 | Very high | 16 Ų | 16 | 25.4 Ų | 25.4 | 11% | 0.112 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -65 | -40.6 | 177.2 | -57.8 | 0 | 0 | 0 | 0 | 111.7 | V194 I195 E196 L201 A202 F220 | V194-S198 WeakPolarHBondContact O-CB 2.91Å; V194-S198 PolarHBondContact O-N 3.15Å; V194-S198 PolarHBondContact O-OG 2.65Å; I195-S198 CarbonylContact O-C 3.5Å; I195-S198 WeakPolarHBondContact O-CB 3.44Å; I195-S198 PolarHBondContact O-N 2.82Å; I195-S198 VanDerWaalsContact O-N 3.14Å; E196-S198 VanDerWaalsContact C-N 3.29Å; E196-S198 PolarHBondContact O-N 2.9Å; S198-L201 PolarHBondContact O-N 2.87Å; S198-A202 PolarHBondContact O-N 2.99Å; S198-F220 WeakPolarHBondContact OG-CE1 3.23Å |
| 199 | L | 94.4 | Very high | 91.2 | Very high | 10 Ų | 10 | 28.3 Ų | 28.3 | 5% | 0.052 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -61.5 | -44.9 | 174.4 | 176 | 60.7 | 0 | 0 | 0 | 111.3 | I195 E196 L201 A202 T203 F218 C221 L251 T255 | I195-L199 PolarHBondContact O-N 2.94Å; E196-L199 PolarHBondContact O-N 2.7Å; L199-L201 VanDerWaalsContact C-N 3.32Å; L199-L201 PolarHBondContact O-N 3.44Å; L199-A202 PolarHBondContact O-N 3.42Å; L199-T203 PolarHBondContact O-N 3.29Å; L199-T203 PolarHBondContact O-OG1 2.83Å; L199-F218 HydrophobicContact CD1-CD1 3.98Å; L199-F218 HydrophobicContact CD1-CE1 3.75Å; L199-C221 PolarHBondContact N-SG 3.1Å; L199-C221 VanDerWaalsContact N-SG 3.38Å; L199-L251 HydrophobicContact CD2-CD1 4.31Å; L199-T255 HydrophobicContact CD1-CG2 4.25Å |
| 200 | K | 90.8 | Very high | 91.2 | Very high | 31 Ų | 31 | 25.4 Ų | 25.4 | 14% | 0.135 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -61.6 | -41.4 | 176.2 | -66.8 | 179.8 | -152.4 | -64.1 | 0 | 111.6 | F175 E196 M197 T203 I204 | F175-K200 HydrophobicContact CD1-CD 4.18Å; F175-K200 HydrophobicContact CD2-CB 4.31Å; F175-K200 HydrophobicContact CE1-CB 4.46Å; F175-K200 HydrophobicContact CE1-CD 3.37Å; F175-K200 HydrophobicContact CE2-CB 4.07Å; F175-K200 HydrophobicContact CE2-CD 4.05Å; F175-K200 HydrophobicContact CZ-CB 4.16Å; F175-K200 HydrophobicContact CZ-CD 3.3Å; F175-K200 HydrophobicContact CZ-CG 4.29Å; E196-K200 WeakPolarHBondContact O-CG 3.49Å; E196-K200 PolarHBondContact O-N 2.89Å; E196-K200 WeakPolarHBondContact OE1-CE 3.43Å; E196-K200 IonicContact OE1-NZ 2.73Å; E196-K200 PolarHBondContact OE1-NZ 3.3Å; M197-K200 PolarHBondContact O-N 3.37Å; K200-T203 PolarHBondContact O-N 3.17Å; K200-I204 WeakPolarHBondContact O-CG1 3.46Å; K200-I204 PolarHBondContact O-N 2.93Å |
| 201 | L | 95.2 | Very high | 91.3 | Very high | 8 Ų | 8 | 25.9 Ų | 25.9 | 4% | 0.042 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -64.7 | -42.2 | 175.4 | -75.1 | 169.9 | 0 | 0 | 0 | 112.2 | E172 F175 K176 M179 M197 S198 L199 T203 I204 Y205 | E172-L201 HydrophobicContact CG-CD2 4.1Å; F175-L201 HydrophobicContact CB-CD2 3.81Å; F175-L201 HydrophobicContact CB-CG 4.05Å; K176-L201 HydrophobicContact CG-CD1 4.16Å; K176-L201 HydrophobicContact CG-CD2 4.12Å; M179-L201 HydrophobicContact CE-CD1 3.44Å; M179-L201 VanDerWaalsContact CE-CD1 3.44Å; M179-L201 HydrophobicContact SD-CD1 4.18Å; M197-L201 WeakPolarHBondContact O-CG 2.95Å; M197-L201 PolarHBondContact O-N 3.35Å; S198-L201 PolarHBondContact O-N 2.87Å; L199-L201 VanDerWaalsContact C-N 3.32Å; L199-L201 PolarHBondContact O-N 3.44Å; L201-T203 VanDerWaalsContact C-N 3.31Å; L201-T203 PolarHBondContact O-N 2.97Å; L201-I204 PolarHBondContact O-N 3.44Å; L201-I204 VanDerWaalsContact O-N 3.16Å; L201-Y205 HydrophobicContact CB-CE2 4.15Å; L201-Y205 WeakPolarHBondContact O-CD2 3.47Å; L201-Y205 PolarHBondContact O-N 3.1Å |
| 202 | A | 93.3 | Very high | 91.5 | Very high | 1 Ų | 1 | 31.1 Ų | 31.1 | 1% | 0.008 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -58 | -44.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | S198 L199 Y205 A206 F218 | S198-A202 PolarHBondContact O-N 2.99Å; L199-A202 PolarHBondContact O-N 3.42Å; A202-Y205 PolarHBondContact O-N 2.97Å; A202-A206 PolarHBondContact O-N 3.38Å; A202-F218 HydrophobicContact CB-CD1 4.08Å; A202-F218 HydrophobicContact CB-CD2 4.25Å; A202-F218 HydrophobicContact CB-CE1 4.06Å; A202-F218 HydrophobicContact CB-CE2 4.24Å; A202-F218 HydrophobicContact CB-CG 4.16Å; A202-F218 HydrophobicContact CB-CZ 4.15Å |
| 203 | T | 90.1 | Very high | 91.8 | Very high | 34 Ų | 34 | 34.8 Ų | 34.8 | 21% | 0.209 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -64.9 | -38.9 | 175.4 | -58 | 0 | 0 | 0 | 0 | 112.5 | L199 K200 L201 A206 G207 | L199-T203 PolarHBondContact O-N 3.29Å; L199-T203 PolarHBondContact O-OG1 2.83Å; K200-T203 PolarHBondContact O-N 3.17Å; L201-T203 VanDerWaalsContact C-N 3.31Å; L201-T203 PolarHBondContact O-N 2.97Å; T203-A206 WeakPolarHBondContact O-CB 3.36Å; T203-A206 PolarHBondContact O-N 3.25Å; T203-G207 PolarHBondContact O-N 3.4Å |
| 204 | I | 88.3 | Confident | 92.1 | Very high | 1 Ų | 1 | 34.6 Ų | 34.6 | 1% | 0.005 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -63.3 | -44.4 | 173.5 | -72.5 | 164.8 | 0 | 0 | 0 | 110.9 | Y163 L168 A171 E172 F175 K200 L201 A206 G207 Q208 | Y163-I204 HydrophobicContact CD2-CD1 4.26Å; Y163-I204 HydrophobicContact CD2-CG1 3.67Å; Y163-I204 HydrophobicContact CE2-CG1 3.8Å; L168-I204 HydrophobicContact CB-CG2 4.34Å; A171-I204 HydrophobicContact CB-CD1 3.83Å; E172-I204 HydrophobicContact CB-CG2 4.03Å; F175-I204 HydrophobicContact CD2-CD1 3.5Å; F175-I204 VanDerWaalsContact CD2-CD1 3.5Å; F175-I204 HydrophobicContact CE2-CD1 3.85Å; K200-I204 WeakPolarHBondContact O-CG1 3.46Å; K200-I204 PolarHBondContact O-N 2.93Å; L201-I204 PolarHBondContact O-N 3.44Å; L201-I204 VanDerWaalsContact O-N 3.16Å; I204-A206 VanDerWaalsContact C-N 3.32Å; I204-A206 PolarHBondContact O-N 3.49Å; I204-G207 PolarHBondContact O-N 2.82Å; I204-G207 VanDerWaalsContact O-N 3.16Å; I204-Q208 HydrophobicContact CG2-CG 4.37Å; I204-Q208 WeakPolarHBondContact O-CG 2.97Å; I204-Q208 PolarHBondContact O-N 3.04Å |
| 205 | Y | 93.6 | Very high | 92.2 | Very high | 26 Ų | 26 | 37.3 Ų | 37.3 | 10% | 0.102 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -61.8 | -40.5 | 176.8 | -64.2 | -34.9 | 0 | 0 | 0 | 111.9 | E172 K176 L201 A202 Q208 N209 K210 L213 | E172-Y205 HydrophobicContact CG-CE1 3.95Å; K176-Y205 WeakPolarHBondContact CE-OH 3.43Å; K176-Y205 PolarHBondContact NZ-OH 3.34Å; L201-Y205 HydrophobicContact CB-CE2 4.15Å; L201-Y205 WeakPolarHBondContact O-CD2 3.47Å; L201-Y205 PolarHBondContact O-N 3.1Å; A202-Y205 PolarHBondContact O-N 2.97Å; Y205-Q208 CarbonylContact O-C 3.4Å; Y205-Q208 PolarHBondContact O-N 3.24Å; Y205-N209 PolarHBondContact O-N 2.75Å; Y205-N209 VanDerWaalsContact O-N 3.16Å; Y205-K210 HydrophobicContact CD1-CD 3.96Å; Y205-K210 PolarHBondContact O-N 2.64Å; Y205-L213 HydrophobicContact CD1-CB 4.37Å; Y205-L213 HydrophobicContact CD1-CD1 4.19Å; Y205-L213 HydrophobicContact CD2-CB 3.53Å; Y205-L213 HydrophobicContact CE1-CD1 4.07Å; Y205-L213 HydrophobicContact CE2-CB 3.97Å; Y205-L213 HydrophobicContact CE2-CD1 4.43Å; Y205-L213 HydrophobicContact CG-CB 3.76Å; Y205-L213 HydrophobicContact CG-CD1 4.4Å |
| 206 | A | 86.8 | Confident | 92.4 | Very high | 21 Ų | 21 | 41.5 Ų | 41.5 | 17% | 0.174 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -58.4 | -47.7 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | A202 T203 I204 Q208 N209 A214 Y262 | A202-A206 PolarHBondContact O-N 3.38Å; T203-A206 WeakPolarHBondContact O-CB 3.36Å; T203-A206 PolarHBondContact O-N 3.25Å; I204-A206 VanDerWaalsContact C-N 3.32Å; I204-A206 PolarHBondContact O-N 3.49Å; A206-Q208 VanDerWaalsContact C-N 3.27Å; A206-Q208 PolarHBondContact O-N 3.2Å; A206-N209 PolarHBondContact O-N 2.68Å; A206-A214 HydrophobicContact CB-CB 4.03Å; A206-Y262 HydrophobicContact CB-CD2 3.51Å; A206-Y262 HydrophobicContact CB-CE2 3.91Å; A206-Y262 HydrophobicContact CB-CG 4.31Å |
| 207 | G | 85 | Confident | 92.7 | Very high | 46 Ų | 46 | 41.7 Ų | 41.7 | 47% | 0.474 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -63.9 | -28 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | T203 I204 N209 | T203-G207 PolarHBondContact O-N 3.4Å; I204-G207 PolarHBondContact O-N 2.82Å; I204-G207 VanDerWaalsContact O-N 3.16Å; G207-N209 VanDerWaalsContact C-N 3.31Å |
| 208 | Q | 87.8 | Confident | 93.1 | Very high | 33 Ų | 33 | 41.8 Ų | 41.8 | 15% | 0.154 | 24% | 0.236 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -84.7 | 0.7 | 174 | -70 | 170.4 | -29 | 0 | 0 | 113.3 | L168 D169 E172 I204 Y205 A206 K210 | L168-Q208 HydrophobicContact CB-CG 3.88Å; L168-Q208 HydrophobicContact CD1-CG 4.02Å; D169-Q208 PolarHBondContact OD1-NE2 3.42Å; E172-Q208 PolarHBondContact OE2-NE2 2.85Å; E172-Q208 PolarHBondContact OE2-OE1 2.99Å; E172-Q208 VanDerWaalsContact OE2-OE1 3.12Å; I204-Q208 HydrophobicContact CG2-CG 4.37Å; I204-Q208 WeakPolarHBondContact O-CG 2.97Å; I204-Q208 PolarHBondContact O-N 3.04Å; Y205-Q208 CarbonylContact O-C 3.4Å; Y205-Q208 PolarHBondContact O-N 3.24Å; A206-Q208 VanDerWaalsContact C-N 3.27Å; A206-Q208 PolarHBondContact O-N 3.2Å; Q208-K210 HydrophobicContact CB-CD 4.22Å; Q208-K210 HydrophobicContact CB-CG 4.03Å; Q208-K210 PolarHBondContact O-N 3.03Å; Q208-K210 VanDerWaalsContact OE1-CE 3.25Å |
| 209 | N | 90.1 | Very high | 93.3 | Very high | 130 Ų | 130 | 46 Ų | 46 | 70% | 0.695 | 25% | 0.254 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.1 | 26.1 | -171.5 | -54.7 | -72 | 0 | 0 | 0 | 114.3 | Y205 A206 G207 N211 | Y205-N209 PolarHBondContact O-N 2.75Å; Y205-N209 VanDerWaalsContact O-N 3.16Å; A206-N209 PolarHBondContact O-N 2.68Å; G207-N209 VanDerWaalsContact C-N 3.31Å; N209-N211 VanDerWaalsContact C-N 3.25Å; N209-N211 PolarHBondContact O-N 3.08Å; N209-N211 VanDerWaalsContact O-N 3.12Å |
| 210 | K | 94.8 | Very high | 93.5 | Very high | 72 Ų | 72 | 48.7 Ų | 48.7 | 31% | 0.313 | 27% | 0.266 | S | S | . | . | trans | -85.8 | 67.4 | 172.7 | -63.6 | 178.4 | -171 | 161.6 | 0 | 109.5 | E172 Y205 Q208 D212 L213 A214 | E172-K210 IonicContact OE1-NZ 2.67Å; E172-K210 IonicContact OE2-NZ 3.4Å; E172-K210 PolarHBondContact OE2-NZ 3.31Å; Y205-K210 HydrophobicContact CD1-CD 3.96Å; Y205-K210 PolarHBondContact O-N 2.64Å; Q208-K210 HydrophobicContact CB-CD 4.22Å; Q208-K210 HydrophobicContact CB-CG 4.03Å; Q208-K210 PolarHBondContact O-N 3.03Å; Q208-K210 VanDerWaalsContact OE1-CE 3.25Å; K210-D212 PolarHBondContact O-N 3.01Å; K210-L213 HydrophobicContact CB-CB 4.35Å; K210-L213 HydrophobicContact CB-CD1 4.23Å; K210-L213 HydrophobicContact CD-CD1 4.02Å; K210-L213 PolarHBondContact O-N 3.48Å; K210-L213 VanDerWaalsContact O-N 3.14Å; K210-A214 PolarHBondContact O-N 3.25Å | ||
| 211 | N | 93.4 | Very high | 93.8 | Very high | 70 Ų | 70 | 47.2 Ų | 47.2 | 37% | 0.374 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -56.4 | -43.5 | -166.8 | -64.2 | -24.9 | 0 | 0 | 0 | 114 | N209 L213 A214 E215 Y262 | N209-N211 VanDerWaalsContact C-N 3.25Å; N209-N211 PolarHBondContact O-N 3.08Å; N209-N211 VanDerWaalsContact O-N 3.12Å; N211-L213 VanDerWaalsContact C-N 3.32Å; N211-L213 PolarHBondContact O-N 2.98Å; N211-A214 PolarHBondContact O-N 3.39Å; N211-E215 WeakPolarHBondContact O-CG 3.44Å; N211-E215 PolarHBondContact O-N 2.95Å; N211-Y262 WeakPolarHBondContact CA-OH 3.06Å; N211-Y262 WeakPolarHBondContact CB-OH 3.32Å; N211-Y262 PolarHBondContact O-OH 3.43Å |
| 212 | D | 96.8 | Very high | 93.9 | Very high | 132 Ų | 132 | 47.7 Ų | 47.7 | 71% | 0.706 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -62.8 | -40.1 | -179.1 | -59.6 | -19.3 | 0 | 0 | 0 | 111.8 | K210 T216 | K210-D212 PolarHBondContact O-N 3.01Å; D212-T216 WeakPolarHBondContact O-CB 3.45Å; D212-T216 PolarHBondContact O-N 3.05Å; D212-T216 PolarHBondContact O-OG1 3.4Å |
| 213 | L | 97.6 | Very high | 94.2 | Very high | 82 Ų | 82 | 52.5 Ų | 52.5 | 43% | 0.429 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -71.7 | -36.8 | 177.1 | -66.1 | 178.3 | 0 | 0 | 0 | 111.9 | Y205 K210 N211 G217 | Y205-L213 HydrophobicContact CD1-CB 4.37Å; Y205-L213 HydrophobicContact CD1-CD1 4.19Å; Y205-L213 HydrophobicContact CD2-CB 3.53Å; Y205-L213 HydrophobicContact CE1-CD1 4.07Å; Y205-L213 HydrophobicContact CE2-CB 3.97Å; Y205-L213 HydrophobicContact CE2-CD1 4.43Å; Y205-L213 HydrophobicContact CG-CB 3.76Å; Y205-L213 HydrophobicContact CG-CD1 4.4Å; K210-L213 HydrophobicContact CB-CB 4.35Å; K210-L213 HydrophobicContact CB-CD1 4.23Å; K210-L213 HydrophobicContact CD-CD1 4.02Å; K210-L213 PolarHBondContact O-N 3.48Å; K210-L213 VanDerWaalsContact O-N 3.14Å; N211-L213 VanDerWaalsContact C-N 3.32Å; N211-L213 PolarHBondContact O-N 2.98Å; L213-G217 PolarHBondContact O-N 3.15Å |
| 214 | A | 93.4 | Very high | 94.6 | Very high | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -63.2 | -50.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | A206 K210 N211 T216 G217 F218 Y262 | A206-A214 HydrophobicContact CB-CB 4.03Å; K210-A214 PolarHBondContact O-N 3.25Å; N211-A214 PolarHBondContact O-N 3.39Å; A214-T216 PolarHBondContact O-N 2.89Å; A214-G217 PolarHBondContact O-N 2.95Å; A214-F218 HydrophobicContact CB-CE2 4.36Å; A214-F218 WeakPolarHBondContact O-CD2 3.42Å; A214-F218 PolarHBondContact O-N 3.49Å; A214-Y262 HydrophobicContact CB-CE1 4.49Å; A214-Y262 HydrophobicContact CB-CE2 4.15Å |
| 215 | E | 95.8 | Very high | 95 | Very high | 60 Ų | 60 | 51.9 Ų | 51.9 | 28% | 0.28 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -58.8 | -48.2 | 177.8 | -74.4 | -172.6 | -173.3 | 0 | 0 | 111.6 | N211 G217 F218 Q219 Y262 R268 | N211-E215 WeakPolarHBondContact O-CG 3.44Å; N211-E215 PolarHBondContact O-N 2.95Å; E215-G217 VanDerWaalsContact C-N 3.29Å; E215-G217 PolarHBondContact O-N 3.4Å; E215-F218 PolarHBondContact O-N 2.95Å; E215-Q219 VanDerWaalsContact O-CB 3.32Å; E215-Q219 WeakPolarHBondContact O-CB 3.34Å; E215-Q219 PolarHBondContact O-N 3.5Å; E215-Y262 HydrophobicContact CG-CE1 3.75Å; E215-R268 IonicContact OE1-CZ 2.72Å; E215-R268 IonicContact OE1-NH1 3.67Å; E215-R268 PolarHBondContact OE1-NH1 3.49Å; E215-R268 IonicContact OE1-NH2 3.68Å; E215-R268 PolarHBondContact OE1-NH2 2.72Å; E215-R268 IonicContact OE2-NH1 2.83Å |
| 216 | T | 98.1 | Very high | 95.2 | Very high | 88 Ų | 88 | 53.6 Ų | 53.6 | 54% | 0.54 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -59.7 | -41.8 | 176.9 | -54.9 | 0 | 0 | 0 | 0 | 111.5 | D212 A214 Q219 F220 | D212-T216 WeakPolarHBondContact O-CB 3.45Å; D212-T216 PolarHBondContact O-N 3.05Å; D212-T216 PolarHBondContact O-OG1 3.4Å; A214-T216 PolarHBondContact O-N 2.89Å; T216-Q219 PolarHBondContact O-N 3.29Å; T216-F220 WeakPolarHBondContact O-CB 3.28Å; T216-F220 PolarHBondContact O-N 3.43Å |
| 217 | G | 97.9 | Very high | 95.7 | Very high | 14 Ų | 14 | 55 Ų | 55 | 14% | 0.144 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -65.3 | -45.6 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113 | L213 A214 E215 F220 C221 | L213-G217 PolarHBondContact O-N 3.15Å; A214-G217 PolarHBondContact O-N 2.95Å; E215-G217 VanDerWaalsContact C-N 3.29Å; E215-G217 PolarHBondContact O-N 3.4Å; G217-F220 PolarHBondContact O-N 3.44Å; G217-C221 PolarHBondContact O-N 2.95Å; G217-C221 PolarHBondContact O-SG 2.87Å |
| 218 | F | 97.7 | Very high | 96.1 | Very high | 2 Ų | 2 | 54 Ų | 54 | 1% | 0.009 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -65.5 | -39.6 | 176.2 | -72.2 | -60.2 | 0 | 0 | 0 | 112.2 | L199 A202 A214 E215 C221 T222 H259 Y262 | L199-F218 HydrophobicContact CD1-CD1 3.98Å; L199-F218 HydrophobicContact CD1-CE1 3.75Å; A202-F218 HydrophobicContact CB-CD1 4.08Å; A202-F218 HydrophobicContact CB-CD2 4.25Å; A202-F218 HydrophobicContact CB-CE1 4.06Å; A202-F218 HydrophobicContact CB-CE2 4.24Å; A202-F218 HydrophobicContact CB-CG 4.16Å; A202-F218 HydrophobicContact CB-CZ 4.15Å; A214-F218 HydrophobicContact CB-CE2 4.36Å; A214-F218 WeakPolarHBondContact O-CD2 3.42Å; A214-F218 PolarHBondContact O-N 3.49Å; E215-F218 PolarHBondContact O-N 2.95Å; F218-C221 PolarHBondContact O-N 3.27Å; F218-T222 WeakPolarHBondContact O-CB 3.4Å; F218-T222 PolarHBondContact O-N 3.33Å; F218-T222 PolarHBondContact O-OG1 3.08Å; F218-H259 HydrophobicContact CB-CB 4.35Å; F218-H259 WeakPolarHBondContact CB-CD2 3.47Å; F218-H259 HydrophobicContact CD1-CB 3.88Å; F218-H259 AromaticContact CD2-CD2 3.63Å; F218-H259 HydrophobicContact CE1-CB 4.34Å; F218-H259 HydrophobicContact CG-CB 4.08Å; F218-H259 AromaticContact CG-CD2 3.49Å; F218-H259 VanDerWaalsContact CG-CD2 3.49Å; F218-H259 WeakPolarHBondContact CG-CD2 3.36Å; F218-Y262 AromaticContact CD2-CD1 3.94Å; F218-Y262 HydrophobicContact CD2-CD1 3.94Å; F218-Y262 HydrophobicContact CD2-CE1 4.5Å; F218-Y262 HydrophobicContact CD2-CG 4.36Å; F218-Y262 AromaticContact CE2-CD1 3.79Å; F218-Y262 HydrophobicContact CE2-CD1 3.79Å; F218-Y262 HydrophobicContact CE2-CD2 4.47Å; F218-Y262 AromaticContact CE2-CG 3.74Å; F218-Y262 HydrophobicContact CE2-CG 3.74Å |
| 219 | Q | 98.3 | Very high | 96.4 | Very high | 106 Ų | 106 | 53.3 Ų | 53.3 | 50% | 0.495 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -61.1 | -50.7 | 175.2 | -178 | 176 | -0.7 | 0 | 0 | 110.8 | E215 T216 C221 T222 E223 | E215-Q219 VanDerWaalsContact O-CB 3.32Å; E215-Q219 WeakPolarHBondContact O-CB 3.34Å; E215-Q219 PolarHBondContact O-N 3.5Å; T216-Q219 PolarHBondContact O-N 3.29Å; Q219-C221 VanDerWaalsContact C-N 3.33Å; Q219-C221 PolarHBondContact O-N 3.38Å; Q219-T222 PolarHBondContact O-N 3.22Å; Q219-E223 HydrophobicContact CG-CG 4.2Å; Q219-E223 WeakPolarHBondContact CG-OE1 3.28Å; Q219-E223 PolarHBondContact NE2-OE1 3.03Å; Q219-E223 WeakPolarHBondContact O-CB 3.49Å; Q219-E223 WeakPolarHBondContact O-CG 3.4Å; Q219-E223 PolarHBondContact O-N 3.02Å |
| 220 | F | 98.3 | Very high | 96.6 | Very high | 66 Ų | 66 | 51.7 Ų | 51.7 | 29% | 0.289 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -54.2 | -47.7 | 176.4 | 168.5 | -97.9 | 0 | 0 | 0 | 112.1 | I195 S198 T216 G217 S224 | I195-F220 HydrophobicContact CG1-CE1 4.48Å; S198-F220 WeakPolarHBondContact OG-CE1 3.23Å; T216-F220 WeakPolarHBondContact O-CB 3.28Å; T216-F220 PolarHBondContact O-N 3.43Å; G217-F220 PolarHBondContact O-N 3.44Å; F220-S224 WeakPolarHBondContact CE2-OG 3.42Å; F220-S224 WeakPolarHBondContact O-CB 3.43Å; F220-S224 PolarHBondContact O-N 3.37Å; F220-S224 PolarHBondContact O-OG 3.17Å |
| 221 | C | 97.9 | Very high | 96.4 | Very high | 0 Ų | 0 | 53.5 Ų | 53.5 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -61.9 | -47.1 | 179.7 | -63.4 | 0 | 0 | 0 | 0 | 111.5 | I195 L199 G217 F218 Q219 L225 T255 | I195-C221 HydrophobicContact CG2-CB 3.92Å; L199-C221 PolarHBondContact N-SG 3.1Å; L199-C221 VanDerWaalsContact N-SG 3.38Å; G217-C221 PolarHBondContact O-N 2.95Å; G217-C221 PolarHBondContact O-SG 2.87Å; F218-C221 PolarHBondContact O-N 3.27Å; Q219-C221 VanDerWaalsContact C-N 3.33Å; Q219-C221 PolarHBondContact O-N 3.38Å; C221-L225 WeakPolarHBondContact O-CB 3.43Å; C221-L225 VanDerWaalsContact O-CD1 3.3Å; C221-L225 WeakPolarHBondContact O-CD1 3.33Å; C221-L225 WeakPolarHBondContact O-CG 3.48Å; C221-L225 PolarHBondContact O-N 3.09Å; C221-L225 VanDerWaalsContact O-N 3.13Å; C221-T255 HydrophobicContact CB-CG2 3.58Å |
| 222 | T | 98.2 | Very high | 96.2 | Very high | 17 Ų | 17 | 51.1 Ų | 51.1 | 10% | 0.104 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -64 | -51.2 | -177.8 | -53.2 | 0 | 0 | 0 | 0 | 111.1 | F218 Q219 S224 L225 E226 L252 L256 | F218-T222 WeakPolarHBondContact O-CB 3.4Å; F218-T222 PolarHBondContact O-N 3.33Å; F218-T222 PolarHBondContact O-OG1 3.08Å; Q219-T222 PolarHBondContact O-N 3.22Å; T222-S224 PolarHBondContact O-N 3.41Å; T222-L225 PolarHBondContact O-N 2.73Å; T222-E226 HydrophobicContact CG2-CG 4.47Å; T222-E226 WeakPolarHBondContact CG2-OE1 3.34Å; T222-E226 WeakPolarHBondContact O-CB 3.43Å; T222-E226 WeakPolarHBondContact O-CG 3.38Å; T222-E226 PolarHBondContact O-N 3.04Å; T222-L252 HydrophobicContact CG2-CD1 4.09Å; T222-L256 HydrophobicContact CG2-CD2 4.42Å |
| 223 | E | 98.3 | Very high | 95.6 | Very high | 103 Ų | 103 | 51.4 Ų | 51.4 | 48% | 0.481 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -64.4 | -40.2 | -178.2 | -69.6 | 177.7 | 179 | 0 | 0 | 112.1 | Q219 A227 | Q219-E223 HydrophobicContact CG-CG 4.2Å; Q219-E223 WeakPolarHBondContact CG-OE1 3.28Å; Q219-E223 PolarHBondContact NE2-OE1 3.03Å; Q219-E223 WeakPolarHBondContact O-CB 3.49Å; Q219-E223 WeakPolarHBondContact O-CG 3.4Å; Q219-E223 PolarHBondContact O-N 3.02Å; E223-A227 WeakPolarHBondContact O-CB 3.34Å; E223-A227 PolarHBondContact O-N 3.33Å |
| 224 | S | 98.1 | Very high | 95.1 | Very high | 22 Ų | 22 | 55.4 Ų | 55.4 | 15% | 0.154 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -64.8 | -43 | 178.8 | -60.5 | 0 | 0 | 0 | 0 | 111.8 | F220 T222 K228 | F220-S224 WeakPolarHBondContact CE2-OG 3.42Å; F220-S224 WeakPolarHBondContact O-CB 3.43Å; F220-S224 PolarHBondContact O-N 3.37Å; F220-S224 PolarHBondContact O-OG 3.17Å; T222-S224 PolarHBondContact O-N 3.41Å; S224-K228 VanDerWaalsContact O-CB 3.27Å; S224-K228 WeakPolarHBondContact O-CB 3.05Å; S224-K228 PolarHBondContact O-N 3.37Å |
| 225 | L | 97.6 | Very high | 94.6 | Very high | 0 Ų | 0 | 58.6 Ų | 58.6 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -69.6 | -43.2 | 179 | -66.9 | 165.9 | 0 | 0 | 0 | 111.6 | I195 C221 T222 K228 L229 T248 L251 L252 | I195-L225 HydrophobicContact CD1-CD2 3.7Å; I195-L225 HydrophobicContact CD1-CG 4.02Å; I195-L225 HydrophobicContact CG2-CD1 3.89Å; I195-L225 HydrophobicContact CG2-CD2 4.06Å; I195-L225 HydrophobicContact CG2-CG 3.89Å; C221-L225 WeakPolarHBondContact O-CB 3.43Å; C221-L225 VanDerWaalsContact O-CD1 3.3Å; C221-L225 WeakPolarHBondContact O-CD1 3.33Å; C221-L225 WeakPolarHBondContact O-CG 3.48Å; C221-L225 PolarHBondContact O-N 3.09Å; C221-L225 VanDerWaalsContact O-N 3.13Å; T222-L225 PolarHBondContact O-N 2.73Å; L225-K228 PolarHBondContact O-N 3.24Å; L225-L229 WeakPolarHBondContact O-CB 3.28Å; L225-L229 VanDerWaalsContact O-CG 3.25Å; L225-L229 WeakPolarHBondContact O-CG 3.43Å; L225-L229 PolarHBondContact O-N 2.93Å; L225-T248 HydrophobicContact CD2-CG2 3.76Å; L225-L251 HydrophobicContact CD1-CB 4.41Å; L225-L251 HydrophobicContact CD1-CD2 4.47Å; L225-L251 HydrophobicContact CD1-CG 3.93Å; L225-L251 HydrophobicContact CD2-CB 4.28Å; L225-L251 HydrophobicContact CD2-CD2 3.82Å; L225-L251 HydrophobicContact CD2-CG 4.04Å; L225-L252 HydrophobicContact CB-CB 4.18Å; L225-L252 HydrophobicContact CB-CD1 4.24Å; L225-L252 HydrophobicContact CD1-CB 4.1Å; L225-L252 HydrophobicContact CD1-CD1 4.4Å |
| 226 | E | 97.4 | Very high | 93.8 | Very high | 62 Ų | 62 | 58.8 Ų | 58.8 | 29% | 0.29 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -62.4 | -48.6 | 176.2 | -74.1 | 176.4 | 177.2 | 0 | 0 | 111.3 | T222 K228 L229 E230 L252 R278 | T222-E226 HydrophobicContact CG2-CG 4.47Å; T222-E226 WeakPolarHBondContact CG2-OE1 3.34Å; T222-E226 WeakPolarHBondContact O-CB 3.43Å; T222-E226 WeakPolarHBondContact O-CG 3.38Å; T222-E226 PolarHBondContact O-N 3.04Å; E226-K228 VanDerWaalsContact C-N 3.25Å; E226-K228 PolarHBondContact O-N 2.73Å; E226-L229 PolarHBondContact O-N 3.36Å; E226-L229 VanDerWaalsContact O-N 3.07Å; E226-E230 WeakPolarHBondContact O-CG 3.09Å; E226-E230 PolarHBondContact O-N 3.21Å; E226-L252 HydrophobicContact CG-CD1 4.3Å; E226-L252 HydrophobicContact CG-CD2 4.08Å; E226-R278 IonicContact OE1-CZ 2.67Å; E226-R278 IonicContact OE1-NH1 3.58Å; E226-R278 PolarHBondContact OE1-NH1 3.04Å; E226-R278 IonicContact OE1-NH2 2.65Å; E226-R278 PolarHBondContact OE1-NH2 3.42Å |
| 227 | A | 96.4 | Very high | 92.5 | Very high | 51 Ų | 51 | 58.2 Ų | 58.2 | 42% | 0.421 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -59.2 | -38.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | E223 E230 K231 | E223-A227 WeakPolarHBondContact O-CB 3.34Å; E223-A227 PolarHBondContact O-N 3.33Å; A227-E230 PolarHBondContact O-N 3.35Å; A227-K231 WeakPolarHBondContact O-CG 3.38Å; A227-K231 PolarHBondContact O-N 2.92Å; A227-K231 VanDerWaalsContact O-N 3.13Å |
| 228 | K | 94.5 | Very high | 91.3 | Very high | 23 Ų | 23 | 65.6 Ų | 65.6 | 10% | 0.1 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -66.5 | -39.2 | 175.4 | -168.6 | 174 | -172 | 173 | 0 | 112.3 | D190 N192 S224 L225 E226 K231 F232 T248 | D190-K228 WeakPolarHBondContact O-CD 3.36Å; D190-K228 PolarHBondContact O-NZ 2.91Å; N192-K228 PolarHBondContact OD1-NZ 3.04Å; S224-K228 VanDerWaalsContact O-CB 3.27Å; S224-K228 WeakPolarHBondContact O-CB 3.05Å; S224-K228 PolarHBondContact O-N 3.37Å; L225-K228 PolarHBondContact O-N 3.24Å; E226-K228 VanDerWaalsContact C-N 3.25Å; E226-K228 PolarHBondContact O-N 2.73Å; K228-K231 PolarHBondContact O-N 2.92Å; K228-F232 HydrophobicContact CG-CD2 4.48Å; K228-F232 HydrophobicContact CG-CE2 3.96Å; K228-F232 WeakPolarHBondContact O-CD2 3.5Å; K228-F232 PolarHBondContact O-N 3.02Å; K228-F232 VanDerWaalsContact O-N 3.17Å; K228-T248 HydrophobicContact CB-CG2 4.44Å; K228-T248 HydrophobicContact CD-CG2 4.13Å; K228-T248 HydrophobicContact CG-CG2 4.4Å |
| 229 | L | 94.5 | Very high | 90.1 | Very high | 19 Ų | 19 | 71.9 Ų | 71.9 | 10% | 0.099 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -67.9 | -35 | 175.3 | -71.4 | 168.8 | 0 | 0 | 0 | 113 | L225 E226 F232 K233 R245 T248 R249 L252 | L225-L229 WeakPolarHBondContact O-CB 3.28Å; L225-L229 VanDerWaalsContact O-CG 3.25Å; L225-L229 WeakPolarHBondContact O-CG 3.43Å; L225-L229 PolarHBondContact O-N 2.93Å; E226-L229 PolarHBondContact O-N 3.36Å; E226-L229 VanDerWaalsContact O-N 3.07Å; L229-F232 HydrophobicContact CD2-CD2 4.28Å; L229-F232 PolarHBondContact O-N 2.97Å; L229-K233 PolarHBondContact O-N 3.49Å; L229-R245 HydrophobicContact CD2-CG 4.05Å; L229-T248 HydrophobicContact CD1-CG2 4.4Å; L229-T248 HydrophobicContact CD2-CG2 3.89Å; L229-T248 HydrophobicContact CG-CG2 3.83Å; L229-R249 HydrophobicContact CD1-CG 3.95Å; L229-R249 HydrophobicContact CD2-CG 3.47Å; L229-R249 VanDerWaalsContact CD2-CG 3.47Å; L229-R249 HydrophobicContact CG-CG 4.38Å; L229-L252 HydrophobicContact CD1-CD2 3.76Å |
| 230 | E | 93.8 | Very high | 89 | Confident | 96 Ų | 96 | 69.1 Ų | 69.1 | 45% | 0.449 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -65.3 | -43.8 | 172.4 | -66.1 | -49.6 | 134.5 | 0 | 0 | 111.4 | E226 A227 F232 K233 E234 | E226-E230 WeakPolarHBondContact O-CG 3.09Å; E226-E230 PolarHBondContact O-N 3.21Å; A227-E230 PolarHBondContact O-N 3.35Å; E230-F232 PolarHBondContact O-N 3.19Å; E230-K233 WeakPolarHBondContact O-CB 3.22Å; E230-K233 PolarHBondContact O-N 2.92Å; E230-K233 IonicContact OE1-NZ 3.63Å; E230-K233 PolarHBondContact OE1-NZ 3.47Å; E230-K233 WeakPolarHBondContact OE2-CD 3.44Å; E230-K233 IonicContact OE2-NZ 2.7Å; E230-K233 PolarHBondContact OE2-NZ 3.48Å; E230-E234 PolarHBondContact O-N 3.37Å |
| 231 | K | 90.9 | Very high | 88.4 | Confident | 111 Ų | 111 | 68.6 Ų | 68.6 | 48% | 0.483 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -57.2 | -37.1 | 174.4 | -69.4 | 173.6 | -172.2 | 174.4 | 0 | 112.4 | D190 A227 K228 K233 E234 L235 | D190-K231 IonicContact OD2-NZ 3.51Å; A227-K231 WeakPolarHBondContact O-CG 3.38Å; A227-K231 PolarHBondContact O-N 2.92Å; A227-K231 VanDerWaalsContact O-N 3.13Å; K228-K231 PolarHBondContact O-N 2.92Å; K231-K233 PolarHBondContact O-N 3.34Å; K231-E234 PolarHBondContact O-N 3.41Å; K231-L235 PolarHBondContact O-N 3.44Å |
| 232 | F | 87.8 | Confident | 87.8 | Confident | 20 Ų | 20 | 73.1 Ų | 73.1 | 9% | 0.088 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -61 | -32.6 | 175.7 | -80.3 | -59.9 | 0 | 0 | 0 | 113.1 | K228 L229 E230 E234 L235 Q240 L244 R245 | K228-F232 HydrophobicContact CG-CD2 4.48Å; K228-F232 HydrophobicContact CG-CE2 3.96Å; K228-F232 WeakPolarHBondContact O-CD2 3.5Å; K228-F232 PolarHBondContact O-N 3.02Å; K228-F232 VanDerWaalsContact O-N 3.17Å; L229-F232 HydrophobicContact CD2-CD2 4.28Å; L229-F232 PolarHBondContact O-N 2.97Å; E230-F232 PolarHBondContact O-N 3.19Å; F232-E234 VanDerWaalsContact C-N 3.3Å; F232-E234 PolarHBondContact O-N 2.86Å; F232-L235 HydrophobicContact CD1-CD1 4.29Å; F232-Q240 VanDerWaalsContact O-CD 3.26Å; F232-Q240 PolarHBondContact O-NE2 3.03Å; F232-L244 HydrophobicContact CE1-CD2 4.35Å; F232-L244 HydrophobicContact CZ-CB 4.31Å; F232-L244 HydrophobicContact CZ-CD2 3.73Å; F232-L244 HydrophobicContact CZ-CG 3.77Å; F232-R245 HydrophobicContact CD2-CB 4.43Å; F232-R245 HydrophobicContact CD2-CG 4.38Å; F232-R245 HydrophobicContact CG-CG 4.49Å |
| 233 | K | 85.6 | Confident | 87.2 | Confident | 138 Ų | 138 | 78.5 Ų | 78.5 | 60% | 0.6 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -72.2 | -25.5 | 178.5 | -60.4 | 175.9 | -167.2 | 164.6 | 0 | 112.9 | L229 E230 K231 | L229-K233 PolarHBondContact O-N 3.49Å; E230-K233 WeakPolarHBondContact O-CB 3.22Å; E230-K233 PolarHBondContact O-N 2.92Å; E230-K233 IonicContact OE1-NZ 3.63Å; E230-K233 PolarHBondContact OE1-NZ 3.47Å; E230-K233 WeakPolarHBondContact OE2-CD 3.44Å; E230-K233 IonicContact OE2-NZ 2.7Å; E230-K233 PolarHBondContact OE2-NZ 3.48Å; K231-K233 PolarHBondContact O-N 3.34Å |
| 234 | E | 86.9 | Confident | 86.7 | Confident | 166 Ų | 166 | 76.3 Ų | 76.3 | 78% | 0.776 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -82.7 | -21.2 | -178.8 | -62.9 | 179.2 | 171.2 | 0 | 0 | 112.7 | E230 K231 F232 | E230-E234 PolarHBondContact O-N 3.37Å; K231-E234 PolarHBondContact O-N 3.41Å; F232-E234 VanDerWaalsContact C-N 3.3Å; F232-E234 PolarHBondContact O-N 2.86Å |
| 235 | L | 82.6 | Confident | 86.3 | Confident | 67 Ų | 67 | 78.4 Ų | 78.4 | 35% | 0.351 | 40% | 0.396 | S | S | . | . | S | Bend | trans | -75.5 | 146.4 | -178.8 | -70.2 | 170.5 | 0 | 0 | 0 | 112 | K231 F232 Q240 | K231-L235 PolarHBondContact O-N 3.44Å; F232-L235 HydrophobicContact CD1-CD1 4.29Å; L235-Q240 HydrophobicContact CB-CG 4.05Å; L235-Q240 PolarHBondContact O-NE2 3.29Å |
| 236 | P | 78.6 | Confident | 85.9 | Confident | 64 Ų | 64 | 81.9 Ų | 81.9 | 42% | 0.416 | 41% | 0.413 | S | S | . | . | trans | -56 | 145.8 | 168.7 | -21.3 | 32.6 | 0 | 0 | 0 | 111.5 | E238 E239 Q240 | P236-E238 WeakPolarHBondContact CB-OE2 3.23Å; P236-E238 PolarHBondContact O-N 3.28Å; P236-E239 PolarHBondContact O-N 3.27Å; P236-Q240 PolarHBondContact O-N 3.01Å | ||
| 237 | A | 71.1 | Confident | 85.4 | Confident | 75 Ų | 75 | 81.4 Ų | 81.4 | 62% | 0.62 | 41% | 0.411 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58 | -27.2 | -175.2 | 0 | 0 | 0 | 0 | 0 | 113 | E239 | A237-E239 VanDerWaalsContact C-N 3.3Å; A237-E239 PolarHBondContact O-N 3.44Å |
| 238 | E | 72.8 | Confident | 85.2 | Confident | 170 Ų | 170 | 79 Ų | 79 | 79% | 0.794 | 39% | 0.391 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.8 | -20 | 178.5 | -57.7 | 79.4 | -171.5 | 0 | 0 | 113.7 | P236 | P236-E238 WeakPolarHBondContact CB-OE2 3.23Å; P236-E238 PolarHBondContact O-N 3.28Å |
| 239 | E | 72.7 | Confident | 85.2 | Confident | 134 Ų | 134 | 80.7 Ų | 80.7 | 63% | 0.626 | 40% | 0.397 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.7 | -7.3 | -179.4 | -64.2 | -178.4 | -171.5 | 0 | 0 | 112.5 | P236 A237 S241 | P236-E239 PolarHBondContact O-N 3.27Å; A237-E239 VanDerWaalsContact C-N 3.3Å; A237-E239 PolarHBondContact O-N 3.44Å; E239-S241 PolarHBondContact O-N 3.4Å |
| 240 | Q | 74.8 | Confident | 85 | Confident | 48 Ų | 48 | 81.6 Ų | 81.6 | 22% | 0.224 | 40% | 0.401 | C | S | . | . | trans | -78.6 | 113.5 | 178.7 | -67.4 | 179.4 | 35.7 | 0 | 0 | 110.5 | F232 L235 P236 E242 | F232-Q240 VanDerWaalsContact O-CD 3.26Å; F232-Q240 PolarHBondContact O-NE2 3.03Å; L235-Q240 HydrophobicContact CB-CG 4.05Å; L235-Q240 PolarHBondContact O-NE2 3.29Å; P236-Q240 PolarHBondContact O-N 3.01Å; Q240-E242 PolarHBondContact O-N 2.68Å; Q240-E242 VanDerWaalsContact O-N 3.12Å | ||
| 241 | S | 85.3 | Confident | 85 | Confident | 54 Ų | 54 | 77.3 Ų | 77.3 | 38% | 0.378 | 38% | 0.381 | S | S | . | . | trans | -75.4 | 99.1 | 164.8 | 176 | 0 | 0 | 0 | 0 | 108.8 | E239 E243 L244 R245 | E239-S241 PolarHBondContact O-N 3.4Å; S241-E243 PolarHBondContact O-N 3.12Å; S241-L244 PolarHBondContact O-N 3.38Å; S241-L244 VanDerWaalsContact O-N 3.14Å; S241-L244 WeakPolarHBondContact OG-CB 3.46Å; S241-L244 PolarHBondContact OG-N 3.32Å; S241-R245 PolarHBondContact O-N 3.35Å | ||
| 242 | E | 85.7 | Confident | 85.3 | Confident | 95 Ų | 95 | 72.5 Ų | 72.5 | 44% | 0.444 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -53.5 | -40 | 175.1 | -68 | -64.3 | 110 | 0 | 0 | 112.1 | Q240 R245 M246 | Q240-E242 PolarHBondContact O-N 2.68Å; Q240-E242 VanDerWaalsContact O-N 3.12Å; E242-R245 PolarHBondContact O-N 3.05Å; E242-R245 IonicContact OE1-CZ 3.99Å; E242-R245 IonicContact OE1-NH1 3.4Å; E242-R245 PolarHBondContact OE1-NH1 3.42Å; E242-R245 IonicContact OE1-NH2 4Å; E242-R245 IonicContact OE2-CZ 3.66Å; E242-R245 IonicContact OE2-NH1 2.68Å; E242-R245 PolarHBondContact OE2-NH1 2.85Å; E242-R245 IonicContact OE2-NH2 2.74Å; E242-R245 PolarHBondContact OE2-NH2 3.37Å; E242-M246 WeakPolarHBondContact O-CB 3.31Å; E242-M246 PolarHBondContact O-N 3.02Å |
| 243 | E | 86.7 | Confident | 85.5 | Confident | 130 Ų | 130 | 72 Ų | 72 | 61% | 0.607 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -61.9 | -50.3 | 176.1 | -176.3 | 175.4 | -169.2 | 0 | 0 | 111.2 | S241 R245 M246 E247 | S241-E243 PolarHBondContact O-N 3.12Å; E243-R245 VanDerWaalsContact C-N 3.34Å; E243-R245 PolarHBondContact O-N 2.88Å; E243-M246 PolarHBondContact O-N 2.83Å; E243-E247 WeakPolarHBondContact O-CG 3.45Å; E243-E247 PolarHBondContact O-N 3.19Å |
| 244 | L | 86.2 | Confident | 85.8 | Confident | 57 Ų | 57 | 66.9 Ų | 66.9 | 30% | 0.298 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -66.3 | -36 | 179.1 | -176.2 | 60.6 | 0 | 0 | 0 | 112.1 | F232 S241 T248 | F232-L244 HydrophobicContact CE1-CD2 4.35Å; F232-L244 HydrophobicContact CZ-CB 4.31Å; F232-L244 HydrophobicContact CZ-CD2 3.73Å; F232-L244 HydrophobicContact CZ-CG 3.77Å; S241-L244 PolarHBondContact O-N 3.38Å; S241-L244 VanDerWaalsContact O-N 3.14Å; S241-L244 WeakPolarHBondContact OG-CB 3.46Å; S241-L244 PolarHBondContact OG-N 3.32Å; L244-T248 WeakPolarHBondContact O-CB 2.96Å; L244-T248 PolarHBondContact O-N 2.94Å; L244-T248 PolarHBondContact O-OG1 3.35Å |
| 245 | R | 91.2 | Very high | 86 | Confident | 67 Ų | 67 | 59 Ų | 59 | 25% | 0.253 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -61.9 | -51 | 174.2 | -174.1 | -159 | 66.2 | -137.5 | -10 | 110.2 | L229 F232 S241 E242 E243 E247 T248 R249 | L229-R245 HydrophobicContact CD2-CG 4.05Å; F232-R245 HydrophobicContact CD2-CB 4.43Å; F232-R245 HydrophobicContact CD2-CG 4.38Å; F232-R245 HydrophobicContact CG-CG 4.49Å; S241-R245 PolarHBondContact O-N 3.35Å; E242-R245 PolarHBondContact O-N 3.05Å; E242-R245 IonicContact OE1-CZ 3.99Å; E242-R245 IonicContact OE1-NH1 3.4Å; E242-R245 PolarHBondContact OE1-NH1 3.42Å; E242-R245 IonicContact OE1-NH2 4Å; E242-R245 IonicContact OE2-CZ 3.66Å; E242-R245 IonicContact OE2-NH1 2.68Å; E242-R245 PolarHBondContact OE2-NH1 2.85Å; E242-R245 IonicContact OE2-NH2 2.74Å; E242-R245 PolarHBondContact OE2-NH2 3.37Å; E243-R245 VanDerWaalsContact C-N 3.34Å; E243-R245 PolarHBondContact O-N 2.88Å; R245-E247 PolarHBondContact O-N 3.4Å; R245-T248 WeakPolarHBondContact O-CB 3.41Å; R245-T248 PolarHBondContact O-N 2.97Å; R245-T248 VanDerWaalsContact O-N 3.15Å; R245-R249 WeakPolarHBondContact O-CG 3.44Å; R245-R249 PolarHBondContact O-N 3.3Å |
| 246 | M | 88.9 | Confident | 86.8 | Confident | 72 Ų | 72 | 55.9 Ų | 55.9 | 36% | 0.355 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -57.4 | -48 | 177 | 176.7 | -178.1 | 76.6 | 0 | 0 | 111.1 | E242 E243 T248 R249 L250 E286 | E242-M246 WeakPolarHBondContact O-CB 3.31Å; E242-M246 PolarHBondContact O-N 3.02Å; E243-M246 PolarHBondContact O-N 2.83Å; M246-T248 VanDerWaalsContact C-N 3.3Å; M246-T248 PolarHBondContact O-N 3.31Å; M246-R249 PolarHBondContact O-N 3.48Å; M246-L250 HydrophobicContact CG-CD1 4.09Å; M246-L250 WeakPolarHBondContact O-CG 2.94Å; M246-L250 PolarHBondContact O-N 3.43Å; M246-E286 WeakPolarHBondContact CG-OE2 2.96Å |
| 247 | E | 86.8 | Confident | 87.3 | Confident | 52 Ų | 52 | 52.8 Ų | 52.8 | 24% | 0.243 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -56.3 | -43.2 | 174.9 | -75.3 | -172.6 | 169 | 0 | 0 | 112.2 | E243 R245 L250 L251 | E243-E247 WeakPolarHBondContact O-CG 3.45Å; E243-E247 PolarHBondContact O-N 3.19Å; R245-E247 PolarHBondContact O-N 3.4Å; E247-L250 PolarHBondContact O-N 3.26Å; E247-L251 WeakPolarHBondContact O-CB 3.28Å; E247-L251 PolarHBondContact O-N 2.92Å |
| 248 | T | 92.1 | Very high | 88.2 | Confident | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -66.6 | -41 | 179.2 | -53.5 | 0 | 0 | 0 | 0 | 111.4 | N192 L225 K228 L229 L244 R245 M246 L251 L252 | N192-T248 PolarHBondContact ND2-OG1 3.05Å; N192-T248 PolarHBondContact OD1-OG1 3.47Å; L225-T248 HydrophobicContact CD2-CG2 3.76Å; K228-T248 HydrophobicContact CB-CG2 4.44Å; K228-T248 HydrophobicContact CD-CG2 4.13Å; K228-T248 HydrophobicContact CG-CG2 4.4Å; L229-T248 HydrophobicContact CD1-CG2 4.4Å; L229-T248 HydrophobicContact CD2-CG2 3.89Å; L229-T248 HydrophobicContact CG-CG2 3.83Å; L244-T248 WeakPolarHBondContact O-CB 2.96Å; L244-T248 PolarHBondContact O-N 2.94Å; L244-T248 PolarHBondContact O-OG1 3.35Å; R245-T248 WeakPolarHBondContact O-CB 3.41Å; R245-T248 PolarHBondContact O-N 2.97Å; R245-T248 VanDerWaalsContact O-N 3.15Å; M246-T248 VanDerWaalsContact C-N 3.3Å; M246-T248 PolarHBondContact O-N 3.31Å; T248-L251 PolarHBondContact O-N 3.04Å; T248-L252 PolarHBondContact O-N 2.94Å |
| 249 | R | 93.8 | Very high | 89.3 | Confident | 60 Ų | 60 | 43 Ų | 43 | 23% | 0.226 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -64.1 | -45.7 | 175.3 | -70.7 | -165.9 | 73.9 | -175.2 | 8.6 | 111.3 | L229 R245 M246 L251 L252 G253 I282 E285 E286 | L229-R249 HydrophobicContact CD1-CG 3.95Å; L229-R249 HydrophobicContact CD2-CG 3.47Å; L229-R249 VanDerWaalsContact CD2-CG 3.47Å; L229-R249 HydrophobicContact CG-CG 4.38Å; R245-R249 WeakPolarHBondContact O-CG 3.44Å; R245-R249 PolarHBondContact O-N 3.3Å; M246-R249 PolarHBondContact O-N 3.48Å; R249-L251 VanDerWaalsContact C-N 3.32Å; R249-L251 PolarHBondContact O-N 3.44Å; R249-L252 WeakPolarHBondContact O-CB 3.26Å; R249-L252 PolarHBondContact O-N 3.43Å; R249-L252 VanDerWaalsContact O-N 3.1Å; R249-G253 PolarHBondContact O-N 3.02Å; R249-I282 HydrophobicContact CB-CG2 4.3Å; R249-I282 VanDerWaalsContact O-CG2 3.23Å; R249-I282 WeakPolarHBondContact O-CG2 3.41Å; R249-E285 IonicContact CZ-OE2 3.51Å; R249-E285 VanDerWaalsContact CZ-OE2 3.25Å; R249-E285 IonicContact NH1-OE2 3.87Å; R249-E285 PolarHBondContact NH1-OE2 2.83Å; R249-E285 IonicContact NH2-OE2 2.73Å; R249-E285 PolarHBondContact NH2-OE2 3.41Å; R249-E286 HydrophobicContact CB-CG 4.19Å; R249-E286 WeakPolarHBondContact CD-OE1 3.45Å; R249-E286 IonicContact CZ-OE1 3.66Å; R249-E286 VanDerWaalsContact CZ-OE1 3.29Å; R249-E286 IonicContact NE-OE1 3.06Å; R249-E286 PolarHBondContact NE-OE1 3.44Å; R249-E286 IonicContact NH1-OE1 3.62Å; R249-E286 PolarHBondContact NH1-OE1 3.4Å |
| 250 | L | 91.4 | Very high | 90.2 | Very high | 38 Ų | 38 | 36.7 Ų | 36.7 | 20% | 0.199 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -61.7 | -40.5 | 177.3 | -69.7 | 174.5 | 0 | 0 | 0 | 112 | M246 E247 L252 G253 L254 E286 Q287 | M246-L250 HydrophobicContact CG-CD1 4.09Å; M246-L250 WeakPolarHBondContact O-CG 2.94Å; M246-L250 PolarHBondContact O-N 3.43Å; E247-L250 PolarHBondContact O-N 3.26Å; L250-L252 VanDerWaalsContact C-N 3.3Å; L250-L252 PolarHBondContact O-N 3.27Å; L250-G253 PolarHBondContact O-N 2.74Å; L250-L254 WeakPolarHBondContact O-CG 3.48Å; L250-L254 PolarHBondContact O-N 3.04Å; L250-E286 HydrophobicContact CD2-CB 3.73Å; L250-E286 HydrophobicContact CD2-CG 4.31Å; L250-E286 HydrophobicContact CG-CB 4.27Å; L250-Q287 HydrophobicContact CD2-CG 3.81Å |
| 251 | L | 92.5 | Very high | 90.9 | Very high | 5 Ų | 5 | 37.8 Ų | 37.8 | 3% | 0.026 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -64.2 | -34.7 | 174.3 | -176.3 | 56.5 | 0 | 0 | 0 | 112.3 | N192 I195 E196 L199 L225 E247 T248 R249 L254 T255 | N192-L251 HydrophobicContact CB-CD2 3.88Å; N192-L251 WeakPolarHBondContact O-CD2 3.49Å; I195-L251 HydrophobicContact CB-CD2 4.27Å; I195-L251 HydrophobicContact CG2-CD2 4.18Å; E196-L251 HydrophobicContact CB-CD1 4.4Å; E196-L251 HydrophobicContact CG-CD1 4.45Å; L199-L251 HydrophobicContact CD2-CD1 4.31Å; L225-L251 HydrophobicContact CD1-CB 4.41Å; L225-L251 HydrophobicContact CD1-CD2 4.47Å; L225-L251 HydrophobicContact CD1-CG 3.93Å; L225-L251 HydrophobicContact CD2-CB 4.28Å; L225-L251 HydrophobicContact CD2-CD2 3.82Å; L225-L251 HydrophobicContact CD2-CG 4.04Å; E247-L251 WeakPolarHBondContact O-CB 3.28Å; E247-L251 PolarHBondContact O-N 2.92Å; T248-L251 PolarHBondContact O-N 3.04Å; R249-L251 VanDerWaalsContact C-N 3.32Å; R249-L251 PolarHBondContact O-N 3.44Å; L251-L254 PolarHBondContact O-N 3.26Å; L251-T255 WeakPolarHBondContact O-CB 3.49Å; L251-T255 PolarHBondContact O-N 2.85Å; L251-T255 PolarHBondContact O-OG1 2.93Å |
| 252 | L | 97.1 | Very high | 91.1 | Very high | 11 Ų | 11 | 36 Ų | 36 | 6% | 0.058 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -65.5 | -43.7 | 171.8 | 177 | 61.3 | 0 | 0 | 0 | 111.1 | T222 L225 E226 L229 T248 R249 L250 L254 T255 L256 I282 | T222-L252 HydrophobicContact CG2-CD1 4.09Å; L225-L252 HydrophobicContact CB-CB 4.18Å; L225-L252 HydrophobicContact CB-CD1 4.24Å; L225-L252 HydrophobicContact CD1-CB 4.1Å; L225-L252 HydrophobicContact CD1-CD1 4.4Å; E226-L252 HydrophobicContact CG-CD1 4.3Å; E226-L252 HydrophobicContact CG-CD2 4.08Å; L229-L252 HydrophobicContact CD1-CD2 3.76Å; T248-L252 PolarHBondContact O-N 2.94Å; R249-L252 WeakPolarHBondContact O-CB 3.26Å; R249-L252 PolarHBondContact O-N 3.43Å; R249-L252 VanDerWaalsContact O-N 3.1Å; L250-L252 VanDerWaalsContact C-N 3.3Å; L250-L252 PolarHBondContact O-N 3.27Å; L252-L254 VanDerWaalsContact C-N 3.33Å; L252-L254 PolarHBondContact O-N 2.93Å; L252-T255 WeakPolarHBondContact O-CB 3.05Å; L252-T255 PolarHBondContact O-N 3.46Å; L252-L256 HydrophobicContact CD1-CD1 4.05Å; L252-L256 HydrophobicContact CD1-CG 4.11Å; L252-L256 HydrophobicContact CG-CD1 3.94Å; L252-L256 HydrophobicContact CG-CG 4.46Å; L252-L256 WeakPolarHBondContact O-CB 3.48Å; L252-L256 VanDerWaalsContact O-CG 3.3Å; L252-L256 WeakPolarHBondContact O-CG 3.38Å; L252-L256 PolarHBondContact O-N 3.25Å; L252-I282 HydrophobicContact CB-CD1 4.33Å; L252-I282 HydrophobicContact CD2-CD1 3.92Å; L252-I282 HydrophobicContact CG-CD1 3.87Å |
| 253 | G | 93.3 | Very high | 91.4 | Very high | 8 Ų | 8 | 31.6 Ų | 31.6 | 8% | 0.082 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -56 | -45.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | R249 L250 L256 D257 A279 | R249-G253 PolarHBondContact O-N 3.02Å; L250-G253 PolarHBondContact O-N 2.74Å; G253-L256 PolarHBondContact O-N 2.95Å; G253-D257 PolarHBondContact O-N 3.11Å; G253-A279 WeakPolarHBondContact O-CB 3.34Å |
| 254 | L | 90.8 | Very high | 91.3 | Very high | 32 Ų | 32 | 25.5 Ų | 25.5 | 17% | 0.168 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -66.5 | -37 | 176.4 | -69.9 | 171.8 | 0 | 0 | 0 | 113.3 | F20 L28 L250 L251 L252 S258 | F20-L254 HydrophobicContact CE2-CD2 4.25Å; L28-L254 HydrophobicContact CD1-CD1 3.88Å; L28-L254 HydrophobicContact CD2-CD1 3.9Å; L28-L254 HydrophobicContact CG-CD1 4.29Å; L250-L254 WeakPolarHBondContact O-CG 3.48Å; L250-L254 PolarHBondContact O-N 3.04Å; L251-L254 PolarHBondContact O-N 3.26Å; L252-L254 VanDerWaalsContact C-N 3.33Å; L252-L254 PolarHBondContact O-N 2.93Å; L254-S258 WeakPolarHBondContact O-CB 3.24Å; L254-S258 PolarHBondContact O-N 3.47Å; L254-S258 PolarHBondContact O-OG 2.93Å |
| 255 | T | 92.9 | Very high | 91.3 | Very high | 0 Ų | 0 | 25 Ų | 25 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -63.2 | -46.7 | 175.7 | -61.6 | 0 | 0 | 0 | 0 | 110.3 | L199 C221 L251 L252 S258 H259 | L199-T255 HydrophobicContact CD1-CG2 4.25Å; C221-T255 HydrophobicContact CB-CG2 3.58Å; L251-T255 WeakPolarHBondContact O-CB 3.49Å; L251-T255 PolarHBondContact O-N 2.85Å; L251-T255 PolarHBondContact O-OG1 2.93Å; L252-T255 WeakPolarHBondContact O-CB 3.05Å; L252-T255 PolarHBondContact O-N 3.46Å; T255-S258 PolarHBondContact O-N 2.72Å; T255-H259 VanDerWaalsContact O-CB 3.28Å; T255-H259 WeakPolarHBondContact O-CB 3.47Å; T255-H259 PolarHBondContact O-N 3.49Å |
| 256 | L | 97.4 | Very high | 91.2 | Very high | 1 Ų | 1 | 23.7 Ų | 23.7 | 1% | 0.005 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -65.4 | -41.8 | 178.5 | -69.4 | 166.6 | 0 | 0 | 0 | 112 | T222 L252 G253 H259 A260 D275 R278 A279 I282 | T222-L256 HydrophobicContact CG2-CD2 4.42Å; L252-L256 HydrophobicContact CD1-CD1 4.05Å; L252-L256 HydrophobicContact CD1-CG 4.11Å; L252-L256 HydrophobicContact CG-CD1 3.94Å; L252-L256 HydrophobicContact CG-CG 4.46Å; L252-L256 WeakPolarHBondContact O-CB 3.48Å; L252-L256 VanDerWaalsContact O-CG 3.3Å; L252-L256 WeakPolarHBondContact O-CG 3.38Å; L252-L256 PolarHBondContact O-N 3.25Å; G253-L256 PolarHBondContact O-N 2.95Å; L256-H259 PolarHBondContact O-N 3.42Å; L256-A260 VanDerWaalsContact O-CB 3.26Å; L256-A260 WeakPolarHBondContact O-CB 3.36Å; L256-A260 PolarHBondContact O-N 2.97Å; L256-D275 HydrophobicContact CB-CB 4.47Å; L256-D275 HydrophobicContact CD2-CB 4.39Å; L256-R278 HydrophobicContact CD1-CB 3.78Å; L256-A279 HydrophobicContact CB-CB 3.92Å; L256-I282 HydrophobicContact CD1-CD1 3.94Å |
| 257 | D | 90.6 | Very high | 91.2 | Very high | 0 Ų | 0 | 27.4 Ų | 27.4 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -57.1 | -52 | 172.2 | 177.6 | 11 | 0 | 0 | 0 | 111.4 | G253 H259 A260 R261 Y276 Q293 L297 | G253-D257 PolarHBondContact O-N 3.11Å; D257-H259 VanDerWaalsContact C-N 3.32Å; D257-H259 PolarHBondContact O-N 3.46Å; D257-A260 WeakPolarHBondContact O-CB 3.12Å; D257-A260 PolarHBondContact O-N 3.37Å; D257-A260 VanDerWaalsContact O-N 3.15Å; D257-R261 WeakPolarHBondContact O-CG 3.41Å; D257-R261 PolarHBondContact O-N 2.82Å; D257-R261 IonicContact OD1-CZ 3.54Å; D257-R261 IonicContact OD1-NE 2.85Å; D257-R261 PolarHBondContact OD1-NE 2.84Å; D257-R261 IonicContact OD1-NH2 3.76Å; D257-R261 PolarHBondContact OD1-NH2 3.4Å; D257-R261 IonicContact OD2-NE 2.75Å; D257-R261 IonicContact OD2-NH2 3.92Å; D257-Y276 WeakPolarHBondContact OD1-CE1 3.5Å; D257-Q293 PolarHBondContact OD2-NE2 2.76Å; D257-L297 HydrophobicContact CB-CD2 3.95Å |
| 258 | S | 89.9 | Confident | 91.6 | Very high | 11 Ų | 11 | 29.1 Ų | 29.1 | 8% | 0.077 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -61.6 | -41.2 | -179.4 | -56.9 | 0 | 0 | 0 | 0 | 112.1 | L254 T255 R261 Y262 | L254-S258 WeakPolarHBondContact O-CB 3.24Å; L254-S258 PolarHBondContact O-N 3.47Å; L254-S258 PolarHBondContact O-OG 2.93Å; T255-S258 PolarHBondContact O-N 2.72Å; S258-R261 PolarHBondContact O-N 3.38Å; S258-Y262 PolarHBondContact O-N 2.92Å; S258-Y262 VanDerWaalsContact O-N 3.15Å |
| 259 | H | 95.1 | Very high | 91.7 | Very high | 29 Ų | 29 | 30.9 Ų | 30.9 | 13% | 0.134 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -67 | -39.2 | 176 | -174.7 | -125.2 | 0 | 0 | 0 | 111.9 | F218 T255 L256 D257 R261 Y262 M263 D275 | F218-H259 HydrophobicContact CB-CB 4.35Å; F218-H259 WeakPolarHBondContact CB-CD2 3.47Å; F218-H259 HydrophobicContact CD1-CB 3.88Å; F218-H259 AromaticContact CD2-CD2 3.63Å; F218-H259 HydrophobicContact CE1-CB 4.34Å; F218-H259 HydrophobicContact CG-CB 4.08Å; F218-H259 AromaticContact CG-CD2 3.49Å; F218-H259 VanDerWaalsContact CG-CD2 3.49Å; F218-H259 WeakPolarHBondContact CG-CD2 3.36Å; T255-H259 VanDerWaalsContact O-CB 3.28Å; T255-H259 WeakPolarHBondContact O-CB 3.47Å; T255-H259 PolarHBondContact O-N 3.49Å; L256-H259 PolarHBondContact O-N 3.42Å; D257-H259 VanDerWaalsContact C-N 3.32Å; D257-H259 PolarHBondContact O-N 3.46Å; H259-R261 VanDerWaalsContact C-N 3.35Å; H259-R261 PolarHBondContact O-N 3.43Å; H259-Y262 WeakPolarHBondContact O-CB 3.36Å; H259-Y262 PolarHBondContact O-N 3.21Å; H259-M263 WeakPolarHBondContact NE2-CE 3.4Å; H259-M263 WeakPolarHBondContact O-CB 3.49Å; H259-M263 WeakPolarHBondContact O-CG 3.36Å; H259-M263 PolarHBondContact O-N 2.9Å; H259-D275 IonicContact CE1-OD2 3.02Å; H259-D275 PolarHBondContact CE1-OD2 2.88Å; H259-D275 IonicContact CG-OD2 3.15Å; H259-D275 IonicContact ND1-OD2 2.65Å; H259-D275 PolarHBondContact ND1-OD2 3.38Å |
| 260 | A | 92.9 | Very high | 91.9 | Very high | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -60.9 | -43.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | L256 D257 Y262 M263 A264 A272 D275 Y276 | L256-A260 VanDerWaalsContact O-CB 3.26Å; L256-A260 WeakPolarHBondContact O-CB 3.36Å; L256-A260 PolarHBondContact O-N 2.97Å; D257-A260 WeakPolarHBondContact O-CB 3.12Å; D257-A260 PolarHBondContact O-N 3.37Å; D257-A260 VanDerWaalsContact O-N 3.15Å; A260-Y262 PolarHBondContact O-N 3.43Å; A260-M263 PolarHBondContact O-N 3.08Å; A260-A264 WeakPolarHBondContact O-CB 3.44Å; A260-A264 PolarHBondContact O-N 3.24Å; A260-A272 HydrophobicContact CB-CB 4.42Å; A260-A272 VanDerWaalsContact O-CB 3.3Å; A260-A272 WeakPolarHBondContact O-CB 3.4Å; A260-D275 HydrophobicContact CB-CB 3.71Å; A260-Y276 HydrophobicContact CB-CD1 3.79Å; A260-Y276 HydrophobicContact CB-CD2 3.62Å; A260-Y276 HydrophobicContact CB-CE1 3.74Å; A260-Y276 HydrophobicContact CB-CE2 3.55Å; A260-Y276 HydrophobicContact CB-CG 3.73Å |
| 261 | R | 88.1 | Confident | 92.1 | Very high | 72 Ų | 72 | 37.3 Ų | 37.3 | 27% | 0.272 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -58.8 | -45.8 | 173.9 | -68.2 | 172.9 | -167.7 | -105 | -6.7 | 111.5 | D257 S258 H259 A264 A265 Y276 D300 | D257-R261 WeakPolarHBondContact O-CG 3.41Å; D257-R261 PolarHBondContact O-N 2.82Å; D257-R261 IonicContact OD1-CZ 3.54Å; D257-R261 IonicContact OD1-NE 2.85Å; D257-R261 PolarHBondContact OD1-NE 2.84Å; D257-R261 IonicContact OD1-NH2 3.76Å; D257-R261 PolarHBondContact OD1-NH2 3.4Å; D257-R261 IonicContact OD2-NE 2.75Å; D257-R261 IonicContact OD2-NH2 3.92Å; S258-R261 PolarHBondContact O-N 3.38Å; H259-R261 VanDerWaalsContact C-N 3.35Å; H259-R261 PolarHBondContact O-N 3.43Å; R261-A264 PolarHBondContact O-N 3.03Å; R261-A265 WeakPolarHBondContact O-CB 3.47Å; R261-A265 PolarHBondContact O-N 2.68Å; R261-Y276 WeakPolarHBondContact CG-OH 3.2Å; R261-D300 IonicContact CZ-OD2 2.77Å; R261-D300 IonicContact NH2-OD2 3.87Å; R261-D300 PolarHBondContact NH2-OD2 3.36Å |
| 262 | Y | 89.4 | Confident | 92.2 | Very high | 15 Ų | 15 | 37 Ų | 37 | 6% | 0.059 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -63 | -43.8 | 175.9 | 171.3 | -110.9 | 0 | 0 | 0 | 112.5 | A206 N211 A214 E215 F218 S258 H259 A260 A264 A265 T266 | A206-Y262 HydrophobicContact CB-CD2 3.51Å; A206-Y262 HydrophobicContact CB-CE2 3.91Å; A206-Y262 HydrophobicContact CB-CG 4.31Å; N211-Y262 WeakPolarHBondContact CA-OH 3.06Å; N211-Y262 WeakPolarHBondContact CB-OH 3.32Å; N211-Y262 PolarHBondContact O-OH 3.43Å; A214-Y262 HydrophobicContact CB-CE1 4.49Å; A214-Y262 HydrophobicContact CB-CE2 4.15Å; E215-Y262 HydrophobicContact CG-CE1 3.75Å; F218-Y262 AromaticContact CD2-CD1 3.94Å; F218-Y262 HydrophobicContact CD2-CD1 3.94Å; F218-Y262 HydrophobicContact CD2-CE1 4.5Å; F218-Y262 HydrophobicContact CD2-CG 4.36Å; F218-Y262 AromaticContact CE2-CD1 3.79Å; F218-Y262 HydrophobicContact CE2-CD1 3.79Å; F218-Y262 HydrophobicContact CE2-CD2 4.47Å; F218-Y262 AromaticContact CE2-CG 3.74Å; F218-Y262 HydrophobicContact CE2-CG 3.74Å; S258-Y262 PolarHBondContact O-N 2.92Å; S258-Y262 VanDerWaalsContact O-N 3.15Å; H259-Y262 WeakPolarHBondContact O-CB 3.36Å; H259-Y262 PolarHBondContact O-N 3.21Å; A260-Y262 PolarHBondContact O-N 3.43Å; Y262-A264 VanDerWaalsContact C-N 3.33Å; Y262-A264 PolarHBondContact O-N 2.93Å; Y262-A265 PolarHBondContact O-N 3.41Å; Y262-T266 HydrophobicContact CD2-CG2 4.16Å; Y262-T266 HydrophobicContact CE2-CG2 3.7Å; Y262-T266 WeakPolarHBondContact O-CG2 3.31Å; Y262-T266 PolarHBondContact O-N 3.49Å; Y262-T266 PolarHBondContact O-OG1 3.16Å |
| 263 | M | 92.6 | Very high | 92.2 | Very high | 4 Ų | 4 | 37.1 Ų | 37.1 | 2% | 0.02 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -62.9 | -39.7 | 176.6 | -73.9 | -66.9 | 155.4 | 0 | 0 | 111.7 | H259 A260 T266 H267 R268 R271 A272 | H259-M263 WeakPolarHBondContact NE2-CE 3.4Å; H259-M263 WeakPolarHBondContact O-CB 3.49Å; H259-M263 WeakPolarHBondContact O-CG 3.36Å; H259-M263 PolarHBondContact O-N 2.9Å; A260-M263 PolarHBondContact O-N 3.08Å; M263-T266 WeakPolarHBondContact CA-OG1 3.31Å; M263-T266 CarbonylContact O-C 3.59Å; M263-T266 PolarHBondContact O-N 3.21Å; M263-T266 PolarHBondContact O-OG1 2.99Å; M263-T266 VanDerWaalsContact O-OG1 3.11Å; M263-H267 PolarHBondContact O-N 3.34Å; M263-R268 HydrophobicContact CB-CB 4.37Å; M263-R268 WeakPolarHBondContact O-CA 3.35Å; M263-R268 WeakPolarHBondContact O-CB 3.48Å; M263-R268 PolarHBondContact O-N 3.02Å; M263-R268 HydrophobicContact SD-CB 3.98Å; M263-R268 HydrophobicContact SD-CG 4.38Å; M263-R271 HydrophobicContact CB-CB 4.37Å; M263-R271 HydrophobicContact CG-CB 4.15Å; M263-R271 HydrophobicContact SD-CB 4.15Å; M263-A272 HydrophobicContact CB-CB 3.96Å |
| 264 | A | 85.3 | Confident | 92.4 | Very high | 2 Ų | 2 | 41.6 Ų | 41.6 | 2% | 0.017 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -66.2 | -42.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | F11 A260 R261 Y262 T266 H267 L269 A272 I304 | F11-A264 HydrophobicContact CE1-CB 3.73Å; F11-A264 VanDerWaalsContact CZ-C 3.47Å; F11-A264 HydrophobicContact CZ-CB 3.79Å; A260-A264 WeakPolarHBondContact O-CB 3.44Å; A260-A264 PolarHBondContact O-N 3.24Å; R261-A264 PolarHBondContact O-N 3.03Å; Y262-A264 VanDerWaalsContact C-N 3.33Å; Y262-A264 PolarHBondContact O-N 2.93Å; A264-T266 PolarHBondContact O-N 3.24Å; A264-H267 PolarHBondContact O-N 2.96Å; A264-L269 HydrophobicContact CB-CD2 4.37Å; A264-A272 HydrophobicContact CB-CB 3.95Å; A264-I304 HydrophobicContact CB-CD1 3.57Å |
| 265 | A | 84.9 | Confident | 92.7 | Very high | 47 Ų | 47 | 40.7 Ų | 40.7 | 39% | 0.388 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -63.2 | -31.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | F11 R261 Y262 H267 | F11-A265 HydrophobicContact CD1-CB 3.73Å; F11-A265 HydrophobicContact CE1-CB 3.71Å; F11-A265 HydrophobicContact CG-CB 4.35Å; F11-A265 HydrophobicContact CZ-CB 4.3Å; R261-A265 WeakPolarHBondContact O-CB 3.47Å; R261-A265 PolarHBondContact O-N 2.68Å; Y262-A265 PolarHBondContact O-N 3.41Å; A265-H267 VanDerWaalsContact C-N 3.27Å; A265-H267 PolarHBondContact O-N 3.12Å |
| 266 | T | 88.9 | Confident | 92.9 | Very high | 39 Ų | 39 | 41.2 Ų | 41.2 | 24% | 0.239 | 21% | 0.207 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -89.7 | 15 | 175.3 | 57.7 | 0 | 0 | 0 | 0 | 113.3 | Y262 M263 A264 R268 | Y262-T266 HydrophobicContact CD2-CG2 4.16Å; Y262-T266 HydrophobicContact CE2-CG2 3.7Å; Y262-T266 WeakPolarHBondContact O-CG2 3.31Å; Y262-T266 PolarHBondContact O-N 3.49Å; Y262-T266 PolarHBondContact O-OG1 3.16Å; M263-T266 WeakPolarHBondContact CA-OG1 3.31Å; M263-T266 CarbonylContact O-C 3.59Å; M263-T266 PolarHBondContact O-N 3.21Å; M263-T266 PolarHBondContact O-OG1 2.99Å; M263-T266 VanDerWaalsContact O-OG1 3.11Å; A264-T266 PolarHBondContact O-N 3.24Å; T266-R268 PolarHBondContact O-N 3.34Å |
| 267 | H | 90.6 | Very high | 93 | Very high | 149 Ų | 149 | 47.9 Ų | 47.9 | 69% | 0.69 | 24% | 0.236 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 62.3 | 19.8 | 178.8 | -57.3 | -63.5 | 0 | 0 | 0 | 115.7 | M263 A264 A265 L269 | M263-H267 PolarHBondContact O-N 3.34Å; A264-H267 PolarHBondContact O-N 2.96Å; A265-H267 VanDerWaalsContact C-N 3.27Å; A265-H267 PolarHBondContact O-N 3.12Å; H267-L269 VanDerWaalsContact C-N 3.31Å; H267-L269 PolarHBondContact O-N 2.96Å |
| 268 | R | 95.2 | Very high | 93.4 | Very high | 89 Ų | 89 | 52.2 Ų | 52.2 | 34% | 0.336 | 25% | 0.252 | S | S | . | . | trans | -93.2 | 58.5 | 175.7 | -56.1 | -176.6 | -162.7 | 170.5 | 7.9 | 110.9 | E215 M263 T266 S270 R271 A272 | E215-R268 IonicContact OE1-CZ 2.72Å; E215-R268 IonicContact OE1-NH1 3.67Å; E215-R268 PolarHBondContact OE1-NH1 3.49Å; E215-R268 IonicContact OE1-NH2 3.68Å; E215-R268 PolarHBondContact OE1-NH2 2.72Å; E215-R268 IonicContact OE2-NH1 2.83Å; M263-R268 HydrophobicContact CB-CB 4.37Å; M263-R268 WeakPolarHBondContact O-CA 3.35Å; M263-R268 WeakPolarHBondContact O-CB 3.48Å; M263-R268 PolarHBondContact O-N 3.02Å; M263-R268 HydrophobicContact SD-CB 3.98Å; M263-R268 HydrophobicContact SD-CG 4.38Å; T266-R268 PolarHBondContact O-N 3.34Å; R268-S270 VanDerWaalsContact C-N 3.28Å; R268-S270 PolarHBondContact O-N 3.3Å; R268-R271 HydrophobicContact CB-CB 4.5Å; R268-R271 PolarHBondContact O-N 2.9Å; R268-A272 PolarHBondContact O-N 3.47Å; R268-A272 VanDerWaalsContact O-N 3.14Å | ||
| 269 | L | 94.1 | Very high | 93.6 | Very high | 36 Ų | 36 | 51.7 Ų | 51.7 | 19% | 0.188 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -56.8 | -35.9 | -171 | -59 | -179.3 | 0 | 0 | 0 | 113.9 | A264 H267 R271 A272 A273 I304 L307 Q308 | A264-L269 HydrophobicContact CB-CD2 4.37Å; H267-L269 VanDerWaalsContact C-N 3.31Å; H267-L269 PolarHBondContact O-N 2.96Å; L269-R271 VanDerWaalsContact C-N 3.34Å; L269-R271 PolarHBondContact O-N 3.45Å; L269-A272 PolarHBondContact O-N 2.91Å; L269-A273 PolarHBondContact O-N 3.35Å; L269-I304 HydrophobicContact CB-CG2 4.2Å; L269-I304 HydrophobicContact CD2-CD1 4.33Å; L269-I304 VanDerWaalsContact O-CG2 3.29Å; L269-I304 WeakPolarHBondContact O-CG2 3.5Å; L269-L307 HydrophobicContact CD1-CB 3.76Å; L269-L307 HydrophobicContact CD2-CB 4.4Å; L269-L307 HydrophobicContact CD2-CD1 4.23Å; L269-Q308 HydrophobicContact CB-CG 3.75Å; L269-Q308 HydrophobicContact CD1-CG 4.04Å |
| 270 | S | 97.1 | Very high | 93.7 | Very high | 88 Ų | 88 | 51 Ų | 51 | 62% | 0.615 | 25% | 0.245 | S | C | * | . | H | α-helix | trans | -66.5 | -34.5 | 178.9 | -52.2 | 0 | 0 | 0 | 0 | 113.2 | R268 L274 Q308 | R268-S270 VanDerWaalsContact C-N 3.28Å; R268-S270 PolarHBondContact O-N 3.3Å; S270-L274 PolarHBondContact O-N 3.45Å; S270-Q308 VanDerWaalsContact CA-NE2 3.28Å; S270-Q308 PolarHBondContact OG-NE2 2.75Å |
| 271 | R | 96.1 | Very high | 93.9 | Very high | 145 Ų | 145 | 55.2 Ų | 55.2 | 55% | 0.547 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -72.6 | -43.1 | 174 | -67.6 | -170.9 | -179 | -176 | 1.5 | 110.6 | M263 R268 L269 A273 L274 D275 | M263-R271 HydrophobicContact CB-CB 4.37Å; M263-R271 HydrophobicContact CG-CB 4.15Å; M263-R271 HydrophobicContact SD-CB 4.15Å; R268-R271 HydrophobicContact CB-CB 4.5Å; R268-R271 PolarHBondContact O-N 2.9Å; L269-R271 VanDerWaalsContact C-N 3.34Å; L269-R271 PolarHBondContact O-N 3.45Å; R271-A273 VanDerWaalsContact C-N 3.33Å; R271-A273 PolarHBondContact O-N 3.25Å; R271-L274 WeakPolarHBondContact O-CB 3.45Å; R271-L274 PolarHBondContact O-N 2.88Å; R271-L274 VanDerWaalsContact O-N 3.12Å; R271-D275 PolarHBondContact O-N 3.45Å |
| 272 | A | 93.4 | Very high | 94.2 | Very high | 0 Ų | 0 | 52.5 Ų | 52.5 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -56.6 | -44.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | A260 M263 A264 R268 L269 L274 D275 Y276 I304 | A260-A272 HydrophobicContact CB-CB 4.42Å; A260-A272 VanDerWaalsContact O-CB 3.3Å; A260-A272 WeakPolarHBondContact O-CB 3.4Å; M263-A272 HydrophobicContact CB-CB 3.96Å; A264-A272 HydrophobicContact CB-CB 3.95Å; R268-A272 PolarHBondContact O-N 3.47Å; R268-A272 VanDerWaalsContact O-N 3.14Å; L269-A272 PolarHBondContact O-N 2.91Å; A272-L274 VanDerWaalsContact C-N 3.31Å; A272-L274 PolarHBondContact O-N 3.42Å; A272-D275 PolarHBondContact O-N 2.88Å; A272-Y276 HydrophobicContact CB-CE2 4.48Å; A272-Y276 WeakPolarHBondContact O-CB 3.45Å; A272-Y276 WeakPolarHBondContact O-CD2 3.45Å; A272-Y276 PolarHBondContact O-N 3.22Å; A272-I304 HydrophobicContact CB-CD1 4.45Å; A272-I304 HydrophobicContact CB-CG1 4.35Å; A272-I304 HydrophobicContact CB-CG2 4.26Å |
| 273 | A | 97.6 | Very high | 94.3 | Very high | 12 Ų | 12 | 52 Ų | 52 | 10% | 0.099 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -61.3 | -38.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | L269 R271 K277 L301 I304 | L269-A273 PolarHBondContact O-N 3.35Å; R271-A273 VanDerWaalsContact C-N 3.33Å; R271-A273 PolarHBondContact O-N 3.25Å; A273-K277 WeakPolarHBondContact O-CB 3.45Å; A273-K277 PolarHBondContact O-N 3.46Å; A273-L301 HydrophobicContact CB-CD1 4.14Å; A273-L301 WeakPolarHBondContact O-CD1 3.32Å; A273-I304 HydrophobicContact CB-CG2 3.83Å |
| 274 | L | 98.2 | Very high | 94.4 | Very high | 103 Ų | 103 | 54.2 Ų | 54.2 | 54% | 0.539 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -64.7 | -47.6 | 176.7 | -179 | 64.5 | 0 | 0 | 0 | 110.9 | S270 R271 A272 K277 R278 | S270-L274 PolarHBondContact O-N 3.45Å; R271-L274 WeakPolarHBondContact O-CB 3.45Å; R271-L274 PolarHBondContact O-N 2.88Å; R271-L274 VanDerWaalsContact O-N 3.12Å; A272-L274 VanDerWaalsContact C-N 3.31Å; A272-L274 PolarHBondContact O-N 3.42Å; L274-K277 PolarHBondContact O-N 3.14Å; L274-R278 WeakPolarHBondContact O-CG 3.36Å; L274-R278 PolarHBondContact O-N 3.1Å |
| 275 | D | 97.3 | Very high | 94.9 | Very high | 13 Ų | 13 | 59.1 Ų | 59.1 | 7% | 0.07 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -65.6 | -43.7 | -179.3 | -69.6 | -22.7 | 0 | 0 | 0 | 111.8 | L256 H259 A260 R271 A272 K277 R278 A279 | L256-D275 HydrophobicContact CB-CB 4.47Å; L256-D275 HydrophobicContact CD2-CB 4.39Å; H259-D275 IonicContact CE1-OD2 3.02Å; H259-D275 PolarHBondContact CE1-OD2 2.88Å; H259-D275 IonicContact CG-OD2 3.15Å; H259-D275 IonicContact ND1-OD2 2.65Å; H259-D275 PolarHBondContact ND1-OD2 3.38Å; A260-D275 HydrophobicContact CB-CB 3.71Å; R271-D275 PolarHBondContact O-N 3.45Å; A272-D275 PolarHBondContact O-N 2.88Å; D275-K277 VanDerWaalsContact C-N 3.33Å; D275-K277 PolarHBondContact O-N 3.27Å; D275-R278 PolarHBondContact O-N 3.33Å; D275-A279 WeakPolarHBondContact O-CB 3.49Å; D275-A279 PolarHBondContact O-N 2.82Å |
| 276 | Y | 97.1 | Very high | 95.2 | Very high | 11 Ų | 11 | 58.9 Ų | 58.9 | 4% | 0.043 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -59.6 | -41.9 | 173.7 | -80.3 | -53.2 | 0 | 0 | 0 | 112.5 | D257 A260 R261 A272 R278 A279 L280 L297 D300 I304 | D257-Y276 WeakPolarHBondContact OD1-CE1 3.5Å; A260-Y276 HydrophobicContact CB-CD1 3.79Å; A260-Y276 HydrophobicContact CB-CD2 3.62Å; A260-Y276 HydrophobicContact CB-CE1 3.74Å; A260-Y276 HydrophobicContact CB-CE2 3.55Å; A260-Y276 HydrophobicContact CB-CG 3.73Å; R261-Y276 WeakPolarHBondContact CG-OH 3.2Å; A272-Y276 HydrophobicContact CB-CE2 4.48Å; A272-Y276 WeakPolarHBondContact O-CB 3.45Å; A272-Y276 WeakPolarHBondContact O-CD2 3.45Å; A272-Y276 PolarHBondContact O-N 3.22Å; Y276-R278 VanDerWaalsContact C-N 3.32Å; Y276-R278 PolarHBondContact O-N 3.27Å; Y276-A279 PolarHBondContact O-N 2.81Å; Y276-L280 VanDerWaalsContact O-CB 3.23Å; Y276-L280 WeakPolarHBondContact O-CB 3.47Å; Y276-L280 PolarHBondContact O-N 2.94Å; Y276-L297 HydrophobicContact CD1-CD2 3.84Å; Y276-L297 HydrophobicContact CE1-CD2 4.26Å; Y276-D300 HydrophobicContact CD1-CB 4.07Å; Y276-D300 HydrophobicContact CE1-CB 3.66Å; Y276-D300 HydrophobicContact CE2-CB 4.27Å; Y276-I304 HydrophobicContact CD2-CG1 3.6Å; Y276-I304 HydrophobicContact CE2-CD1 4.05Å; Y276-I304 HydrophobicContact CE2-CG1 3.44Å; Y276-I304 VanDerWaalsContact CE2-CG1 3.44Å |
| 277 | K | 98.5 | Very high | 95.2 | Very high | 141 Ų | 141 | 60.5 Ų | 60.5 | 61% | 0.613 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -61.7 | -41.4 | 176.8 | -175.4 | 177.5 | -179.6 | 179.1 | 0 | 111.7 | A273 L274 D275 L281 L301 | A273-K277 WeakPolarHBondContact O-CB 3.45Å; A273-K277 PolarHBondContact O-N 3.46Å; L274-K277 PolarHBondContact O-N 3.14Å; D275-K277 VanDerWaalsContact C-N 3.33Å; D275-K277 PolarHBondContact O-N 3.27Å; K277-L281 PolarHBondContact O-N 3.08Å; K277-L281 VanDerWaalsContact O-N 3.14Å; K277-L301 HydrophobicContact CB-CD2 4.35Å |
| 278 | R | 98.5 | Very high | 95.2 | Very high | 90 Ų | 90 | 54.7 Ų | 54.7 | 34% | 0.34 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -69 | -44.2 | 177.6 | -67.6 | 176.5 | 70.2 | -163.8 | 1.9 | 111.7 | E226 L256 L274 D275 Y276 L280 L281 I282 | E226-R278 IonicContact OE1-CZ 2.67Å; E226-R278 IonicContact OE1-NH1 3.58Å; E226-R278 PolarHBondContact OE1-NH1 3.04Å; E226-R278 IonicContact OE1-NH2 2.65Å; E226-R278 PolarHBondContact OE1-NH2 3.42Å; L256-R278 HydrophobicContact CD1-CB 3.78Å; L274-R278 WeakPolarHBondContact O-CG 3.36Å; L274-R278 PolarHBondContact O-N 3.1Å; D275-R278 PolarHBondContact O-N 3.33Å; Y276-R278 VanDerWaalsContact C-N 3.32Å; Y276-R278 PolarHBondContact O-N 3.27Å; R278-L280 VanDerWaalsContact C-N 3.34Å; R278-L281 PolarHBondContact O-N 3.49Å; R278-I282 WeakPolarHBondContact O-CG1 3.27Å; R278-I282 PolarHBondContact O-N 3.13Å; R278-I282 VanDerWaalsContact O-N 3.14Å |
| 279 | A | 95 | Very high | 95.1 | Very high | 0 Ų | 0 | 55.5 Ų | 55.5 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -60.4 | -44.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | G253 L256 D275 Y276 I282 C283 L297 | G253-A279 WeakPolarHBondContact O-CB 3.34Å; L256-A279 HydrophobicContact CB-CB 3.92Å; D275-A279 WeakPolarHBondContact O-CB 3.49Å; D275-A279 PolarHBondContact O-N 2.82Å; Y276-A279 PolarHBondContact O-N 2.81Å; A279-I282 PolarHBondContact O-N 2.99Å; A279-C283 WeakPolarHBondContact O-CB 3.33Å; A279-C283 PolarHBondContact O-N 3.41Å; A279-L297 HydrophobicContact CB-CD1 4.1Å; A279-L297 HydrophobicContact CB-CD2 3.88Å |
| 280 | L | 96.6 | Very high | 94.9 | Very high | 14 Ų | 14 | 57.2 Ų | 57.2 | 7% | 0.073 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -59.5 | -47.8 | 177.4 | 176.4 | 61.8 | 0 | 0 | 0 | 111.3 | Y276 R278 I282 C283 Q284 S294 L297 L298 L301 | Y276-L280 VanDerWaalsContact O-CB 3.23Å; Y276-L280 WeakPolarHBondContact O-CB 3.47Å; Y276-L280 PolarHBondContact O-N 2.94Å; R278-L280 VanDerWaalsContact C-N 3.34Å; L280-I282 VanDerWaalsContact C-N 3.35Å; L280-I282 PolarHBondContact O-N 3.46Å; L280-C283 PolarHBondContact O-N 2.8Å; L280-Q284 HydrophobicContact CD1-CG 3.93Å; L280-Q284 HydrophobicContact CG-CG 4.35Å; L280-Q284 WeakPolarHBondContact O-CB 3.42Å; L280-Q284 WeakPolarHBondContact O-CG 3.3Å; L280-Q284 PolarHBondContact O-N 3.18Å; L280-S294 VanDerWaalsContact CD1-O 3.26Å; L280-S294 WeakPolarHBondContact CD1-O 3.49Å; L280-L297 HydrophobicContact CB-CB 4.09Å; L280-L297 HydrophobicContact CD1-CB 3.96Å; L280-L298 HydrophobicContact CD1-CB 4.2Å; L280-L298 HydrophobicContact CD2-CB 4.37Å; L280-L298 HydrophobicContact CD2-CD1 3.81Å; L280-L301 HydrophobicContact CD2-CD2 4.36Å |
| 281 | L | 98.4 | Very high | 94.3 | Very high | 90 Ų | 90 | 55.1 Ų | 55.1 | 47% | 0.471 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -57.7 | -48.2 | 178.5 | 179.5 | 65.7 | 0 | 0 | 0 | 111.5 | K277 R278 C283 Q284 E285 | K277-L281 PolarHBondContact O-N 3.08Å; K277-L281 VanDerWaalsContact O-N 3.14Å; R278-L281 PolarHBondContact O-N 3.49Å; L281-C283 VanDerWaalsContact C-N 3.33Å; L281-C283 PolarHBondContact O-N 3.2Å; L281-Q284 PolarHBondContact O-N 3.44Å; L281-E285 HydrophobicContact CD1-CG 4.32Å; L281-E285 WeakPolarHBondContact CD1-OE1 3.43Å; L281-E285 WeakPolarHBondContact O-CB 3.49Å; L281-E285 WeakPolarHBondContact O-CG 3.39Å; L281-E285 PolarHBondContact O-N 3.09Å |
| 282 | I | 94.1 | Very high | 93.7 | Very high | 14 Ų | 14 | 50.7 Ų | 50.7 | 7% | 0.072 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -58.3 | -47.3 | 177 | -70.4 | 169.4 | 0 | 0 | 0 | 110.6 | R249 L252 L256 R278 A279 L280 Q284 E285 E286 | R249-I282 HydrophobicContact CB-CG2 4.3Å; R249-I282 VanDerWaalsContact O-CG2 3.23Å; R249-I282 WeakPolarHBondContact O-CG2 3.41Å; L252-I282 HydrophobicContact CB-CD1 4.33Å; L252-I282 HydrophobicContact CD2-CD1 3.92Å; L252-I282 HydrophobicContact CG-CD1 3.87Å; L256-I282 HydrophobicContact CD1-CD1 3.94Å; R278-I282 WeakPolarHBondContact O-CG1 3.27Å; R278-I282 PolarHBondContact O-N 3.13Å; R278-I282 VanDerWaalsContact O-N 3.14Å; A279-I282 PolarHBondContact O-N 2.99Å; L280-I282 VanDerWaalsContact C-N 3.35Å; L280-I282 PolarHBondContact O-N 3.46Å; I282-Q284 PolarHBondContact O-N 3.46Å; I282-E285 PolarHBondContact O-N 2.87Å; I282-E286 HydrophobicContact CG2-CG 4.43Å; I282-E286 WeakPolarHBondContact O-CB 3.42Å; I282-E286 WeakPolarHBondContact O-CG 3.29Å; I282-E286 PolarHBondContact O-N 2.92Å |
| 283 | C | 91.5 | Very high | 93.2 | Very high | 6 Ų | 6 | 52.4 Ų | 52.4 | 4% | 0.041 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -64.3 | -41.3 | -177.9 | -168.3 | 0 | 0 | 0 | 0 | 112 | A279 L280 L281 Q287 G288 S294 L297 | A279-C283 WeakPolarHBondContact O-CB 3.33Å; A279-C283 PolarHBondContact O-N 3.41Å; L280-C283 PolarHBondContact O-N 2.8Å; L281-C283 VanDerWaalsContact C-N 3.33Å; L281-C283 PolarHBondContact O-N 3.2Å; C283-Q287 WeakPolarHBondContact O-CA 3.32Å; C283-Q287 WeakPolarHBondContact O-CB 3.27Å; C283-Q287 PolarHBondContact O-N 3.14Å; C283-Q287 PolarHBondContact SG-OE1 3.38Å; C283-G288 PolarHBondContact O-N 2.93Å; C283-S294 PolarHBondContact SG-N 2.96Å; C283-S294 VanDerWaalsContact SG-N 3.42Å; C283-S294 PolarHBondContact SG-OG 2.92Å; C283-L297 HydrophobicContact CB-CD1 3.78Å |
| 284 | Q | 94.9 | Very high | 92.7 | Very high | 49 Ų | 49 | 52 Ų | 52 | 23% | 0.229 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -65.5 | -42 | 176.9 | -72.6 | 177.9 | -38.3 | 0 | 0 | 112.2 | L280 L281 I282 G288 E289 | L280-Q284 HydrophobicContact CD1-CG 3.93Å; L280-Q284 HydrophobicContact CG-CG 4.35Å; L280-Q284 WeakPolarHBondContact O-CB 3.42Å; L280-Q284 WeakPolarHBondContact O-CG 3.3Å; L280-Q284 PolarHBondContact O-N 3.18Å; L281-Q284 PolarHBondContact O-N 3.44Å; I282-Q284 PolarHBondContact O-N 3.46Å; Q284-G288 WeakPolarHBondContact O-CA 3.46Å; Q284-G288 PolarHBondContact O-N 3.19Å; Q284-E289 HydrophobicContact CB-CG 4.5Å; Q284-E289 HydrophobicContact CG-CG 4.24Å |
| 285 | E | 96 | Very high | 92.2 | Very high | 106 Ų | 106 | 47.1 Ų | 47.1 | 50% | 0.495 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -67 | -42.5 | 178.8 | -74.3 | 178.9 | -173.9 | 0 | 0 | 112.5 | R249 L281 I282 | R249-E285 IonicContact CZ-OE2 3.51Å; R249-E285 VanDerWaalsContact CZ-OE2 3.25Å; R249-E285 IonicContact NH1-OE2 3.87Å; R249-E285 PolarHBondContact NH1-OE2 2.83Å; R249-E285 IonicContact NH2-OE2 2.73Å; R249-E285 PolarHBondContact NH2-OE2 3.41Å; L281-E285 HydrophobicContact CD1-CG 4.32Å; L281-E285 WeakPolarHBondContact CD1-OE1 3.43Å; L281-E285 WeakPolarHBondContact O-CB 3.49Å; L281-E285 WeakPolarHBondContact O-CG 3.39Å; L281-E285 PolarHBondContact O-N 3.09Å; I282-E285 PolarHBondContact O-N 2.87Å |
| 286 | E | 90.7 | Very high | 91.6 | Very high | 42 Ų | 42 | 48 Ų | 48 | 20% | 0.196 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -89.7 | -26.5 | -173.4 | -59.1 | -60.5 | 143.6 | 0 | 0 | 113.4 | M246 R249 L250 I282 | M246-E286 WeakPolarHBondContact CG-OE2 2.96Å; R249-E286 HydrophobicContact CB-CG 4.19Å; R249-E286 WeakPolarHBondContact CD-OE1 3.45Å; R249-E286 IonicContact CZ-OE1 3.66Å; R249-E286 VanDerWaalsContact CZ-OE1 3.29Å; R249-E286 IonicContact NE-OE1 3.06Å; R249-E286 PolarHBondContact NE-OE1 3.44Å; R249-E286 IonicContact NH1-OE1 3.62Å; R249-E286 PolarHBondContact NH1-OE1 3.4Å; L250-E286 HydrophobicContact CD2-CB 3.73Å; L250-E286 HydrophobicContact CD2-CG 4.31Å; L250-E286 HydrophobicContact CG-CB 4.27Å; I282-E286 HydrophobicContact CG2-CG 4.43Å; I282-E286 WeakPolarHBondContact O-CB 3.42Å; I282-E286 WeakPolarHBondContact O-CG 3.29Å; I282-E286 PolarHBondContact O-N 2.92Å |
| 287 | Q | 87.5 | Confident | 91.1 | Very high | 72 Ų | 72 | 47.6 Ų | 47.6 | 34% | 0.336 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -127.8 | -12.5 | -172.5 | -57.6 | 179.5 | -33.9 | 0 | 0 | 114.2 | L250 C283 H291 | L250-Q287 HydrophobicContact CD2-CG 3.81Å; C283-Q287 WeakPolarHBondContact O-CA 3.32Å; C283-Q287 WeakPolarHBondContact O-CB 3.27Å; C283-Q287 PolarHBondContact O-N 3.14Å; C283-Q287 PolarHBondContact SG-OE1 3.38Å; Q287-H291 HydrophobicContact CB-CB 3.85Å; Q287-H291 PolarHBondContact OE1-CE1 3.01Å; Q287-H291 PolarHBondContact OE1-ND1 3.44Å |
| 288 | G | 91.3 | Very high | 90.9 | Very high | 27 Ų | 27 | 41.1 Ų | 41.1 | 28% | 0.278 | 21% | 0.211 | S | C | . | . | trans | 92.9 | 164.5 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | C283 Q284 T290 H291 S294 | C283-G288 PolarHBondContact O-N 2.93Å; Q284-G288 WeakPolarHBondContact O-CA 3.46Å; Q284-G288 PolarHBondContact O-N 3.19Å; G288-T290 PolarHBondContact O-N 3.43Å; G288-H291 WeakPolarHBondContact O-CB 3.44Å; G288-H291 PolarHBondContact O-N 2.99Å; G288-S294 WeakPolarHBondContact O-CB 3.47Å; G288-S294 PolarHBondContact O-OG 2.65Å | ||
| 289 | E | 93 | Very high | 90.5 | Very high | 106 Ų | 106 | 36.9 Ų | 36.9 | 50% | 0.495 | 20% | 0.195 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -72.5 | -28.2 | -173.6 | -60.6 | -174.5 | 166.7 | 0 | 0 | 114.1 | Q284 H291 L295 L324 | Q284-E289 HydrophobicContact CB-CG 4.5Å; Q284-E289 HydrophobicContact CG-CG 4.24Å; E289-H291 VanDerWaalsContact C-N 3.33Å; E289-L295 WeakPolarHBondContact O-CD2 3.49Å; E289-L324 HydrophobicContact CB-CD1 4.39Å |
| 290 | T | 90.3 | Very high | 90.2 | Very high | 73 Ų | 73 | 37.6 Ų | 37.6 | 45% | 0.448 | 20% | 0.199 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -88.9 | -0.6 | 179.3 | 55.9 | 0 | 0 | 0 | 0 | 113.2 | G288 L324 | G288-T290 PolarHBondContact O-N 3.43Å; T290-L324 HydrophobicContact CG2-CD2 4.15Å |
| 291 | H | 84.6 | Confident | 90.2 | Very high | 44 Ų | 44 | 37.7 Ų | 37.7 | 20% | 0.204 | 20% | 0.2 | C | C | . | . | S | Bend | trans | -62.6 | 136.5 | 176.4 | -172.9 | -96.7 | 0 | 0 | 0 | 110.3 | Q287 G288 E289 Q293 S294 L295 | Q287-H291 HydrophobicContact CB-CB 3.85Å; Q287-H291 PolarHBondContact OE1-CE1 3.01Å; Q287-H291 PolarHBondContact OE1-ND1 3.44Å; G288-H291 WeakPolarHBondContact O-CB 3.44Å; G288-H291 PolarHBondContact O-N 2.99Å; E289-H291 VanDerWaalsContact C-N 3.33Å; H291-Q293 WeakPolarHBondContact ND1-CB 3.4Å; H291-Q293 PolarHBondContact ND1-N 3.24Å; H291-Q293 PolarHBondContact O-N 2.96Å; H291-Q293 VanDerWaalsContact O-N 3.12Å; H291-S294 WeakPolarHBondContact O-CA 3.33Å; H291-S294 WeakPolarHBondContact O-CB 3.23Å; H291-S294 PolarHBondContact O-N 3.34Å; H291-L295 PolarHBondContact O-N 3.5Å; H291-L295 VanDerWaalsContact O-N 3.16Å |
| 292 | P | 83.8 | Confident | 90 | Very high | 51 Ų | 51 | 33.4 Ų | 33.4 | 33% | 0.331 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -43.6 | -47.9 | 178.3 | -36.4 | 39.5 | 0 | 0 | 0 | 114.4 | S294 L295 V296 H330 | P292-S294 PolarHBondContact O-N 3.41Å; P292-L295 PolarHBondContact O-N 3.32Å; P292-V296 WeakPolarHBondContact O-CG2 3.25Å; P292-V296 PolarHBondContact O-N 3.48Å; P292-H330 WeakPolarHBondContact CA-NE2 3.47Å; P292-H330 WeakPolarHBondContact CB-NE2 3.44Å |
| 293 | Q | 82.1 | Confident | 89.8 | Confident | 37 Ų | 37 | 33.5 Ų | 33.5 | 17% | 0.173 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -66.5 | -34.6 | -179.3 | -172.6 | 66.3 | 27.9 | 0 | 0 | 112.6 | D257 H291 L295 V296 L297 | D257-Q293 PolarHBondContact OD2-NE2 2.76Å; H291-Q293 WeakPolarHBondContact ND1-CB 3.4Å; H291-Q293 PolarHBondContact ND1-N 3.24Å; H291-Q293 PolarHBondContact O-N 2.96Å; H291-Q293 VanDerWaalsContact O-N 3.12Å; Q293-L295 VanDerWaalsContact C-N 3.34Å; Q293-V296 PolarHBondContact O-N 2.96Å; Q293-L297 HydrophobicContact CG-CD1 3.96Å; Q293-L297 HydrophobicContact CG-CG 4.39Å; Q293-L297 WeakPolarHBondContact O-CB 3.49Å; Q293-L297 WeakPolarHBondContact O-CD1 3.46Å; Q293-L297 VanDerWaalsContact O-CG 3.22Å; Q293-L297 WeakPolarHBondContact O-CG 3.47Å; Q293-L297 PolarHBondContact O-N 2.96Å |
| 294 | S | 88.1 | Confident | 89.9 | Confident | 2 Ų | 2 | 33.4 Ų | 33.4 | 1% | 0.014 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -63.9 | -41.8 | 175.2 | -60.9 | 0 | 0 | 0 | 0 | 110.8 | L280 C283 G288 H291 P292 L297 L298 | L280-S294 VanDerWaalsContact CD1-O 3.26Å; L280-S294 WeakPolarHBondContact CD1-O 3.49Å; C283-S294 PolarHBondContact SG-N 2.96Å; C283-S294 VanDerWaalsContact SG-N 3.42Å; C283-S294 PolarHBondContact SG-OG 2.92Å; G288-S294 WeakPolarHBondContact O-CB 3.47Å; G288-S294 PolarHBondContact O-OG 2.65Å; H291-S294 WeakPolarHBondContact O-CA 3.33Å; H291-S294 WeakPolarHBondContact O-CB 3.23Å; H291-S294 PolarHBondContact O-N 3.34Å; P292-S294 PolarHBondContact O-N 3.41Å; S294-L297 PolarHBondContact O-N 3.43Å; S294-L298 VanDerWaalsContact O-CB 3.28Å; S294-L298 WeakPolarHBondContact O-CB 3.34Å; S294-L298 PolarHBondContact O-N 3.2Å |
| 295 | L | 87.6 | Confident | 90 | Very high | 1 Ų | 1 | 31.6 Ų | 31.6 | 1% | 0.005 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -67.5 | -40.7 | 178.6 | -57.5 | 178.7 | 0 | 0 | 0 | 112.1 | E289 H291 P292 Q293 L298 S299 L324 L336 | E289-L295 WeakPolarHBondContact O-CD2 3.49Å; H291-L295 PolarHBondContact O-N 3.5Å; H291-L295 VanDerWaalsContact O-N 3.16Å; P292-L295 PolarHBondContact O-N 3.32Å; Q293-L295 VanDerWaalsContact C-N 3.34Å; L295-L298 PolarHBondContact O-N 2.91Å; L295-S299 PolarHBondContact O-N 3.36Å; L295-L324 HydrophobicContact CD2-CB 3.52Å; L295-L324 HydrophobicContact CD2-CD1 3.98Å; L295-L324 HydrophobicContact CD2-CG 4.42Å; L295-L336 HydrophobicContact CB-CD1 4.41Å |
| 296 | V | 84.7 | Confident | 89.8 | Confident | 33 Ų | 33 | 27 Ų | 27 | 20% | 0.2 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -62.6 | -50.6 | 174.6 | 171.5 | 0 | 0 | 0 | 0 | 110.5 | P292 Q293 L298 S299 D300 | P292-V296 WeakPolarHBondContact O-CG2 3.25Å; P292-V296 PolarHBondContact O-N 3.48Å; Q293-V296 PolarHBondContact O-N 2.96Å; V296-L298 VanDerWaalsContact C-N 3.28Å; V296-L298 PolarHBondContact O-N 2.74Å; V296-S299 WeakPolarHBondContact O-CB 3.23Å; V296-S299 PolarHBondContact O-N 2.96Å; V296-S299 VanDerWaalsContact O-N 3.08Å; V296-D300 PolarHBondContact O-N 3.44Å |
| 297 | L | 87.1 | Confident | 89.8 | Confident | 2 Ų | 2 | 27.4 Ų | 27.4 | 1% | 0.01 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -60.9 | -36.9 | 179.4 | -72.5 | 167.9 | 0 | 0 | 0 | 112.5 | D257 Y276 A279 L280 C283 Q293 S294 D300 L301 | D257-L297 HydrophobicContact CB-CD2 3.95Å; Y276-L297 HydrophobicContact CD1-CD2 3.84Å; Y276-L297 HydrophobicContact CE1-CD2 4.26Å; A279-L297 HydrophobicContact CB-CD1 4.1Å; A279-L297 HydrophobicContact CB-CD2 3.88Å; L280-L297 HydrophobicContact CB-CB 4.09Å; L280-L297 HydrophobicContact CD1-CB 3.96Å; C283-L297 HydrophobicContact CB-CD1 3.78Å; Q293-L297 HydrophobicContact CG-CD1 3.96Å; Q293-L297 HydrophobicContact CG-CG 4.39Å; Q293-L297 WeakPolarHBondContact O-CB 3.49Å; Q293-L297 WeakPolarHBondContact O-CD1 3.46Å; Q293-L297 VanDerWaalsContact O-CG 3.22Å; Q293-L297 WeakPolarHBondContact O-CG 3.47Å; Q293-L297 PolarHBondContact O-N 2.96Å; S294-L297 PolarHBondContact O-N 3.43Å; L297-D300 PolarHBondContact O-N 2.87Å; L297-L301 WeakPolarHBondContact O-CB 3.49Å; L297-L301 PolarHBondContact O-N 3.36Å |
| 298 | L | 93.6 | Very high | 90.1 | Very high | 4 Ų | 4 | 26.6 Ų | 26.6 | 2% | 0.021 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -64.8 | -41.4 | 175.2 | -174.2 | 63.3 | 0 | 0 | 0 | 111.6 | L280 S294 L295 V296 A302 L317 Q320 A321 | L280-L298 HydrophobicContact CD1-CB 4.2Å; L280-L298 HydrophobicContact CD2-CB 4.37Å; L280-L298 HydrophobicContact CD2-CD1 3.81Å; S294-L298 VanDerWaalsContact O-CB 3.28Å; S294-L298 WeakPolarHBondContact O-CB 3.34Å; S294-L298 PolarHBondContact O-N 3.2Å; L295-L298 PolarHBondContact O-N 2.91Å; V296-L298 VanDerWaalsContact C-N 3.28Å; V296-L298 PolarHBondContact O-N 2.74Å; L298-A302 PolarHBondContact O-N 3.4Å; L298-A302 VanDerWaalsContact O-N 3.1Å; L298-L317 HydrophobicContact CD1-CB 3.91Å; L298-L317 HydrophobicContact CD1-CD2 3.76Å; L298-L317 HydrophobicContact CD1-CG 4.33Å; L298-L317 WeakPolarHBondContact CD2-O 3.5Å; L298-L317 HydrophobicContact CG-CB 4.4Å; L298-L317 WeakPolarHBondContact CG-O 3.4Å; L298-Q320 HydrophobicContact CD2-CB 4.05Å; L298-Q320 HydrophobicContact CD2-CG 3.92Å; L298-A321 HydrophobicContact CB-CB 4.26Å; L298-A321 HydrophobicContact CD2-CB 3.76Å; L298-A321 HydrophobicContact CG-CB 4.05Å |
| 299 | S | 89.1 | Confident | 90.2 | Very high | 1 Ų | 1 | 27.5 Ų | 27.5 | 1% | 0.007 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -70.2 | -39.2 | 175.7 | -167 | 0 | 0 | 0 | 0 | 113.1 | L295 V296 A302 T303 L336 N339 | L295-S299 PolarHBondContact O-N 3.36Å; V296-S299 WeakPolarHBondContact O-CB 3.23Å; V296-S299 PolarHBondContact O-N 2.96Å; V296-S299 VanDerWaalsContact O-N 3.08Å; S299-A302 WeakPolarHBondContact O-CB 3.49Å; S299-A302 PolarHBondContact O-N 3.14Å; S299-T303 PolarHBondContact O-N 2.72Å; S299-T303 PolarHBondContact O-OG1 2.97Å; S299-L336 VanDerWaalsContact CB-CD2 3.43Å; S299-N339 PolarHBondContact OG-ND2 2.9Å |
| 300 | D | 88.5 | Confident | 90.4 | Very high | 16 Ų | 16 | 27.1 Ų | 27.1 | 9% | 0.086 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -66.5 | -43.4 | 177.6 | -73.3 | -10.5 | 0 | 0 | 0 | 110.4 | R261 Y276 V296 L297 A302 T303 I304 | R261-D300 IonicContact CZ-OD2 2.77Å; R261-D300 IonicContact NH2-OD2 3.87Å; R261-D300 PolarHBondContact NH2-OD2 3.36Å; Y276-D300 HydrophobicContact CD1-CB 4.07Å; Y276-D300 HydrophobicContact CE1-CB 3.66Å; Y276-D300 HydrophobicContact CE2-CB 4.27Å; V296-D300 PolarHBondContact O-N 3.44Å; L297-D300 PolarHBondContact O-N 2.87Å; D300-A302 VanDerWaalsContact C-N 3.35Å; D300-A302 PolarHBondContact O-N 2.87Å; D300-T303 PolarHBondContact O-N 3.44Å; D300-T303 VanDerWaalsContact O-N 3.14Å; D300-I304 WeakPolarHBondContact O-CG1 3.46Å; D300-I304 PolarHBondContact O-N 2.98Å |
| 301 | L | 96.7 | Very high | 90.5 | Very high | 16 Ų | 16 | 25.8 Ų | 25.8 | 8% | 0.084 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -58.7 | -45.9 | 172.9 | 178.8 | 58.2 | 0 | 0 | 0 | 111.6 | A273 K277 L280 L297 T303 I304 L305 L317 | A273-L301 HydrophobicContact CB-CD1 4.14Å; A273-L301 WeakPolarHBondContact O-CD1 3.32Å; K277-L301 HydrophobicContact CB-CD2 4.35Å; L280-L301 HydrophobicContact CD2-CD2 4.36Å; L297-L301 WeakPolarHBondContact O-CB 3.49Å; L297-L301 PolarHBondContact O-N 3.36Å; L301-T303 VanDerWaalsContact C-N 3.26Å; L301-T303 PolarHBondContact O-N 3.08Å; L301-I304 PolarHBondContact O-N 3.15Å; L301-L305 HydrophobicContact CD1-CD1 4.49Å; L301-L305 HydrophobicContact CD1-CG 4.38Å; L301-L305 HydrophobicContact CG-CD1 4.32Å; L301-L305 WeakPolarHBondContact O-CG 3.21Å; L301-L305 PolarHBondContact O-N 3.2Å; L301-L317 HydrophobicContact CD2-CD1 3.93Å; L301-L317 HydrophobicContact CG-CD1 3.91Å |
| 302 | A | 95.1 | Very high | 90.9 | Very high | 0 Ų | 0 | 29.6 Ų | 29.6 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -57.8 | -42.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | L298 S299 D300 I304 L305 D306 A314 L317 V318 | L298-A302 PolarHBondContact O-N 3.4Å; L298-A302 VanDerWaalsContact O-N 3.1Å; S299-A302 WeakPolarHBondContact O-CB 3.49Å; S299-A302 PolarHBondContact O-N 3.14Å; D300-A302 VanDerWaalsContact C-N 3.35Å; D300-A302 PolarHBondContact O-N 2.87Å; A302-I304 PolarHBondContact O-N 2.74Å; A302-L305 PolarHBondContact O-N 2.94Å; A302-D306 WeakPolarHBondContact O-CB 3.37Å; A302-D306 PolarHBondContact O-N 3.19Å; A302-A314 HydrophobicContact CB-CB 4.37Å; A302-A314 WeakPolarHBondContact CB-O 3.43Å; A302-A314 WeakPolarHBondContact O-CB 3.26Å; A302-L317 HydrophobicContact CB-CB 3.93Å; A302-V318 HydrophobicContact CB-CB 3.8Å |
| 303 | T | 90.2 | Very high | 91.5 | Very high | 16 Ų | 16 | 31.6 Ų | 31.6 | 10% | 0.098 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -66 | -39.7 | 179.3 | -53.3 | 0 | 0 | 0 | 0 | 112.1 | L10 S299 D300 L301 D306 L307 | L10-T303 HydrophobicContact CD1-CG2 4.15Å; L10-T303 HydrophobicContact CD2-CG2 3.47Å; L10-T303 VanDerWaalsContact CD2-CG2 3.47Å; L10-T303 HydrophobicContact CG-CG2 4.34Å; S299-T303 PolarHBondContact O-N 2.72Å; S299-T303 PolarHBondContact O-OG1 2.97Å; D300-T303 PolarHBondContact O-N 3.44Å; D300-T303 VanDerWaalsContact O-N 3.14Å; L301-T303 VanDerWaalsContact C-N 3.26Å; L301-T303 PolarHBondContact O-N 3.08Å; T303-D306 WeakPolarHBondContact O-CB 3.41Å; T303-D306 PolarHBondContact O-N 3.28Å; T303-L307 VanDerWaalsContact O-CG 3.32Å; T303-L307 WeakPolarHBondContact O-CG 3.46Å; T303-L307 PolarHBondContact O-N 2.98Å |
| 304 | I | 94.1 | Very high | 92.2 | Very high | 4 Ų | 4 | 29.8 Ų | 29.8 | 2% | 0.021 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -64.3 | -42 | 174.3 | -63.8 | -50 | 0 | 0 | 0 | 111.8 | A264 L269 A272 A273 Y276 D300 L301 A302 D306 L307 Q308 | A264-I304 HydrophobicContact CB-CD1 3.57Å; L269-I304 HydrophobicContact CB-CG2 4.2Å; L269-I304 HydrophobicContact CD2-CD1 4.33Å; L269-I304 VanDerWaalsContact O-CG2 3.29Å; L269-I304 WeakPolarHBondContact O-CG2 3.5Å; A272-I304 HydrophobicContact CB-CD1 4.45Å; A272-I304 HydrophobicContact CB-CG1 4.35Å; A272-I304 HydrophobicContact CB-CG2 4.26Å; A273-I304 HydrophobicContact CB-CG2 3.83Å; Y276-I304 HydrophobicContact CD2-CG1 3.6Å; Y276-I304 HydrophobicContact CE2-CD1 4.05Å; Y276-I304 HydrophobicContact CE2-CG1 3.44Å; Y276-I304 VanDerWaalsContact CE2-CG1 3.44Å; D300-I304 WeakPolarHBondContact O-CG1 3.46Å; D300-I304 PolarHBondContact O-N 2.98Å; L301-I304 PolarHBondContact O-N 3.15Å; A302-I304 PolarHBondContact O-N 2.74Å; I304-D306 VanDerWaalsContact C-N 3.31Å; I304-D306 PolarHBondContact O-N 3.44Å; I304-L307 HydrophobicContact CD1-CD1 4.21Å; I304-L307 PolarHBondContact O-N 2.9Å; I304-Q308 WeakPolarHBondContact O-CG 3.42Å; I304-Q308 PolarHBondContact O-N 3.45Å; I304-Q308 VanDerWaalsContact O-N 3.08Å |
| 305 | L | 96.1 | Very high | 92.5 | Very high | 11 Ų | 11 | 31.5 Ų | 31.5 | 6% | 0.058 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -62.8 | -40.8 | 176.3 | -68.1 | 173.7 | 0 | 0 | 0 | 111.6 | L301 A302 Q308 G309 R310 E313 A314 L317 | L301-L305 HydrophobicContact CD1-CD1 4.49Å; L301-L305 HydrophobicContact CD1-CG 4.38Å; L301-L305 HydrophobicContact CG-CD1 4.32Å; L301-L305 WeakPolarHBondContact O-CG 3.21Å; L301-L305 PolarHBondContact O-N 3.2Å; A302-L305 PolarHBondContact O-N 2.94Å; L305-Q308 WeakPolarHBondContact O-CA 3.47Å; L305-Q308 WeakPolarHBondContact O-CB 3.24Å; L305-Q308 PolarHBondContact O-N 3.4Å; L305-Q308 VanDerWaalsContact O-N 3.09Å; L305-G309 PolarHBondContact O-N 3.41Å; L305-R310 HydrophobicContact CB-CB 4.38Å; L305-R310 VanDerWaalsContact CD2-CZ 3.45Å; L305-R310 WeakPolarHBondContact O-CA 3.36Å; L305-R310 WeakPolarHBondContact O-CB 3.48Å; L305-R310 PolarHBondContact O-N 2.96Å; L305-E313 HydrophobicContact CD1-CB 4.21Å; L305-A314 HydrophobicContact CB-CB 4.03Å; L305-L317 HydrophobicContact CD1-CD1 3.5Å |
| 306 | D | 92.7 | Very high | 92.9 | Very high | 10 Ų | 10 | 35 Ų | 35 | 5% | 0.053 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -62 | -42.8 | 175.7 | -178.4 | 63 | 0 | 0 | 0 | 112.1 | A302 T303 I304 Q308 G309 H311 A314 V343 H346 | A302-D306 WeakPolarHBondContact O-CB 3.37Å; A302-D306 PolarHBondContact O-N 3.19Å; T303-D306 WeakPolarHBondContact O-CB 3.41Å; T303-D306 PolarHBondContact O-N 3.28Å; I304-D306 VanDerWaalsContact C-N 3.31Å; I304-D306 PolarHBondContact O-N 3.44Å; D306-Q308 PolarHBondContact O-N 3.48Å; D306-G309 WeakPolarHBondContact O-CA 3.42Å; D306-G309 PolarHBondContact O-N 3.49Å; D306-H311 PolarHBondContact O-CE1 3.23Å; D306-H311 IonicContact OD1-CE1 3.85Å; D306-H311 PolarHBondContact OD1-CE1 3.03Å; D306-H311 IonicContact OD1-CG 2.64Å; D306-H311 IonicContact OD1-ND1 3.46Å; D306-H311 PolarHBondContact OD1-ND1 3.36Å; D306-A314 HydrophobicContact CB-CB 3.9Å; D306-V343 HydrophobicContact CB-CG2 4.05Å; D306-H346 WeakPolarHBondContact OD1-CB 3.35Å; D306-H346 IonicContact OD1-CG 3.78Å; D306-H346 IonicContact OD1-ND1 2.66Å; D306-H346 PolarHBondContact OD1-ND1 2.88Å; D306-H346 IonicContact OD2-CE1 3.02Å; D306-H346 PolarHBondContact OD2-CE1 2.97Å; D306-H346 IonicContact OD2-CG 3.39Å; D306-H346 IonicContact OD2-ND1 3.4Å; D306-H346 PolarHBondContact OD2-ND1 3.4Å |
| 307 | L | 90.6 | Very high | 93.5 | Very high | 50 Ų | 50 | 35.3 Ų | 35.3 | 26% | 0.262 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -64.1 | -24.5 | 172.8 | -69.6 | 173.4 | 0 | 0 | 0 | 113.4 | L10 L269 T303 I304 G309 | L10-L307 HydrophobicContact CD1-CD1 3.96Å; L10-L307 HydrophobicContact CD1-CD2 4.23Å; L10-L307 HydrophobicContact CD1-CG 4.49Å; L269-L307 HydrophobicContact CD1-CB 3.76Å; L269-L307 HydrophobicContact CD2-CB 4.4Å; L269-L307 HydrophobicContact CD2-CD1 4.23Å; T303-L307 VanDerWaalsContact O-CG 3.32Å; T303-L307 WeakPolarHBondContact O-CG 3.46Å; T303-L307 PolarHBondContact O-N 2.98Å; I304-L307 HydrophobicContact CD1-CD1 4.21Å; I304-L307 PolarHBondContact O-N 2.9Å; L307-G309 PolarHBondContact O-N 2.94Å |
| 308 | Q | 93.6 | Very high | 93.8 | Very high | 54 Ų | 54 | 35.2 Ų | 35.2 | 25% | 0.252 | 19% | 0.189 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -79.2 | -1.8 | 171.2 | -67.7 | -179.2 | -37 | 0 | 0 | 113.2 | L269 S270 I304 L305 D306 R310 | L269-Q308 HydrophobicContact CB-CG 3.75Å; L269-Q308 HydrophobicContact CD1-CG 4.04Å; S270-Q308 VanDerWaalsContact CA-NE2 3.28Å; S270-Q308 PolarHBondContact OG-NE2 2.75Å; I304-Q308 WeakPolarHBondContact O-CG 3.42Å; I304-Q308 PolarHBondContact O-N 3.45Å; I304-Q308 VanDerWaalsContact O-N 3.08Å; L305-Q308 WeakPolarHBondContact O-CA 3.47Å; L305-Q308 WeakPolarHBondContact O-CB 3.24Å; L305-Q308 PolarHBondContact O-N 3.4Å; L305-Q308 VanDerWaalsContact O-N 3.09Å; D306-Q308 PolarHBondContact O-N 3.48Å; Q308-R310 VanDerWaalsContact C-N 3.3Å; Q308-R310 HydrophobicContact CB-CG 4.17Å; Q308-R310 VanDerWaalsContact OE1-NH1 3.07Å |
| 309 | G | 93.6 | Very high | 93.9 | Very high | 46 Ų | 46 | 39.8 Ų | 39.8 | 47% | 0.474 | 21% | 0.209 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 79.3 | 9.3 | -173.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | L305 D306 L307 H311 | L305-G309 PolarHBondContact O-N 3.41Å; D306-G309 WeakPolarHBondContact O-CA 3.42Å; D306-G309 PolarHBondContact O-N 3.49Å; L307-G309 PolarHBondContact O-N 2.94Å; G309-H311 VanDerWaalsContact C-N 3.27Å; G309-H311 PolarHBondContact O-N 2.99Å |
| 310 | R | 96.4 | Very high | 94.2 | Very high | 98 Ų | 98 | 43.1 Ų | 43.1 | 37% | 0.37 | 22% | 0.224 | S | C | . | . | trans | -92.3 | 55.7 | -177.9 | -61 | 165.1 | 66.4 | -168.3 | 2.2 | 110.5 | L305 Q308 D312 E313 A314 | L305-R310 HydrophobicContact CB-CB 4.38Å; L305-R310 VanDerWaalsContact CD2-CZ 3.45Å; L305-R310 WeakPolarHBondContact O-CA 3.36Å; L305-R310 WeakPolarHBondContact O-CB 3.48Å; L305-R310 PolarHBondContact O-N 2.96Å; Q308-R310 VanDerWaalsContact C-N 3.3Å; Q308-R310 HydrophobicContact CB-CG 4.17Å; Q308-R310 VanDerWaalsContact OE1-NH1 3.07Å; R310-D312 VanDerWaalsContact C-N 3.3Å; R310-D312 PolarHBondContact O-N 3.45Å; R310-E313 HydrophobicContact CB-CB 4.36Å; R310-E313 IonicContact CZ-OE1 3.29Å; R310-E313 VanDerWaalsContact CZ-OE1 3.22Å; R310-E313 IonicContact CZ-OE2 2.96Å; R310-E313 IonicContact NE-OE1 3.41Å; R310-E313 PolarHBondContact NE-OE1 3.26Å; R310-E313 IonicContact NE-OE2 2.82Å; R310-E313 IonicContact NH2-OE1 2.74Å; R310-E313 PolarHBondContact NH2-OE1 3.25Å; R310-E313 IonicContact NH2-OE2 3.31Å; R310-E313 PolarHBondContact NH2-OE2 2.99Å; R310-E313 PolarHBondContact O-N 3.13Å; R310-E313 VanDerWaalsContact O-N 3.1Å; R310-A314 PolarHBondContact O-N 3.39Å | ||
| 311 | H | 93.3 | Very high | 94.3 | Very high | 46 Ų | 46 | 42.3 Ų | 42.3 | 21% | 0.213 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -59.1 | -38.6 | -172.9 | -50.5 | -52.3 | 0 | 0 | 0 | 113.1 | D306 G309 E313 A314 L315 N347 | D306-H311 PolarHBondContact O-CE1 3.23Å; D306-H311 IonicContact OD1-CE1 3.85Å; D306-H311 PolarHBondContact OD1-CE1 3.03Å; D306-H311 IonicContact OD1-CG 2.64Å; D306-H311 IonicContact OD1-ND1 3.46Å; D306-H311 PolarHBondContact OD1-ND1 3.36Å; G309-H311 VanDerWaalsContact C-N 3.27Å; G309-H311 PolarHBondContact O-N 2.99Å; H311-E313 VanDerWaalsContact C-N 3.25Å; H311-E313 PolarHBondContact O-N 3.27Å; H311-A314 PolarHBondContact O-N 2.81Å; H311-L315 WeakPolarHBondContact O-CB 3.38Å; H311-L315 PolarHBondContact O-N 3.1Å; H311-N347 HydrophobicContact CB-CB 4.14Å |
| 312 | D | 92.2 | Very high | 94.2 | Very high | 123 Ų | 123 | 41.7 Ų | 41.7 | 66% | 0.658 | 22% | 0.217 | S | C | * | . | H | α-helix | trans | -67.4 | -25.6 | 179.6 | -65.4 | -33.4 | 0 | 0 | 0 | 113 | R310 P316 N347 | R310-D312 VanDerWaalsContact C-N 3.3Å; R310-D312 PolarHBondContact O-N 3.45Å; D312-P316 WeakPolarHBondContact O-CD 3.45Å; D312-N347 PolarHBondContact OD1-ND2 3.01Å |
| 313 | E | 95.8 | Very high | 94.1 | Very high | 93 Ų | 93 | 46.1 Ų | 46.1 | 44% | 0.435 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -87.2 | -30.8 | 174.1 | -63.3 | -175.2 | -105.6 | 0 | 0 | 112 | L305 R310 H311 P316 | L305-E313 HydrophobicContact CD1-CB 4.21Å; R310-E313 HydrophobicContact CB-CB 4.36Å; R310-E313 IonicContact CZ-OE1 3.29Å; R310-E313 VanDerWaalsContact CZ-OE1 3.22Å; R310-E313 IonicContact CZ-OE2 2.96Å; R310-E313 IonicContact NE-OE1 3.41Å; R310-E313 PolarHBondContact NE-OE1 3.26Å; R310-E313 IonicContact NE-OE2 2.82Å; R310-E313 IonicContact NH2-OE1 2.74Å; R310-E313 PolarHBondContact NH2-OE1 3.25Å; R310-E313 IonicContact NH2-OE2 3.31Å; R310-E313 PolarHBondContact NH2-OE2 2.99Å; R310-E313 PolarHBondContact O-N 3.13Å; R310-E313 VanDerWaalsContact O-N 3.1Å; H311-E313 VanDerWaalsContact C-N 3.25Å; H311-E313 PolarHBondContact O-N 3.27Å; E313-P316 WeakPolarHBondContact O-CD 3.2Å; E313-P316 WeakPolarHBondContact O-CG 3.2Å |
| 314 | A | 96.4 | Very high | 94.2 | Very high | 0 Ų | 0 | 46.5 Ų | 46.5 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -69.7 | -43.4 | 177 | 0 | 0 | 0 | 0 | 0 | 112.8 | A302 L305 D306 R310 H311 L317 V318 V343 | A302-A314 HydrophobicContact CB-CB 4.37Å; A302-A314 WeakPolarHBondContact CB-O 3.43Å; A302-A314 WeakPolarHBondContact O-CB 3.26Å; L305-A314 HydrophobicContact CB-CB 4.03Å; D306-A314 HydrophobicContact CB-CB 3.9Å; R310-A314 PolarHBondContact O-N 3.39Å; H311-A314 PolarHBondContact O-N 2.81Å; A314-L317 PolarHBondContact O-N 3.04Å; A314-V318 PolarHBondContact O-N 2.94Å; A314-V318 VanDerWaalsContact O-N 3.1Å; A314-V343 HydrophobicContact CB-CG1 3.87Å; A314-V343 HydrophobicContact CB-CG2 4.31Å |
| 315 | L | 95.3 | Very high | 93.9 | Very high | 38 Ų | 38 | 46.3 Ų | 46.3 | 20% | 0.199 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -56.9 | -47.7 | -174.1 | -173.3 | 60.2 | 0 | 0 | 0 | 114.6 | H311 L317 V318 K319 M340 V343 L344 | H311-L315 WeakPolarHBondContact O-CB 3.38Å; H311-L315 PolarHBondContact O-N 3.1Å; L315-L317 VanDerWaalsContact C-N 3.31Å; L315-L317 PolarHBondContact O-N 3.27Å; L315-V318 HydrophobicContact CD1-CG1 4.47Å; L315-V318 WeakPolarHBondContact O-CG1 3.44Å; L315-K319 WeakPolarHBondContact O-CB 3.42Å; L315-K319 PolarHBondContact O-N 3.44Å; L315-M340 HydrophobicContact CD1-CE 4.37Å; L315-V343 HydrophobicContact CB-CG1 4.11Å; L315-V343 HydrophobicContact CD1-CG1 4.28Å; L315-L344 HydrophobicContact CD1-CD2 3.64Å; L315-L344 HydrophobicContact CD1-CG 4.07Å; L315-L344 HydrophobicContact CD2-CD2 4.12Å |
| 316 | P | 96.8 | Very high | 93.6 | Very high | 74 Ų | 74 | 51.2 Ų | 51.2 | 48% | 0.481 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -63.3 | -36.5 | 178.3 | 23.6 | -33.9 | 0 | 0 | 0 | 112.6 | D312 E313 K319 Q320 | D312-P316 WeakPolarHBondContact O-CD 3.45Å; E313-P316 WeakPolarHBondContact O-CD 3.2Å; E313-P316 WeakPolarHBondContact O-CG 3.2Å; P316-K319 PolarHBondContact O-N 3.5Å; P316-Q320 WeakPolarHBondContact O-CB 3.43Å; P316-Q320 PolarHBondContact O-N 3.31Å |
| 317 | L | 96.6 | Very high | 93.3 | Very high | 39 Ų | 39 | 58.2 Ų | 58.2 | 20% | 0.204 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -66.5 | -50.6 | 179.9 | -62.4 | -179.9 | 0 | 0 | 0 | 111.6 | L298 L301 A302 L305 A314 L315 K319 Q320 A321 | L298-L317 HydrophobicContact CD1-CB 3.91Å; L298-L317 HydrophobicContact CD1-CD2 3.76Å; L298-L317 HydrophobicContact CD1-CG 4.33Å; L298-L317 WeakPolarHBondContact CD2-O 3.5Å; L298-L317 HydrophobicContact CG-CB 4.4Å; L298-L317 WeakPolarHBondContact CG-O 3.4Å; L301-L317 HydrophobicContact CD2-CD1 3.93Å; L301-L317 HydrophobicContact CG-CD1 3.91Å; A302-L317 HydrophobicContact CB-CB 3.93Å; L305-L317 HydrophobicContact CD1-CD1 3.5Å; A314-L317 PolarHBondContact O-N 3.04Å; L315-L317 VanDerWaalsContact C-N 3.31Å; L315-L317 PolarHBondContact O-N 3.27Å; L317-K319 VanDerWaalsContact C-N 3.28Å; L317-K319 PolarHBondContact O-N 2.73Å; L317-Q320 PolarHBondContact O-N 2.99Å; L317-A321 PolarHBondContact O-N 2.89Å |
| 318 | V | 92.9 | Very high | 93 | Very high | 0 Ų | 0 | 58.5 Ų | 58.5 | 0% | 0 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -67.9 | -31.6 | 180 | 72.1 | 0 | 0 | 0 | 0 | 111.7 | A302 A314 L315 A321 V322 N339 M340 V343 | A302-V318 HydrophobicContact CB-CB 3.8Å; A314-V318 PolarHBondContact O-N 2.94Å; A314-V318 VanDerWaalsContact O-N 3.1Å; L315-V318 HydrophobicContact CD1-CG1 4.47Å; L315-V318 WeakPolarHBondContact O-CG1 3.44Å; V318-A321 PolarHBondContact O-N 2.96Å; V318-V322 WeakPolarHBondContact O-CG2 3.29Å; V318-V322 PolarHBondContact O-N 3.47Å; V318-N339 HydrophobicContact CG2-CB 4.16Å; V318-M340 HydrophobicContact CG1-CB 3.97Å; V318-M340 HydrophobicContact CG1-CG 3.93Å; V318-M340 HydrophobicContact CG2-CB 3.86Å; V318-V343 HydrophobicContact CG1-CB 4.46Å; V318-V343 HydrophobicContact CG1-CG2 4.27Å |
| 319 | K | 95.4 | Very high | 92.4 | Very high | 100 Ų | 100 | 58.9 Ų | 58.9 | 44% | 0.435 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -63.7 | -46.4 | 172.7 | -177.5 | 177.5 | 172.9 | -177.7 | 0 | 111.6 | L315 P316 L317 A321 V322 E323 M340 | L315-K319 WeakPolarHBondContact O-CB 3.42Å; L315-K319 PolarHBondContact O-N 3.44Å; P316-K319 PolarHBondContact O-N 3.5Å; L317-K319 VanDerWaalsContact C-N 3.28Å; L317-K319 PolarHBondContact O-N 2.73Å; K319-A321 VanDerWaalsContact C-N 3.31Å; K319-A321 PolarHBondContact O-N 3.42Å; K319-V322 PolarHBondContact O-N 2.95Å; K319-E323 WeakPolarHBondContact CE-OE1 3.42Å; K319-E323 IonicContact NZ-OE1 3.98Å; K319-E323 WeakPolarHBondContact O-CG 3.32Å; K319-E323 PolarHBondContact O-N 3.43Å; K319-M340 HydrophobicContact CB-CE 4.18Å; K319-M340 HydrophobicContact CG-CE 4.21Å |
| 320 | Q | 95.6 | Very high | 91.5 | Very high | 71 Ų | 71 | 57.8 Ų | 57.8 | 33% | 0.332 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -58.8 | -43 | 174.6 | 179.9 | -176.4 | 3.8 | 0 | 0 | 111.2 | L298 P316 L317 V322 E323 L324 | L298-Q320 HydrophobicContact CD2-CB 4.05Å; L298-Q320 HydrophobicContact CD2-CG 3.92Å; P316-Q320 WeakPolarHBondContact O-CB 3.43Å; P316-Q320 PolarHBondContact O-N 3.31Å; L317-Q320 PolarHBondContact O-N 2.99Å; Q320-V322 PolarHBondContact O-N 3.37Å; Q320-E323 PolarHBondContact O-N 2.69Å; Q320-L324 HydrophobicContact CG-CD1 3.91Å; Q320-L324 HydrophobicContact CG-CG 4.39Å; Q320-L324 WeakPolarHBondContact O-CB 3.37Å; Q320-L324 WeakPolarHBondContact O-CG 3.34Å; Q320-L324 PolarHBondContact O-N 2.99Å |
| 321 | A | 91.9 | Very high | 90.1 | Very high | 0 Ų | 0 | 58 Ų | 58 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -59 | -45 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L298 L317 V318 K319 S325 L336 | L298-A321 HydrophobicContact CB-CB 4.26Å; L298-A321 HydrophobicContact CD2-CB 3.76Å; L298-A321 HydrophobicContact CG-CB 4.05Å; L317-A321 PolarHBondContact O-N 2.89Å; V318-A321 PolarHBondContact O-N 2.96Å; K319-A321 VanDerWaalsContact C-N 3.31Å; K319-A321 PolarHBondContact O-N 3.42Å; A321-S325 VanDerWaalsContact O-CB 3.23Å; A321-S325 WeakPolarHBondContact O-CB 3.3Å; A321-S325 PolarHBondContact O-N 3.14Å; A321-S325 PolarHBondContact O-OG 3.13Å; A321-L336 HydrophobicContact CB-CD2 4.25Å |
| 322 | V | 93.1 | Very high | 89.2 | Confident | 3 Ų | 3 | 57.8 Ų | 57.8 | 2% | 0.018 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -64 | -44.7 | 177.9 | 169.8 | 0 | 0 | 0 | 0 | 111.6 | V318 K319 Q320 S325 R326 L336 L337 M340 | V318-V322 WeakPolarHBondContact O-CG2 3.29Å; V318-V322 PolarHBondContact O-N 3.47Å; K319-V322 PolarHBondContact O-N 2.95Å; Q320-V322 PolarHBondContact O-N 3.37Å; V322-S325 WeakPolarHBondContact CA-OG 3.16Å; V322-S325 PolarHBondContact O-N 3.13Å; V322-S325 PolarHBondContact O-OG 3.18Å; V322-R326 WeakPolarHBondContact O-CG 3.46Å; V322-R326 PolarHBondContact O-N 3.01Å; V322-R326 VanDerWaalsContact O-N 3.09Å; V322-L336 HydrophobicContact CG2-CB 3.82Å; V322-L337 HydrophobicContact CG1-CD2 3.75Å; V322-L337 HydrophobicContact CG1-CG 4.47Å; V322-L337 HydrophobicContact CG2-CD2 4.34Å; V322-M340 HydrophobicContact CB-SD 4.49Å; V322-M340 HydrophobicContact CG2-CB 4.32Å; V322-M340 HydrophobicContact CG2-SD 4.14Å |
| 323 | E | 93.9 | Very high | 88.9 | Confident | 92 Ų | 92 | 53.8 Ų | 53.8 | 43% | 0.43 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -61.8 | -51.4 | 179.5 | -73.3 | 172.2 | 176.1 | 0 | 0 | 111.4 | K319 Q320 S325 R326 E327 | K319-E323 WeakPolarHBondContact CE-OE1 3.42Å; K319-E323 IonicContact NZ-OE1 3.98Å; K319-E323 WeakPolarHBondContact O-CG 3.32Å; K319-E323 PolarHBondContact O-N 3.43Å; Q320-E323 PolarHBondContact O-N 2.69Å; E323-S325 VanDerWaalsContact C-N 3.3Å; E323-S325 PolarHBondContact O-N 3.45Å; E323-R326 WeakPolarHBondContact O-CB 3.34Å; E323-R326 PolarHBondContact O-N 3.1Å; E323-R326 VanDerWaalsContact O-N 3.17Å; E323-E327 PolarHBondContact O-N 2.64Å |
| 324 | L | 92 | Very high | 88.5 | Confident | 24 Ų | 24 | 49.5 Ų | 49.5 | 13% | 0.126 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -61.4 | -38.1 | 176.9 | -67.9 | 173.3 | 0 | 0 | 0 | 112.1 | E289 T290 L295 Q320 R326 E327 A328 | E289-L324 HydrophobicContact CB-CD1 4.39Å; T290-L324 HydrophobicContact CG2-CD2 4.15Å; L295-L324 HydrophobicContact CD2-CB 3.52Å; L295-L324 HydrophobicContact CD2-CD1 3.98Å; L295-L324 HydrophobicContact CD2-CG 4.42Å; Q320-L324 HydrophobicContact CG-CD1 3.91Å; Q320-L324 HydrophobicContact CG-CG 4.39Å; Q320-L324 WeakPolarHBondContact O-CB 3.37Å; Q320-L324 WeakPolarHBondContact O-CG 3.34Å; Q320-L324 PolarHBondContact O-N 2.99Å; L324-R326 VanDerWaalsContact C-N 3.31Å; L324-R326 PolarHBondContact O-N 3.44Å; L324-E327 PolarHBondContact O-N 2.99Å; L324-A328 WeakPolarHBondContact O-CB 3.36Å; L324-A328 PolarHBondContact O-N 2.96Å |
| 325 | S | 88.2 | Confident | 88 | Confident | 0 Ų | 0 | 51 Ų | 51 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -64.5 | -34.3 | 177.9 | 77.3 | 0 | 0 | 0 | 0 | 113.2 | A321 V322 E323 G329 H330 L336 | A321-S325 VanDerWaalsContact O-CB 3.23Å; A321-S325 WeakPolarHBondContact O-CB 3.3Å; A321-S325 PolarHBondContact O-N 3.14Å; A321-S325 PolarHBondContact O-OG 3.13Å; V322-S325 WeakPolarHBondContact CA-OG 3.16Å; V322-S325 PolarHBondContact O-N 3.13Å; V322-S325 PolarHBondContact O-OG 3.18Å; E323-S325 VanDerWaalsContact C-N 3.3Å; E323-S325 PolarHBondContact O-N 3.45Å; S325-G329 PolarHBondContact O-N 3.12Å; S325-H330 PolarHBondContact O-N 3.36Å; S325-L336 VanDerWaalsContact CB-CD1 3.41Å |
| 326 | R | 89.4 | Confident | 87.5 | Confident | 114 Ų | 114 | 49.7 Ų | 49.7 | 43% | 0.43 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -69.2 | -41.5 | 177.1 | -78.4 | 172.5 | 173.3 | 155.9 | -2.3 | 111.3 | V322 E323 L324 Q333 E359 | V322-R326 WeakPolarHBondContact O-CG 3.46Å; V322-R326 PolarHBondContact O-N 3.01Å; V322-R326 VanDerWaalsContact O-N 3.09Å; E323-R326 WeakPolarHBondContact O-CB 3.34Å; E323-R326 PolarHBondContact O-N 3.1Å; E323-R326 VanDerWaalsContact O-N 3.17Å; L324-R326 VanDerWaalsContact C-N 3.31Å; L324-R326 PolarHBondContact O-N 3.44Å; R326-Q333 VanDerWaalsContact CG-NE2 3.28Å; R326-E359 IonicContact CZ-OE1 2.74Å; R326-E359 IonicContact NH2-OE1 3.7Å; R326-E359 PolarHBondContact NH2-OE1 3.42Å; R326-E359 IonicContact NH2-OE2 2.64Å |
| 327 | E | 86.8 | Confident | 87.3 | Confident | 158 Ų | 158 | 46.2 Ų | 46.2 | 74% | 0.738 | 25% | 0.25 | S | C | * | . | H | α-helix | trans | -66.4 | -39.7 | 177.5 | -67.7 | 178.6 | -179.8 | 0 | 0 | 111.8 | E323 L324 | E323-E327 PolarHBondContact O-N 2.64Å; L324-E327 PolarHBondContact O-N 2.99Å |
| 328 | A | 84.8 | Confident | 87.1 | Confident | 56 Ų | 56 | 44.8 Ų | 44.8 | 46% | 0.463 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -80.9 | -14 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | L324 | L324-A328 WeakPolarHBondContact O-CB 3.36Å; L324-A328 PolarHBondContact O-N 2.96Å |
| 329 | G | 80.8 | Confident | 86.8 | Confident | 61 Ų | 61 | 47.1 Ų | 47.1 | 63% | 0.629 | 26% | 0.258 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.7 | 41.9 | -176.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | S325 | S325-G329 PolarHBondContact O-N 3.12Š|
| 330 | H | 74.1 | Confident | 86.8 | Confident | 23 Ų | 23 | 43.7 Ų | 43.7 | 11% | 0.106 | 24% | 0.243 | C | C | . | . | trans | -66.9 | 133.9 | -175 | -164 | -80.1 | 0 | 0 | 0 | 112.4 | P292 S325 D332 Q333 | P292-H330 WeakPolarHBondContact CA-NE2 3.47Å; P292-H330 WeakPolarHBondContact CB-NE2 3.44Å; S325-H330 PolarHBondContact O-N 3.36Å; H330-D332 VanDerWaalsContact C-N 3.31Å; H330-D332 IonicContact CE1-OD2 3.25Å; H330-D332 PolarHBondContact ND1-N 3.31Å; H330-D332 PolarHBondContact O-N 2.89Å; H330-Q333 PolarHBondContact O-N 3.02Å | ||
| 331 | P | 66.7 | Low | 86.8 | Confident | 102 Ų | 102 | 40.3 Ų | 40.3 | 66% | 0.662 | 23% | 0.227 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -62.6 | -34.8 | -177.4 | 23.7 | -33.9 | 0 | 0 | 0 | 113.4 | Q333 | P331-Q333 VanDerWaalsContact C-N 3.33Å; P331-Q333 PolarHBondContact O-N 3.19Å |
| 332 | D | 73.8 | Confident | 86.8 | Confident | 43 Ų | 43 | 40.9 Ų | 40.9 | 23% | 0.23 | 23% | 0.233 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -94.2 | 31.4 | -175.2 | -51.6 | -45.1 | 0 | 0 | 0 | 114.3 | H330 H334 V335 | H330-D332 VanDerWaalsContact C-N 3.31Å; H330-D332 IonicContact CE1-OD2 3.25Å; H330-D332 PolarHBondContact ND1-N 3.31Å; H330-D332 PolarHBondContact O-N 2.89Å; D332-H334 PolarHBondContact O-N 3.07Å; D332-H334 VanDerWaalsContact O-N 3.14Å; D332-H334 IonicContact OD1-CE1 3.78Å; D332-V335 HydrophobicContact CB-CG2 4.29Å; D332-V335 PolarHBondContact O-N 3.09Å; D332-V335 VanDerWaalsContact O-N 3.08Å |
| 333 | Q | 85.8 | Confident | 86.8 | Confident | 38 Ų | 38 | 40.8 Ų | 40.8 | 18% | 0.178 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -56.4 | -31.1 | -179.7 | -168.6 | -170.9 | -21.7 | 0 | 0 | 112.5 | R326 H330 P331 V335 L336 L337 L363 | R326-Q333 VanDerWaalsContact CG-NE2 3.28Å; H330-Q333 PolarHBondContact O-N 3.02Å; P331-Q333 VanDerWaalsContact C-N 3.33Å; P331-Q333 PolarHBondContact O-N 3.19Å; Q333-V335 VanDerWaalsContact C-N 3.29Å; Q333-V335 PolarHBondContact O-N 3.13Å; Q333-L336 PolarHBondContact O-N 3.3Å; Q333-L337 HydrophobicContact CG-CD1 4.07Å; Q333-L337 HydrophobicContact CG-CG 4.43Å; Q333-L337 WeakPolarHBondContact O-CG 3.47Å; Q333-L337 PolarHBondContact O-N 2.94Å; Q333-L363 HydrophobicContact CB-CD1 4.48Å; Q333-L363 HydrophobicContact CG-CD1 4.45Å |
| 334 | H | 87.4 | Confident | 86.9 | Confident | 3 Ų | 3 | 36.6 Ų | 36.6 | 1% | 0.014 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -62.2 | -33.3 | 178 | 57 | -76.2 | 0 | 0 | 0 | 113.3 | D332 G338 A360 L363 A364 D369 A372 | D332-H334 PolarHBondContact O-N 3.07Å; D332-H334 VanDerWaalsContact O-N 3.14Å; D332-H334 IonicContact OD1-CE1 3.78Å; H334-G338 PolarHBondContact O-N 3.15Å; H334-A360 WeakPolarHBondContact CB-O 3.31Å; H334-A360 WeakPolarHBondContact O-CB 3.23Å; H334-L363 HydrophobicContact CB-CB 3.77Å; H334-A364 HydrophobicContact CB-CB 4.06Å; H334-D369 IonicContact CD2-OD2 3.46Å; H334-D369 IonicContact CE1-OD2 2.81Å; H334-D369 IonicContact NE2-OD2 2.72Å; H334-D369 PolarHBondContact NE2-OD2 2.64Å; H334-A372 VanDerWaalsContact CD2-CB 3.48Å; H334-A372 WeakPolarHBondContact CD2-CB 3.34Å |
| 335 | V | 85.8 | Confident | 86.9 | Confident | 33 Ų | 33 | 35.6 Ų | 35.6 | 20% | 0.2 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -67.6 | -48.5 | 177.9 | -180 | 0 | 0 | 0 | 0 | 110.2 | D332 Q333 L337 G338 N339 | D332-V335 HydrophobicContact CB-CG2 4.29Å; D332-V335 PolarHBondContact O-N 3.09Å; D332-V335 VanDerWaalsContact O-N 3.08Å; Q333-V335 VanDerWaalsContact C-N 3.29Å; Q333-V335 PolarHBondContact O-N 3.13Å; V335-L337 VanDerWaalsContact C-N 3.33Å; V335-L337 PolarHBondContact O-N 3.33Å; V335-G338 PolarHBondContact O-N 3.33Å; V335-G338 VanDerWaalsContact O-N 3.17Å; V335-N339 PolarHBondContact O-N 3.42Å |
| 336 | L | 86.8 | Confident | 87.1 | Confident | 10 Ų | 10 | 38.1 Ų | 38.1 | 5% | 0.052 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -61.5 | -41.2 | 179 | -61.4 | 176.4 | 0 | 0 | 0 | 111.8 | L295 S299 A321 V322 S325 Q333 N339 M340 | L295-L336 HydrophobicContact CB-CD1 4.41Å; S299-L336 VanDerWaalsContact CB-CD2 3.43Å; A321-L336 HydrophobicContact CB-CD2 4.25Å; V322-L336 HydrophobicContact CG2-CB 3.82Å; S325-L336 VanDerWaalsContact CB-CD1 3.41Å; Q333-L336 PolarHBondContact O-N 3.3Å; L336-N339 PolarHBondContact O-N 2.97Å; L336-M340 PolarHBondContact O-N 3.01Å |
| 337 | L | 92.6 | Very high | 87.2 | Confident | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -64.8 | -40.6 | 175 | -72.8 | 167.1 | 0 | 0 | 0 | 112.4 | V322 Q333 V335 M340 A341 L356 E359 A360 L363 | V322-L337 HydrophobicContact CG1-CD2 3.75Å; V322-L337 HydrophobicContact CG1-CG 4.47Å; V322-L337 HydrophobicContact CG2-CD2 4.34Å; Q333-L337 HydrophobicContact CG-CD1 4.07Å; Q333-L337 HydrophobicContact CG-CG 4.43Å; Q333-L337 WeakPolarHBondContact O-CG 3.47Å; Q333-L337 PolarHBondContact O-N 2.94Å; V335-L337 VanDerWaalsContact C-N 3.33Å; V335-L337 PolarHBondContact O-N 3.33Å; L337-M340 PolarHBondContact O-N 3.38Å; L337-A341 WeakPolarHBondContact O-CB 3.35Å; L337-A341 PolarHBondContact O-N 3Å; L337-L356 HydrophobicContact CD2-CD2 4.09Å; L337-E359 HydrophobicContact CD1-CG 3.91Å; L337-A360 HydrophobicContact CB-CB 3.82Å; L337-L363 HydrophobicContact CD1-CD1 3.53Å |
| 338 | G | 90.7 | Very high | 87.5 | Confident | 10 Ų | 10 | 29 Ų | 29 | 10% | 0.103 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -61.7 | -43.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | H334 V335 A341 G342 Y357 | H334-G338 PolarHBondContact O-N 3.15Å; V335-G338 PolarHBondContact O-N 3.33Å; V335-G338 VanDerWaalsContact O-N 3.17Å; G338-A341 WeakPolarHBondContact O-CB 3.42Å; G338-A341 PolarHBondContact O-N 3.25Å; G338-G342 PolarHBondContact O-N 3.21Å; G338-Y357 WeakPolarHBondContact O-CE1 3.36Å |
| 339 | N | 87.8 | Confident | 87.9 | Confident | 49 Ų | 49 | 29.2 Ų | 29.2 | 26% | 0.262 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -64.6 | -45.4 | 176.2 | -69.7 | -8.4 | 0 | 0 | 0 | 111.2 | S299 V318 V335 L336 A341 G342 V343 | S299-N339 PolarHBondContact OG-ND2 2.9Å; V318-N339 HydrophobicContact CG2-CB 4.16Å; V335-N339 PolarHBondContact O-N 3.42Å; L336-N339 PolarHBondContact O-N 2.97Å; N339-A341 VanDerWaalsContact C-N 3.3Å; N339-A341 PolarHBondContact O-N 3.45Å; N339-G342 PolarHBondContact O-N 2.98Å; N339-G342 VanDerWaalsContact O-N 3.1Å; N339-V343 WeakPolarHBondContact O-CG2 3.48Å; N339-V343 PolarHBondContact O-N 2.77Å |
| 340 | M | 94.9 | Very high | 88.6 | Confident | 27 Ų | 27 | 27.7 Ų | 27.7 | 13% | 0.133 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -59.2 | -42 | 174.9 | -174.5 | 176.4 | 177 | 0 | 0 | 111.7 | L315 V318 K319 V322 L336 L337 G342 V343 L344 L356 | L315-M340 HydrophobicContact CD1-CE 4.37Å; V318-M340 HydrophobicContact CG1-CB 3.97Å; V318-M340 HydrophobicContact CG1-CG 3.93Å; V318-M340 HydrophobicContact CG2-CB 3.86Å; K319-M340 HydrophobicContact CB-CE 4.18Å; K319-M340 HydrophobicContact CG-CE 4.21Å; V322-M340 HydrophobicContact CB-SD 4.49Å; V322-M340 HydrophobicContact CG2-CB 4.32Å; V322-M340 HydrophobicContact CG2-SD 4.14Å; L336-M340 PolarHBondContact O-N 3.01Å; L337-M340 PolarHBondContact O-N 3.38Å; M340-G342 VanDerWaalsContact C-N 3.29Å; M340-G342 PolarHBondContact O-N 3.37Å; M340-V343 PolarHBondContact O-N 3.44Å; M340-L344 HydrophobicContact CG-CD1 4.43Å; M340-L344 WeakPolarHBondContact O-CG 3.32Å; M340-L344 PolarHBondContact O-N 3.16Å; M340-L356 HydrophobicContact CB-CD1 3.97Å; M340-L356 HydrophobicContact CE-CD1 3.95Å; M340-L356 HydrophobicContact CG-CD1 3.5Å; M340-L356 VanDerWaalsContact CG-CD1 3.5Å; M340-L356 HydrophobicContact SD-CD1 3.56Å; M340-L356 VanDerWaalsContact SD-CD1 3.56Å |
| 341 | A | 95.4 | Very high | 89.6 | Confident | 0 Ų | 0 | 31.6 Ų | 31.6 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -62.8 | -35.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | L337 G338 N339 L345 S353 L356 Y357 | L337-A341 WeakPolarHBondContact O-CB 3.35Å; L337-A341 PolarHBondContact O-N 3Å; G338-A341 WeakPolarHBondContact O-CB 3.42Å; G338-A341 PolarHBondContact O-N 3.25Å; N339-A341 VanDerWaalsContact C-N 3.3Å; N339-A341 PolarHBondContact O-N 3.45Å; A341-L345 WeakPolarHBondContact O-CB 3.46Å; A341-L345 PolarHBondContact O-N 3.31Å; A341-S353 WeakPolarHBondContact O-CB 3.4Å; A341-S353 PolarHBondContact O-OG 3.48Å; A341-L356 HydrophobicContact CB-CB 3.74Å; A341-Y357 HydrophobicContact CB-CD1 3.52Å; A341-Y357 HydrophobicContact CB-CD2 3.63Å; A341-Y357 HydrophobicContact CB-CE1 3.59Å; A341-Y357 HydrophobicContact CB-CE2 3.7Å; A341-Y357 HydrophobicContact CB-CG 3.54Å |
| 342 | G | 92.8 | Very high | 90.9 | Very high | 12 Ų | 12 | 31.5 Ų | 31.5 | 12% | 0.124 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -64.7 | -47.4 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | G338 N339 M340 L344 L345 H346 Y357 | G338-G342 PolarHBondContact O-N 3.21Å; N339-G342 PolarHBondContact O-N 2.98Å; N339-G342 VanDerWaalsContact O-N 3.1Å; M340-G342 VanDerWaalsContact C-N 3.29Å; M340-G342 PolarHBondContact O-N 3.37Å; G342-L344 VanDerWaalsContact C-N 3.34Å; G342-L344 PolarHBondContact O-N 3.26Å; G342-L345 WeakPolarHBondContact O-CB 3.26Å; G342-L345 PolarHBondContact O-N 3.45Å; G342-L345 VanDerWaalsContact O-N 3.15Å; G342-H346 PolarHBondContact O-N 2.95Å; G342-Y357 VanDerWaalsContact CA-OH 3.28Å; G342-Y357 WeakPolarHBondContact CA-OH 3.12Å; G342-Y357 PolarHBondContact N-OH 3.32Å |
| 343 | V | 93.4 | Very high | 92 | Very high | 2 Ų | 2 | 29.5 Ų | 29.5 | 1% | 0.012 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -60.6 | -43.4 | 175.9 | 178.3 | 0 | 0 | 0 | 0 | 111 | D306 A314 L315 V318 N339 M340 L345 H346 N347 | D306-V343 HydrophobicContact CB-CG2 4.05Å; A314-V343 HydrophobicContact CB-CG1 3.87Å; A314-V343 HydrophobicContact CB-CG2 4.31Å; L315-V343 HydrophobicContact CB-CG1 4.11Å; L315-V343 HydrophobicContact CD1-CG1 4.28Å; V318-V343 HydrophobicContact CG1-CB 4.46Å; V318-V343 HydrophobicContact CG1-CG2 4.27Å; N339-V343 WeakPolarHBondContact O-CG2 3.48Å; N339-V343 PolarHBondContact O-N 2.77Å; M340-V343 PolarHBondContact O-N 3.44Å; V343-L345 VanDerWaalsContact C-N 3.33Å; V343-L345 PolarHBondContact O-N 2.7Å; V343-H346 PolarHBondContact O-N 3.29Å; V343-N347 WeakPolarHBondContact O-CB 3.43Å; V343-N347 PolarHBondContact O-N 3.12Å |
| 344 | L | 94.6 | Very high | 92.5 | Very high | 3 Ų | 3 | 28.9 Ų | 28.9 | 2% | 0.016 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -62.7 | -38.7 | 175.4 | -71.9 | 174.1 | 0 | 0 | 0 | 112.7 | L315 M340 G342 N347 G348 L349 E352 L356 | L315-L344 HydrophobicContact CD1-CD2 3.64Å; L315-L344 HydrophobicContact CD1-CG 4.07Å; L315-L344 HydrophobicContact CD2-CD2 4.12Å; M340-L344 HydrophobicContact CG-CD1 4.43Å; M340-L344 WeakPolarHBondContact O-CG 3.32Å; M340-L344 PolarHBondContact O-N 3.16Å; G342-L344 VanDerWaalsContact C-N 3.34Å; G342-L344 PolarHBondContact O-N 3.26Å; L344-N347 CarbonylContact O-C 3.54Å; L344-N347 PolarHBondContact O-N 3.37Å; L344-G348 PolarHBondContact O-N 3.43Å; L344-L349 HydrophobicContact CB-CB 4.28Å; L344-L349 HydrophobicContact CD2-CB 4.1Å; L344-L349 HydrophobicContact CD2-CD1 3.55Å; L344-L349 HydrophobicContact CD2-CG 4.47Å; L344-L349 PolarHBondContact O-N 2.96Å; L344-E352 HydrophobicContact CD1-CB 3.87Å; L344-L356 HydrophobicContact CD1-CD1 3.47Å; L344-L356 VanDerWaalsContact CD1-CD1 3.47Å; L344-L356 HydrophobicContact CD1-CG 4.29Å |
| 345 | L | 93.3 | Very high | 93 | Very high | 4 Ų | 4 | 35.9 Ų | 35.9 | 2% | 0.021 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -61 | -45.6 | 174.9 | 163.8 | 63.1 | 0 | 0 | 0 | 111 | A341 G342 V343 N347 G348 F350 E382 V383 R386 | A341-L345 WeakPolarHBondContact O-CB 3.46Å; A341-L345 PolarHBondContact O-N 3.31Å; G342-L345 WeakPolarHBondContact O-CB 3.26Å; G342-L345 PolarHBondContact O-N 3.45Å; G342-L345 VanDerWaalsContact O-N 3.15Å; V343-L345 VanDerWaalsContact C-N 3.33Å; V343-L345 PolarHBondContact O-N 2.7Å; L345-N347 VanDerWaalsContact C-N 3.31Å; L345-N347 PolarHBondContact O-N 3.35Å; L345-G348 PolarHBondContact O-N 2.84Å; L345-G348 VanDerWaalsContact O-N 3.11Å; L345-F350 HydrophobicContact CD1-CD1 3.77Å; L345-F350 HydrophobicContact CD1-CE1 3.77Å; L345-E382 HydrophobicContact CD2-CB 4.23Å; L345-E382 HydrophobicContact CD2-CG 3.83Å; L345-V383 HydrophobicContact CB-CG2 4.34Å; L345-V383 HydrophobicContact CD1-CB 4.2Å; L345-V383 HydrophobicContact CD1-CG1 4.5Å; L345-V383 HydrophobicContact CD1-CG2 3.81Å; L345-V383 HydrophobicContact CD2-CG2 3.94Å; L345-V383 HydrophobicContact CG-CG2 4.26Å; L345-R386 HydrophobicContact CD1-CB 4.32Å; L345-R386 HydrophobicContact CD1-CG 4.29Å |
| 346 | H | 92 | Very high | 93.5 | Very high | 52 Ų | 52 | 35.3 Ų | 35.3 | 24% | 0.241 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -66.8 | -33.3 | 176.9 | -66.5 | 164.2 | 0 | 0 | 0 | 112.4 | D306 G342 V343 G348 R386 | D306-H346 WeakPolarHBondContact OD1-CB 3.35Å; D306-H346 IonicContact OD1-CG 3.78Å; D306-H346 IonicContact OD1-ND1 2.66Å; D306-H346 PolarHBondContact OD1-ND1 2.88Å; D306-H346 IonicContact OD2-CE1 3.02Å; D306-H346 PolarHBondContact OD2-CE1 2.97Å; D306-H346 IonicContact OD2-CG 3.39Å; D306-H346 IonicContact OD2-ND1 3.4Å; D306-H346 PolarHBondContact OD2-ND1 3.4Å; G342-H346 PolarHBondContact O-N 2.95Å; V343-H346 PolarHBondContact O-N 3.29Å; H346-G348 PolarHBondContact O-N 3.28Å; H346-R386 PolarHBondContact CD2-NH1 3.48Å |
| 347 | N | 91.7 | Very high | 94 | Very high | 53 Ų | 53 | 35.5 Ų | 35.5 | 28% | 0.283 | 18% | 0.184 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -77.5 | 6 | 172.2 | -149.1 | 14.8 | 0 | 0 | 0 | 114.3 | H311 D312 V343 L344 L345 L349 | H311-N347 HydrophobicContact CB-CB 4.14Å; D312-N347 PolarHBondContact OD1-ND2 3.01Å; V343-N347 WeakPolarHBondContact O-CB 3.43Å; V343-N347 PolarHBondContact O-N 3.12Å; L344-N347 CarbonylContact O-C 3.54Å; L344-N347 PolarHBondContact O-N 3.37Å; L345-N347 VanDerWaalsContact C-N 3.31Å; L345-N347 PolarHBondContact O-N 3.35Å; N347-L349 VanDerWaalsContact C-N 3.27Å; N347-L349 PolarHBondContact O-N 3.36Å |
| 348 | G | 91.4 | Very high | 94.3 | Very high | 27 Ų | 27 | 42 Ų | 42 | 28% | 0.278 | 21% | 0.212 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 75 | 7.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | L344 L345 H346 F350 | L344-G348 PolarHBondContact O-N 3.43Å; L345-G348 PolarHBondContact O-N 2.84Å; L345-G348 VanDerWaalsContact O-N 3.11Å; H346-G348 PolarHBondContact O-N 3.28Å; G348-F350 VanDerWaalsContact C-N 3.27Å; G348-F350 PolarHBondContact O-N 2.72Å |
| 349 | L | 94.1 | Very high | 94.5 | Very high | 61 Ų | 61 | 44.8 Ų | 44.8 | 32% | 0.319 | 22% | 0.222 | S | C | . | . | trans | -85.5 | 63.1 | 179 | -64.1 | 171.9 | 0 | 0 | 0 | 110.8 | L344 N347 E351 E352 S353 | L344-L349 HydrophobicContact CB-CB 4.28Å; L344-L349 HydrophobicContact CD2-CB 4.1Å; L344-L349 HydrophobicContact CD2-CD1 3.55Å; L344-L349 HydrophobicContact CD2-CG 4.47Å; L344-L349 PolarHBondContact O-N 2.96Å; N347-L349 VanDerWaalsContact C-N 3.27Å; N347-L349 PolarHBondContact O-N 3.36Å; L349-E351 PolarHBondContact O-N 2.81Å; L349-E352 HydrophobicContact CB-CB 4.5Å; L349-E352 PolarHBondContact O-N 3.46Å; L349-S353 WeakPolarHBondContact O-CB 3.17Å; L349-S353 PolarHBondContact O-N 3.25Å | ||
| 350 | F | 94.6 | Very high | 94.8 | Very high | 29 Ų | 29 | 42.5 Ų | 42.5 | 13% | 0.127 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -62.4 | -38.4 | -168.9 | -56 | -46.2 | 0 | 0 | 0 | 114.6 | L345 G348 S353 V354 V383 R386 R387 K390 | L345-F350 HydrophobicContact CD1-CD1 3.77Å; L345-F350 HydrophobicContact CD1-CE1 3.77Å; G348-F350 VanDerWaalsContact C-N 3.27Å; G348-F350 PolarHBondContact O-N 2.72Å; F350-S353 PolarHBondContact O-N 3.24Å; F350-V354 WeakPolarHBondContact O-CG2 3.42Å; F350-V354 PolarHBondContact O-N 2.87Å; F350-V383 HydrophobicContact CB-CG1 4.05Å; F350-V383 HydrophobicContact CD1-CG1 4.39Å; F350-R386 HydrophobicContact CE1-CB 3.73Å; F350-R386 HydrophobicContact CZ-CB 3.8Å; F350-R387 HydrophobicContact CB-CG 3.68Å; F350-R387 HydrophobicContact CD1-CG 4.45Å; F350-R387 HydrophobicContact CD2-CG 3.57Å; F350-R387 HydrophobicContact CE2-CG 4.27Å; F350-R387 HydrophobicContact CG-CG 3.66Å; F350-K390 HydrophobicContact CD2-CD 4.45Å; F350-K390 HydrophobicContact CE2-CB 4.2Å; F350-K390 HydrophobicContact CE2-CD 3.6Å; F350-K390 HydrophobicContact CZ-CD 4.4Å |
| 351 | E | 95 | Very high | 94.9 | Very high | 105 Ų | 105 | 42.6 Ų | 42.6 | 49% | 0.491 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -70.8 | -35 | -178.2 | -59.2 | -56.5 | 163.7 | 0 | 0 | 112.2 | L349 K355 R387 | L349-E351 PolarHBondContact O-N 2.81Å; E351-K355 WeakPolarHBondContact O-CG 3.24Å; E351-K355 PolarHBondContact O-N 3.43Å; E351-R387 IonicContact OE1-CZ 2.97Å; E351-R387 IonicContact OE1-NE 3.71Å; E351-R387 IonicContact OE1-NH1 3.64Å; E351-R387 PolarHBondContact OE1-NH1 3.14Å; E351-R387 IonicContact OE1-NH2 2.63Å; E351-R387 PolarHBondContact OE1-NH2 3.45Å; E351-R387 IonicContact OE2-CZ 3.63Å; E351-R387 IonicContact OE2-NH1 3.22Å; E351-R387 PolarHBondContact OE2-NH1 2.88Å; E351-R387 IonicContact OE2-NH2 3.7Å |
| 352 | E | 95.6 | Very high | 95 | Very high | 101 Ų | 101 | 45.3 Ų | 45.3 | 47% | 0.472 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -70.4 | -42.6 | 174.8 | -64.5 | 176.1 | -145.9 | 0 | 0 | 110.7 | L344 L349 V354 K355 L356 | L344-E352 HydrophobicContact CD1-CB 3.87Å; L349-E352 HydrophobicContact CB-CB 4.5Å; L349-E352 PolarHBondContact O-N 3.46Å; E352-V354 PolarHBondContact O-N 3.47Å; E352-K355 PolarHBondContact O-N 3.15Å; E352-L356 PolarHBondContact O-N 3.46Å |
| 353 | S | 96.1 | Very high | 95 | Very high | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -56.1 | -47.1 | 173.7 | 177.7 | 0 | 0 | 0 | 0 | 112.4 | A341 L349 F350 K355 L356 Y357 V383 | A341-S353 WeakPolarHBondContact O-CB 3.4Å; A341-S353 PolarHBondContact O-OG 3.48Å; L349-S353 WeakPolarHBondContact O-CB 3.17Å; L349-S353 PolarHBondContact O-N 3.25Å; F350-S353 PolarHBondContact O-N 3.24Å; S353-K355 VanDerWaalsContact C-N 3.32Å; S353-K355 PolarHBondContact O-N 2.92Å; S353-L356 PolarHBondContact O-N 3.47Å; S353-Y357 WeakPolarHBondContact O-CD2 3.07Å; S353-Y357 PolarHBondContact O-N 3.41Å; S353-Y357 WeakPolarHBondContact OG-CD2 3.38Å; S353-Y357 WeakPolarHBondContact OG-CE2 3.32Å; S353-V383 WeakPolarHBondContact OG-CG2 3.24Å |
| 354 | V | 97.3 | Very high | 94.8 | Very high | 25 Ų | 25 | 47.6 Ų | 47.6 | 15% | 0.152 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -60.7 | -40.7 | 177.1 | 172.4 | 0 | 0 | 0 | 0 | 112 | F350 E352 K358 L380 V383 | F350-V354 WeakPolarHBondContact O-CG2 3.42Å; F350-V354 PolarHBondContact O-N 2.87Å; E352-V354 PolarHBondContact O-N 3.47Å; V354-K358 HydrophobicContact CG1-CD 4.11Å; V354-K358 HydrophobicContact CG1-CG 4.47Å; V354-K358 WeakPolarHBondContact O-CG 3.15Å; V354-K358 PolarHBondContact O-N 3.41Å; V354-L380 HydrophobicContact CG1-CD2 4.39Å; V354-V383 HydrophobicContact CG2-CB 4.33Å; V354-V383 HydrophobicContact CG2-CG1 3.55Å |
| 355 | K | 97.3 | Very high | 94.7 | Very high | 150 Ų | 150 | 52.3 Ų | 52.3 | 65% | 0.652 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -61.9 | -48.7 | 179 | -72.7 | 173.8 | -176.5 | 177.8 | 0 | 110.7 | E351 E352 S353 K358 E359 | E351-K355 WeakPolarHBondContact O-CG 3.24Å; E351-K355 PolarHBondContact O-N 3.43Å; E352-K355 PolarHBondContact O-N 3.15Å; S353-K355 VanDerWaalsContact C-N 3.32Å; S353-K355 PolarHBondContact O-N 2.92Å; K355-K358 PolarHBondContact O-N 3.02Å; K355-E359 PolarHBondContact O-N 3.32Å; K355-E359 VanDerWaalsContact O-N 3.08Å |
| 356 | L | 96.6 | Very high | 94.7 | Very high | 22 Ų | 22 | 57.2 Ų | 57.2 | 12% | 0.115 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -66.4 | -42.1 | 179.9 | -68.4 | -170.4 | 0 | 0 | 0 | 112.6 | L337 M340 A341 L344 E352 S353 K358 E359 A360 | L337-L356 HydrophobicContact CD2-CD2 4.09Å; M340-L356 HydrophobicContact CB-CD1 3.97Å; M340-L356 HydrophobicContact CE-CD1 3.95Å; M340-L356 HydrophobicContact CG-CD1 3.5Å; M340-L356 VanDerWaalsContact CG-CD1 3.5Å; M340-L356 HydrophobicContact SD-CD1 3.56Å; M340-L356 VanDerWaalsContact SD-CD1 3.56Å; A341-L356 HydrophobicContact CB-CB 3.74Å; L344-L356 HydrophobicContact CD1-CD1 3.47Å; L344-L356 VanDerWaalsContact CD1-CD1 3.47Å; L344-L356 HydrophobicContact CD1-CG 4.29Å; E352-L356 PolarHBondContact O-N 3.46Å; S353-L356 PolarHBondContact O-N 3.47Å; L356-K358 VanDerWaalsContact C-N 3.28Å; L356-K358 PolarHBondContact O-N 3.33Å; L356-E359 PolarHBondContact O-N 2.85Å; L356-A360 WeakPolarHBondContact O-CB 3.5Å; L356-A360 PolarHBondContact O-N 2.98Å |
| 357 | Y | 97.5 | Very high | 94.5 | Very high | 14 Ų | 14 | 57.9 Ų | 57.9 | 6% | 0.055 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -61.6 | -35.7 | 175 | -83.5 | -48.9 | 0 | 0 | 0 | 112.6 | G338 A341 G342 S353 L361 I376 L380 V383 | G338-Y357 WeakPolarHBondContact O-CE1 3.36Å; A341-Y357 HydrophobicContact CB-CD1 3.52Å; A341-Y357 HydrophobicContact CB-CD2 3.63Å; A341-Y357 HydrophobicContact CB-CE1 3.59Å; A341-Y357 HydrophobicContact CB-CE2 3.7Å; A341-Y357 HydrophobicContact CB-CG 3.54Å; G342-Y357 VanDerWaalsContact CA-OH 3.28Å; G342-Y357 WeakPolarHBondContact CA-OH 3.12Å; G342-Y357 PolarHBondContact N-OH 3.32Å; S353-Y357 WeakPolarHBondContact O-CD2 3.07Å; S353-Y357 PolarHBondContact O-N 3.41Å; S353-Y357 WeakPolarHBondContact OG-CD2 3.38Å; S353-Y357 WeakPolarHBondContact OG-CE2 3.32Å; Y357-L361 VanDerWaalsContact O-CB 3.27Å; Y357-L361 WeakPolarHBondContact O-CB 3.14Å; Y357-L361 PolarHBondContact O-N 3.46Å; Y357-I376 HydrophobicContact CD1-CB 4.49Å; Y357-I376 HydrophobicContact CD1-CG2 3.91Å; Y357-I376 HydrophobicContact CG-CG2 4.43Å; Y357-I376 VanDerWaalsContact O-CG2 3.23Å; Y357-I376 WeakPolarHBondContact O-CG2 3.45Å; Y357-L380 VanDerWaalsContact CB-CD2 3.46Å; Y357-L380 HydrophobicContact CD2-CD2 4.2Å; Y357-L380 HydrophobicContact CD2-CG 4.36Å; Y357-L380 HydrophobicContact CG-CD2 4.18Å; Y357-L380 HydrophobicContact CG-CG 4.14Å; Y357-V383 HydrophobicContact CD2-CG2 3.93Å; Y357-V383 HydrophobicContact CE2-CG2 3.75Å |
| 358 | K | 97.7 | Very high | 94.4 | Very high | 135 Ų | 135 | 57.8 Ų | 57.8 | 59% | 0.587 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -67.6 | -40.6 | 175 | -75.8 | 177.6 | 177.9 | -178.2 | 0 | 112.4 | V354 K355 L356 L361 A362 | V354-K358 HydrophobicContact CG1-CD 4.11Å; V354-K358 HydrophobicContact CG1-CG 4.47Å; V354-K358 WeakPolarHBondContact O-CG 3.15Å; V354-K358 PolarHBondContact O-N 3.41Å; K355-K358 PolarHBondContact O-N 3.02Å; L356-K358 VanDerWaalsContact C-N 3.28Å; L356-K358 PolarHBondContact O-N 3.33Å; K358-L361 PolarHBondContact O-N 2.95Å; K358-A362 PolarHBondContact O-N 3.15Å; K358-A362 VanDerWaalsContact O-N 3.15Å |
| 359 | E | 96 | Very high | 94 | Very high | 70 Ų | 70 | 57.9 Ų | 57.9 | 33% | 0.327 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -61.4 | -49.9 | 173.5 | -173.5 | -176.4 | 157.6 | 0 | 0 | 110.6 | R326 L337 K355 L356 L361 A362 L363 | R326-E359 IonicContact CZ-OE1 2.74Å; R326-E359 IonicContact NH2-OE1 3.7Å; R326-E359 PolarHBondContact NH2-OE1 3.42Å; R326-E359 IonicContact NH2-OE2 2.64Å; L337-E359 HydrophobicContact CD1-CG 3.91Å; K355-E359 PolarHBondContact O-N 3.32Å; K355-E359 VanDerWaalsContact O-N 3.08Å; L356-E359 PolarHBondContact O-N 2.85Å; E359-L361 VanDerWaalsContact C-N 3.32Å; E359-L361 PolarHBondContact O-N 3.42Å; E359-A362 PolarHBondContact O-N 3.08Å; E359-L363 HydrophobicContact CG-CD1 4.43Å; E359-L363 PolarHBondContact O-N 2.84Å; E359-L363 VanDerWaalsContact O-N 3.13Å |
| 360 | A | 94.3 | Very high | 93.7 | Very high | 0 Ų | 0 | 61.3 Ų | 61.3 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -56.9 | -44.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | H334 L337 L356 A362 L363 A364 I376 | H334-A360 WeakPolarHBondContact CB-O 3.31Å; H334-A360 WeakPolarHBondContact O-CB 3.23Å; L337-A360 HydrophobicContact CB-CB 3.82Å; L356-A360 WeakPolarHBondContact O-CB 3.5Å; L356-A360 PolarHBondContact O-N 2.98Å; A360-A362 PolarHBondContact O-N 3.44Å; A360-L363 PolarHBondContact O-N 2.87Å; A360-A364 WeakPolarHBondContact O-CB 3.25Å; A360-A364 PolarHBondContact O-N 2.99Å; A360-I376 HydrophobicContact CB-CD1 3.7Å; A360-I376 HydrophobicContact CB-CG1 4.23Å |
| 361 | L | 96.9 | Very high | 93.2 | Very high | 30 Ų | 30 | 62.2 Ų | 62.2 | 16% | 0.157 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -62.6 | -43.8 | -179.3 | -174.3 | 62 | 0 | 0 | 0 | 111.8 | Y357 K358 E359 L363 A364 Q365 V373 I376 R377 L380 | Y357-L361 VanDerWaalsContact O-CB 3.27Å; Y357-L361 WeakPolarHBondContact O-CB 3.14Å; Y357-L361 PolarHBondContact O-N 3.46Å; K358-L361 PolarHBondContact O-N 2.95Å; E359-L361 VanDerWaalsContact C-N 3.32Å; E359-L361 PolarHBondContact O-N 3.42Å; L361-L363 VanDerWaalsContact C-N 3.33Å; L361-A364 PolarHBondContact O-N 3.27Å; L361-Q365 WeakPolarHBondContact O-CB 3.44Å; L361-Q365 VanDerWaalsContact O-CG 3.23Å; L361-Q365 WeakPolarHBondContact O-CG 3.27Å; L361-Q365 PolarHBondContact O-N 3.27Å; L361-V373 HydrophobicContact CD1-CB 4.31Å; L361-V373 HydrophobicContact CD1-CG1 3.95Å; L361-V373 HydrophobicContact CD1-CG2 4.21Å; L361-I376 HydrophobicContact CB-CG2 3.74Å; L361-I376 HydrophobicContact CD1-CB 4.38Å; L361-I376 HydrophobicContact CD1-CG2 4.11Å; L361-I376 HydrophobicContact CG-CG2 4.43Å; L361-R377 HydrophobicContact CD1-CG 4.31Å; L361-L380 HydrophobicContact CD2-CD1 4.28Å |
| 362 | A | 96.2 | Very high | 92.6 | Very high | 57 Ų | 57 | 57.8 Ų | 57.8 | 47% | 0.471 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -63.7 | -41 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | K358 E359 A360 S366 | K358-A362 PolarHBondContact O-N 3.15Å; K358-A362 VanDerWaalsContact O-N 3.15Å; E359-A362 PolarHBondContact O-N 3.08Å; A360-A362 PolarHBondContact O-N 3.44Å; A362-S366 WeakPolarHBondContact O-CB 3.46Å; A362-S366 PolarHBondContact O-N 3.07Å |
| 363 | L | 92.3 | Very high | 92.4 | Very high | 61 Ų | 61 | 53.1 Ų | 53.1 | 32% | 0.319 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -67.1 | -46.3 | 176.3 | -71.3 | 172.5 | 0 | 0 | 0 | 111.9 | Q333 H334 L337 E359 A360 L361 Q365 S366 A367 | Q333-L363 HydrophobicContact CB-CD1 4.48Å; Q333-L363 HydrophobicContact CG-CD1 4.45Å; H334-L363 HydrophobicContact CB-CB 3.77Å; L337-L363 HydrophobicContact CD1-CD1 3.53Å; E359-L363 HydrophobicContact CG-CD1 4.43Å; E359-L363 PolarHBondContact O-N 2.84Å; E359-L363 VanDerWaalsContact O-N 3.13Å; A360-L363 PolarHBondContact O-N 2.87Å; L361-L363 VanDerWaalsContact C-N 3.33Å; L363-Q365 VanDerWaalsContact C-N 3.33Å; L363-Q365 PolarHBondContact O-N 2.78Å; L363-S366 PolarHBondContact O-N 2.91Å; L363-S366 VanDerWaalsContact O-N 3.13Å; L363-A367 WeakPolarHBondContact O-CB 3.49Å; L363-A367 PolarHBondContact O-N 3.29Å |
| 364 | A | 89.6 | Confident | 92.1 | Very high | 0 Ų | 0 | 58.6 Ų | 58.6 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -59.8 | -42.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | H334 A360 L361 A367 G368 D369 A372 V373 I376 | H334-A364 HydrophobicContact CB-CB 4.06Å; A360-A364 WeakPolarHBondContact O-CB 3.25Å; A360-A364 PolarHBondContact O-N 2.99Å; L361-A364 PolarHBondContact O-N 3.27Å; A364-A367 PolarHBondContact O-N 3.11Å; A364-G368 PolarHBondContact O-N 3.38Å; A364-D369 PolarHBondContact O-N 2.88Å; A364-A372 HydrophobicContact CB-CB 4.11Å; A364-V373 HydrophobicContact CB-CG2 3.74Å; A364-I376 HydrophobicContact CB-CD1 3.94Å |
| 365 | Q | 94.1 | Very high | 91.4 | Very high | 103 Ų | 103 | 60.3 Ų | 60.3 | 48% | 0.481 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -64 | -41.4 | 174.2 | -73.4 | 176.2 | -25 | 0 | 0 | 112.5 | L361 L363 A367 G368 V373 | L361-Q365 WeakPolarHBondContact O-CB 3.44Å; L361-Q365 VanDerWaalsContact O-CG 3.23Å; L361-Q365 WeakPolarHBondContact O-CG 3.27Å; L361-Q365 PolarHBondContact O-N 3.27Å; L363-Q365 VanDerWaalsContact C-N 3.33Å; L363-Q365 PolarHBondContact O-N 2.78Å; Q365-A367 VanDerWaalsContact C-N 3.25Å; Q365-A367 PolarHBondContact O-N 3.34Å; Q365-G368 PolarHBondContact O-N 3.02Å; Q365-V373 HydrophobicContact CG-CG2 3.72Å |
| 366 | S | 92.8 | Very high | 91.1 | Very high | 107 Ų | 107 | 53.5 Ų | 53.5 | 75% | 0.748 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -66.4 | -29.9 | 176 | -173 | 0 | 0 | 0 | 0 | 112.3 | A362 L363 | A362-S366 WeakPolarHBondContact O-CB 3.46Å; A362-S366 PolarHBondContact O-N 3.07Å; L363-S366 PolarHBondContact O-N 2.91Å; L363-S366 VanDerWaalsContact O-N 3.13Å |
| 367 | A | 87.9 | Confident | 91 | Very high | 66 Ų | 66 | 59 Ų | 59 | 55% | 0.545 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -81.5 | -17.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113 | L363 A364 Q365 D369 | L363-A367 WeakPolarHBondContact O-CB 3.49Å; L363-A367 PolarHBondContact O-N 3.29Å; A364-A367 PolarHBondContact O-N 3.11Å; Q365-A367 VanDerWaalsContact C-N 3.25Å; Q365-A367 PolarHBondContact O-N 3.34Å; A367-D369 VanDerWaalsContact C-N 3.31Å |
| 368 | G | 88.9 | Confident | 90.8 | Very high | 51 Ų | 51 | 61.3 Ų | 61.3 | 53% | 0.526 | 33% | 0.331 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 73.3 | 22.6 | -172.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | A364 Q365 E370 | A364-G368 PolarHBondContact O-N 3.38Å; Q365-G368 PolarHBondContact O-N 3.02Å; G368-E370 PolarHBondContact O-N 2.83Å |
| 369 | D | 83.9 | Confident | 90.5 | Very high | 28 Ų | 28 | 54.9 Ų | 54.9 | 15% | 0.15 | 30% | 0.303 | C | S | . | . | trans | -84.9 | 83.2 | 177.2 | -172.8 | -15.1 | 0 | 0 | 0 | 110 | H334 A364 A367 E371 A372 V373 | H334-D369 IonicContact CD2-OD2 3.46Å; H334-D369 IonicContact CE1-OD2 2.81Å; H334-D369 IonicContact NE2-OD2 2.72Å; H334-D369 PolarHBondContact NE2-OD2 2.64Å; A364-D369 PolarHBondContact O-N 2.88Å; A367-D369 VanDerWaalsContact C-N 3.31Å; D369-E371 VanDerWaalsContact C-N 3.25Å; D369-E371 PolarHBondContact O-N 2.72Å; D369-E371 PolarHBondContact OD1-N 2.96Å; D369-A372 HydrophobicContact CB-CB 4.13Å; D369-A372 PolarHBondContact O-N 2.92Å; D369-A372 WeakPolarHBondContact OD1-CB 3.35Å; D369-A372 PolarHBondContact OD1-N 3.2Å; D369-A372 WeakPolarHBondContact OD2-CB 3.43Å; D369-V373 VanDerWaalsContact O-CG2 3.29Å; D369-V373 WeakPolarHBondContact O-CG2 3.28Å; D369-V373 PolarHBondContact O-N 2.87Å | ||
| 370 | E | 87.9 | Confident | 90.5 | Very high | 134 Ų | 134 | 53.6 Ų | 53.6 | 63% | 0.626 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -63.3 | -30.6 | -178.3 | -66.8 | -63.8 | 163.7 | 0 | 0 | 113 | G368 V373 E374 | G368-E370 PolarHBondContact O-N 2.83Å; E370-V373 PolarHBondContact O-N 3.33Å; E370-E374 PolarHBondContact O-N 3.49Å |
| 371 | E | 82.2 | Confident | 90.6 | Very high | 48 Ų | 48 | 60.7 Ų | 60.7 | 22% | 0.224 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -66.3 | -50.4 | 177.4 | -177.8 | 175.6 | -168.6 | 0 | 0 | 109.8 | A12 N13 R14 S15 D369 V373 E374 Q375 | A12-E371 VanDerWaalsContact O-OE1 3.1Å; N13-E371 WeakPolarHBondContact CA-OE1 3.47Å; R14-E371 PolarHBondContact N-OE1 3.46Å; R14-E371 PolarHBondContact N-OE2 2.65Å; S15-E371 WeakPolarHBondContact CB-OE2 3.49Å; S15-E371 PolarHBondContact N-OE2 2.95Å; S15-E371 VanDerWaalsContact N-OE2 3.1Å; S15-E371 PolarHBondContact OG-OE2 2.83Å; D369-E371 VanDerWaalsContact C-N 3.25Å; D369-E371 PolarHBondContact O-N 2.72Å; D369-E371 PolarHBondContact OD1-N 2.96Å; E371-V373 VanDerWaalsContact C-N 3.3Å; E371-V373 PolarHBondContact O-N 3.15Å; E371-E374 PolarHBondContact O-N 2.87Å; E371-Q375 WeakPolarHBondContact O-CG 3.4Å; E371-Q375 PolarHBondContact O-N 2.82Å; E371-Q375 VanDerWaalsContact O-N 3.08Å |
| 372 | A | 83.4 | Confident | 90.5 | Very high | 12 Ų | 12 | 60.9 Ų | 60.9 | 10% | 0.099 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -63.7 | -36.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | H334 A364 D369 E374 Q375 I376 | H334-A372 VanDerWaalsContact CD2-CB 3.48Å; H334-A372 WeakPolarHBondContact CD2-CB 3.34Å; A364-A372 HydrophobicContact CB-CB 4.11Å; D369-A372 HydrophobicContact CB-CB 4.13Å; D369-A372 PolarHBondContact O-N 2.92Å; D369-A372 WeakPolarHBondContact OD1-CB 3.35Å; D369-A372 PolarHBondContact OD1-N 3.2Å; D369-A372 WeakPolarHBondContact OD2-CB 3.43Å; A372-E374 VanDerWaalsContact C-N 3.32Å; A372-E374 PolarHBondContact O-N 2.94Å; A372-Q375 PolarHBondContact O-N 2.74Å; A372-I376 HydrophobicContact CB-CD1 4.4Å; A372-I376 WeakPolarHBondContact O-CB 3.35Å; A372-I376 VanDerWaalsContact O-CD1 3.28Å; A372-I376 WeakPolarHBondContact O-CD1 3.21Å; A372-I376 WeakPolarHBondContact O-CG1 3.36Å; A372-I376 PolarHBondContact O-N 3.02Å |
| 373 | V | 91.3 | Very high | 90.4 | Very high | 2 Ų | 2 | 58.2 Ų | 58.2 | 1% | 0.012 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -57.9 | -44.7 | 174.5 | 164.9 | 0 | 0 | 0 | 0 | 111.5 | L361 A364 Q365 D369 E370 E371 R377 | L361-V373 HydrophobicContact CD1-CB 4.31Å; L361-V373 HydrophobicContact CD1-CG1 3.95Å; L361-V373 HydrophobicContact CD1-CG2 4.21Å; A364-V373 HydrophobicContact CB-CG2 3.74Å; Q365-V373 HydrophobicContact CG-CG2 3.72Å; D369-V373 VanDerWaalsContact O-CG2 3.29Å; D369-V373 WeakPolarHBondContact O-CG2 3.28Å; D369-V373 PolarHBondContact O-N 2.87Å; E370-V373 PolarHBondContact O-N 3.33Å; E371-V373 VanDerWaalsContact C-N 3.3Å; E371-V373 PolarHBondContact O-N 3.15Å; V373-R377 VanDerWaalsContact CG1-CZ 3.47Å; V373-R377 VanDerWaalsContact O-CG 3.26Å; V373-R377 WeakPolarHBondContact O-CG 3.42Å; V373-R377 PolarHBondContact O-N 2.65Å; V373-R377 VanDerWaalsContact O-N 3.13Å |
| 374 | E | 89.3 | Confident | 90.5 | Very high | 116 Ų | 116 | 56.7 Ų | 56.7 | 54% | 0.542 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -62 | -49.2 | 176.5 | -173.3 | 170.4 | -160.7 | 0 | 0 | 110.9 | E370 E371 A372 I376 R377 E378 | E370-E374 PolarHBondContact O-N 3.49Å; E371-E374 PolarHBondContact O-N 2.87Å; A372-E374 VanDerWaalsContact C-N 3.32Å; A372-E374 PolarHBondContact O-N 2.94Å; E374-I376 PolarHBondContact O-N 3.31Å; E374-R377 WeakPolarHBondContact O-CB 3.48Å; E374-R377 PolarHBondContact O-N 3.08Å; E374-R377 VanDerWaalsContact O-N 3.14Å; E374-E378 PolarHBondContact O-N 2.92Å |
| 375 | Q | 82.9 | Confident | 90.7 | Very high | 60 Ų | 60 | 60.3 Ų | 60.3 | 28% | 0.28 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -60.1 | -43.9 | -179.9 | -66.8 | -53.8 | -28 | 0 | 0 | 113.3 | A9 E371 A372 R377 E378 G379 | A9-Q375 HydrophobicContact CB-CG 4.19Å; E371-Q375 WeakPolarHBondContact O-CG 3.4Å; E371-Q375 PolarHBondContact O-N 2.82Å; E371-Q375 VanDerWaalsContact O-N 3.08Å; A372-Q375 PolarHBondContact O-N 2.74Å; Q375-R377 VanDerWaalsContact C-N 3.3Å; Q375-R377 PolarHBondContact O-N 3.41Å; Q375-E378 PolarHBondContact O-N 3.5Å; Q375-G379 PolarHBondContact O-N 3.06Å |
| 376 | I | 91.3 | Very high | 90.6 | Very high | 7 Ų | 7 | 59.2 Ų | 59.2 | 4% | 0.036 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -65 | -36.9 | 178.7 | -68.6 | 160.6 | 0 | 0 | 0 | 110.9 | Y357 A360 L361 A364 A372 E374 G379 L380 | Y357-I376 HydrophobicContact CD1-CB 4.49Å; Y357-I376 HydrophobicContact CD1-CG2 3.91Å; Y357-I376 HydrophobicContact CG-CG2 4.43Å; Y357-I376 VanDerWaalsContact O-CG2 3.23Å; Y357-I376 WeakPolarHBondContact O-CG2 3.45Å; A360-I376 HydrophobicContact CB-CD1 3.7Å; A360-I376 HydrophobicContact CB-CG1 4.23Å; L361-I376 HydrophobicContact CB-CG2 3.74Å; L361-I376 HydrophobicContact CD1-CB 4.38Å; L361-I376 HydrophobicContact CD1-CG2 4.11Å; L361-I376 HydrophobicContact CG-CG2 4.43Å; A364-I376 HydrophobicContact CB-CD1 3.94Å; A372-I376 HydrophobicContact CB-CD1 4.4Å; A372-I376 WeakPolarHBondContact O-CB 3.35Å; A372-I376 VanDerWaalsContact O-CD1 3.28Å; A372-I376 WeakPolarHBondContact O-CD1 3.21Å; A372-I376 WeakPolarHBondContact O-CG1 3.36Å; A372-I376 PolarHBondContact O-N 3.02Å; E374-I376 PolarHBondContact O-N 3.31Å; I376-G379 PolarHBondContact O-N 3.23Å; I376-L380 HydrophobicContact CG2-CD1 4.34Å; I376-L380 WeakPolarHBondContact O-CG 3.44Å; I376-L380 PolarHBondContact O-N 3.12Å |
| 377 | R | 95.3 | Very high | 90.6 | Very high | 138 Ų | 138 | 57.8 Ų | 57.8 | 52% | 0.521 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -66 | -39 | 175.2 | -75.6 | 171.1 | 175.6 | 162.2 | 2.5 | 112 | L361 V373 E374 Q375 L380 K381 | L361-R377 HydrophobicContact CD1-CG 4.31Å; V373-R377 VanDerWaalsContact CG1-CZ 3.47Å; V373-R377 VanDerWaalsContact O-CG 3.26Å; V373-R377 WeakPolarHBondContact O-CG 3.42Å; V373-R377 PolarHBondContact O-N 2.65Å; V373-R377 VanDerWaalsContact O-N 3.13Å; E374-R377 WeakPolarHBondContact O-CB 3.48Å; E374-R377 PolarHBondContact O-N 3.08Å; E374-R377 VanDerWaalsContact O-N 3.14Å; Q375-R377 VanDerWaalsContact C-N 3.3Å; Q375-R377 PolarHBondContact O-N 3.41Å; R377-L380 PolarHBondContact O-N 3.45Å; R377-K381 PolarHBondContact O-N 2.81Å |
| 378 | E | 93.2 | Very high | 90.8 | Very high | 62 Ų | 62 | 61.8 Ų | 61.8 | 29% | 0.29 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -62.5 | -45.4 | 173.2 | -66.8 | -166.3 | 160.8 | 0 | 0 | 111.5 | V6 E374 Q375 L380 K381 E382 | V6-E378 HydrophobicContact CG2-CB 4.33Å; E374-E378 PolarHBondContact O-N 2.92Å; Q375-E378 PolarHBondContact O-N 3.5Å; E378-L380 PolarHBondContact O-N 3.24Å; E378-K381 WeakPolarHBondContact O-CB 3.44Å; E378-K381 PolarHBondContact O-N 3.24Å; E378-K381 VanDerWaalsContact O-N 3.15Å; E378-E382 PolarHBondContact O-N 3.44Å |
| 379 | G | 91.3 | Very high | 90.8 | Very high | 0 Ų | 0 | 61.8 Ų | 61.8 | 0% | 0 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -55.6 | -48.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q375 I376 K381 E382 V383 | Q375-G379 PolarHBondContact O-N 3.06Å; I376-G379 PolarHBondContact O-N 3.23Å; G379-K381 VanDerWaalsContact C-N 3.31Å; G379-K381 PolarHBondContact O-N 2.79Å; G379-E382 PolarHBondContact O-N 3.25Å; G379-E382 VanDerWaalsContact O-N 3.15Å; G379-V383 VanDerWaalsContact O-CG2 3.31Å; G379-V383 WeakPolarHBondContact O-CG2 3.24Å; G379-V383 PolarHBondContact O-N 2.89Å |
| 380 | L | 95.7 | Very high | 91.1 | Very high | 43 Ų | 43 | 65.5 Ų | 65.5 | 23% | 0.225 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -59.3 | -39 | 176.1 | -77.1 | 168.4 | 0 | 0 | 0 | 113.1 | V354 Y357 L361 I376 R377 E378 V383 G384 | V354-L380 HydrophobicContact CG1-CD2 4.39Å; Y357-L380 VanDerWaalsContact CB-CD2 3.46Å; Y357-L380 HydrophobicContact CD2-CD2 4.2Å; Y357-L380 HydrophobicContact CD2-CG 4.36Å; Y357-L380 HydrophobicContact CG-CD2 4.18Å; Y357-L380 HydrophobicContact CG-CG 4.14Å; L361-L380 HydrophobicContact CD2-CD1 4.28Å; I376-L380 HydrophobicContact CG2-CD1 4.34Å; I376-L380 WeakPolarHBondContact O-CG 3.44Å; I376-L380 PolarHBondContact O-N 3.12Å; R377-L380 PolarHBondContact O-N 3.45Å; E378-L380 PolarHBondContact O-N 3.24Å; L380-V383 PolarHBondContact O-N 3.22Å; L380-G384 PolarHBondContact O-N 3.18Å |
| 381 | K | 96.3 | Very high | 91.1 | Very high | 150 Ų | 150 | 64.8 Ų | 64.8 | 65% | 0.652 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -64.4 | -43.7 | 176 | -175.4 | -176.6 | 178.3 | -175.2 | 0 | 110.9 | R377 E378 G379 G384 N385 | R377-K381 PolarHBondContact O-N 2.81Å; E378-K381 WeakPolarHBondContact O-CB 3.44Å; E378-K381 PolarHBondContact O-N 3.24Å; E378-K381 VanDerWaalsContact O-N 3.15Å; G379-K381 VanDerWaalsContact C-N 3.31Å; G379-K381 PolarHBondContact O-N 2.79Å; K381-G384 PolarHBondContact O-N 3.16Å; K381-N385 PolarHBondContact O-N 2.85Å |
| 382 | E | 94.3 | Very high | 91.4 | Very high | 34 Ų | 34 | 65.3 Ų | 65.3 | 16% | 0.159 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -63.1 | -42.4 | 177.4 | -179.9 | 60.8 | -167.5 | 0 | 0 | 111.8 | V6 L345 E378 G379 G384 N385 R386 | V6-E382 HydrophobicContact CG2-CB 4.33Å; L345-E382 HydrophobicContact CD2-CB 4.23Å; L345-E382 HydrophobicContact CD2-CG 3.83Å; E378-E382 PolarHBondContact O-N 3.44Å; G379-E382 PolarHBondContact O-N 3.25Å; G379-E382 VanDerWaalsContact O-N 3.15Å; E382-G384 VanDerWaalsContact C-N 3.26Å; E382-G384 PolarHBondContact O-N 2.76Å; E382-N385 WeakPolarHBondContact O-CB 3.24Å; E382-N385 PolarHBondContact O-N 3.29Å; E382-N385 VanDerWaalsContact O-N 3.09Å; E382-R386 HydrophobicContact CG-CG 4.46Å; E382-R386 PolarHBondContact O-N 3.46Å; E382-R386 WeakPolarHBondContact OE1-CG 3.3Å; E382-R386 IonicContact OE1-CZ 3.7Å; E382-R386 IonicContact OE1-NE 2.87Å; E382-R386 PolarHBondContact OE1-NE 3.35Å; E382-R386 IonicContact OE1-NH2 3.49Å |
| 383 | V | 94.6 | Very high | 91.4 | Very high | 1 Ų | 1 | 71.8 Ų | 71.8 | 1% | 0.006 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -55.9 | -44.2 | 173.6 | -178.3 | 0 | 0 | 0 | 0 | 110.8 | L345 F350 S353 V354 Y357 G379 L380 N385 R386 R387 | L345-V383 HydrophobicContact CB-CG2 4.34Å; L345-V383 HydrophobicContact CD1-CB 4.2Å; L345-V383 HydrophobicContact CD1-CG1 4.5Å; L345-V383 HydrophobicContact CD1-CG2 3.81Å; L345-V383 HydrophobicContact CD2-CG2 3.94Å; L345-V383 HydrophobicContact CG-CG2 4.26Å; F350-V383 HydrophobicContact CB-CG1 4.05Å; F350-V383 HydrophobicContact CD1-CG1 4.39Å; S353-V383 WeakPolarHBondContact OG-CG2 3.24Å; V354-V383 HydrophobicContact CG2-CB 4.33Å; V354-V383 HydrophobicContact CG2-CG1 3.55Å; Y357-V383 HydrophobicContact CD2-CG2 3.93Å; Y357-V383 HydrophobicContact CE2-CG2 3.75Å; G379-V383 VanDerWaalsContact O-CG2 3.31Å; G379-V383 WeakPolarHBondContact O-CG2 3.24Å; G379-V383 PolarHBondContact O-N 2.89Å; L380-V383 PolarHBondContact O-N 3.22Å; V383-N385 VanDerWaalsContact C-N 3.35Å; V383-N385 PolarHBondContact O-N 3.4Å; V383-R386 PolarHBondContact O-N 2.97Å; V383-R387 HydrophobicContact CG1-CG 4.34Å; V383-R387 WeakPolarHBondContact O-CB 3.47Å; V383-R387 VanDerWaalsContact O-CG 3.27Å; V383-R387 WeakPolarHBondContact O-CG 3.03Å; V383-R387 PolarHBondContact O-N 3.18Å |
| 384 | G | 93.9 | Very high | 91.1 | Very high | 29 Ų | 29 | 76.8 Ų | 76.8 | 30% | 0.299 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -60.5 | -41.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | L380 K381 E382 K388 | L380-G384 PolarHBondContact O-N 3.18Å; K381-G384 PolarHBondContact O-N 3.16Å; E382-G384 VanDerWaalsContact C-N 3.26Å; E382-G384 PolarHBondContact O-N 2.76Å; G384-K388 WeakPolarHBondContact O-CG 3.39Å; G384-K388 PolarHBondContact O-N 3.35Å |
| 385 | N | 93.8 | Very high | 90.7 | Very high | 76 Ų | 76 | 78.5 Ų | 78.5 | 41% | 0.406 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -66 | -48.6 | 177.4 | -65.7 | -21.8 | 0 | 0 | 0 | 111.6 | K381 E382 V383 R387 K388 A389 | K381-N385 PolarHBondContact O-N 2.85Å; E382-N385 WeakPolarHBondContact O-CB 3.24Å; E382-N385 PolarHBondContact O-N 3.29Å; E382-N385 VanDerWaalsContact O-N 3.09Å; V383-N385 VanDerWaalsContact C-N 3.35Å; V383-N385 PolarHBondContact O-N 3.4Å; N385-R387 VanDerWaalsContact C-N 3.34Å; N385-R387 PolarHBondContact O-N 3.13Å; N385-K388 PolarHBondContact O-N 3.17Å; N385-K388 VanDerWaalsContact O-N 3.17Å; N385-A389 PolarHBondContact O-N 3.45Å |
| 386 | R | 92.9 | Very high | 90.1 | Very high | 80 Ų | 80 | 78.4 Ų | 78.4 | 30% | 0.302 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -65 | -35.9 | 179.7 | -66 | -154.6 | -175.4 | -174.8 | 5 | 113 | L345 H346 F350 E382 V383 K388 A389 K390 | L345-R386 HydrophobicContact CD1-CB 4.32Å; L345-R386 HydrophobicContact CD1-CG 4.29Å; H346-R386 PolarHBondContact CD2-NH1 3.48Å; F350-R386 HydrophobicContact CE1-CB 3.73Å; F350-R386 HydrophobicContact CZ-CB 3.8Å; E382-R386 HydrophobicContact CG-CG 4.46Å; E382-R386 PolarHBondContact O-N 3.46Å; E382-R386 WeakPolarHBondContact OE1-CG 3.3Å; E382-R386 IonicContact OE1-CZ 3.7Å; E382-R386 IonicContact OE1-NE 2.87Å; E382-R386 PolarHBondContact OE1-NE 3.35Å; E382-R386 IonicContact OE1-NH2 3.49Å; V383-R386 PolarHBondContact O-N 2.97Å; R386-K388 VanDerWaalsContact C-N 3.35Å; R386-K388 PolarHBondContact O-N 3.25Å; R386-A389 PolarHBondContact O-N 2.73Å; R386-K390 WeakPolarHBondContact O-CB 3.38Å; R386-K390 PolarHBondContact O-N 2.68Å |
| 387 | R | 92.5 | Very high | 88.6 | Confident | 76 Ų | 76 | 83.4 Ų | 83.4 | 29% | 0.287 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -60.9 | -41.9 | 172.6 | -76.7 | 177.6 | 70.9 | 162.6 | 3.5 | 112.3 | F350 E351 V383 N385 K391 | F350-R387 HydrophobicContact CB-CG 3.68Å; F350-R387 HydrophobicContact CD1-CG 4.45Å; F350-R387 HydrophobicContact CD2-CG 3.57Å; F350-R387 HydrophobicContact CE2-CG 4.27Å; F350-R387 HydrophobicContact CG-CG 3.66Å; E351-R387 IonicContact OE1-CZ 2.97Å; E351-R387 IonicContact OE1-NE 3.71Å; E351-R387 IonicContact OE1-NH1 3.64Å; E351-R387 PolarHBondContact OE1-NH1 3.14Å; E351-R387 IonicContact OE1-NH2 2.63Å; E351-R387 PolarHBondContact OE1-NH2 3.45Å; E351-R387 IonicContact OE2-CZ 3.63Å; E351-R387 IonicContact OE2-NH1 3.22Å; E351-R387 PolarHBondContact OE2-NH1 2.88Å; E351-R387 IonicContact OE2-NH2 3.7Å; V383-R387 HydrophobicContact CG1-CG 4.34Å; V383-R387 WeakPolarHBondContact O-CB 3.47Å; V383-R387 VanDerWaalsContact O-CG 3.27Å; V383-R387 WeakPolarHBondContact O-CG 3.03Å; V383-R387 PolarHBondContact O-N 3.18Å; N385-R387 VanDerWaalsContact C-N 3.34Å; N385-R387 PolarHBondContact O-N 3.13Å; R387-K391 WeakPolarHBondContact O-CG 3.39Å; R387-K391 PolarHBondContact O-N 3.04Å; R387-K391 VanDerWaalsContact O-N 3.15Å |
| 388 | K | 91.8 | Very high | 87 | Confident | 151 Ų | 151 | 86.6 Ų | 86.6 | 66% | 0.657 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -67.3 | -43.6 | 177.2 | -71.6 | 174.1 | -177.4 | 178.9 | 0 | 111.5 | G384 N385 R386 K391 A392 | G384-K388 WeakPolarHBondContact O-CG 3.39Å; G384-K388 PolarHBondContact O-N 3.35Å; N385-K388 PolarHBondContact O-N 3.17Å; N385-K388 VanDerWaalsContact O-N 3.17Å; R386-K388 VanDerWaalsContact C-N 3.35Å; R386-K388 PolarHBondContact O-N 3.25Å; K388-K391 PolarHBondContact O-N 3.44Å; K388-A392 PolarHBondContact O-N 3.29Å |
| 389 | A | 90.1 | Very high | 85.2 | Confident | 50 Ų | 50 | 89.3 Ų | 89.3 | 41% | 0.413 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -58.9 | -48.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | N385 R386 K391 A392 E393 | N385-A389 PolarHBondContact O-N 3.45Å; R386-A389 PolarHBondContact O-N 2.73Å; A389-K391 VanDerWaalsContact C-N 3.31Å; A389-K391 PolarHBondContact O-N 2.7Å; A389-A392 PolarHBondContact O-N 3.18Å; A389-A392 VanDerWaalsContact O-N 3.15Å; A389-E393 WeakPolarHBondContact O-CG 3.35Å; A389-E393 PolarHBondContact O-N 3.33Å |
| 390 | K | 89.3 | Confident | 83.2 | Confident | 107 Ų | 107 | 97.8 Ų | 97.8 | 47% | 0.465 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.5 | -38.5 | 177.6 | -171.2 | 173.6 | -175.9 | 173.1 | 0 | 112.8 | F350 R386 E393 T394 | F350-K390 HydrophobicContact CD2-CD 4.45Å; F350-K390 HydrophobicContact CE2-CB 4.2Å; F350-K390 HydrophobicContact CE2-CD 3.6Å; F350-K390 HydrophobicContact CZ-CD 4.4Å; R386-K390 WeakPolarHBondContact O-CB 3.38Å; R386-K390 PolarHBondContact O-N 2.68Å; K390-E393 PolarHBondContact O-N 3.19Å; K390-T394 WeakPolarHBondContact O-CG2 3.19Å; K390-T394 PolarHBondContact O-N 2.78Å; K390-T394 VanDerWaalsContact O-N 3.08Å; K390-T394 PolarHBondContact O-OG1 3.36Å |
| 391 | K | 88.1 | Confident | 81 | Confident | 118 Ų | 118 | 102 Ų | 102 | 51% | 0.513 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.4 | -45.7 | 174.6 | -75.6 | -177.5 | 178.9 | -167.8 | 0 | 112 | R387 K388 A389 E393 T394 E395 | R387-K391 WeakPolarHBondContact O-CG 3.39Å; R387-K391 PolarHBondContact O-N 3.04Å; R387-K391 VanDerWaalsContact O-N 3.15Å; K388-K391 PolarHBondContact O-N 3.44Å; A389-K391 VanDerWaalsContact C-N 3.31Å; A389-K391 PolarHBondContact O-N 2.7Å; K391-E393 VanDerWaalsContact C-N 3.3Å; K391-E393 PolarHBondContact O-N 3.5Å; K391-T394 WeakPolarHBondContact CA-OG1 3.41Å; K391-T394 PolarHBondContact O-N 3.25Å; K391-T394 VanDerWaalsContact O-N 3.16Å; K391-T394 PolarHBondContact O-OG1 3.12Å; K391-E395 WeakPolarHBondContact O-CB 3.44Å; K391-E395 WeakPolarHBondContact O-CG 3.45Å; K391-E395 PolarHBondContact O-N 3.31Å |
| 392 | A | 87.9 | Confident | 78.9 | Confident | 60 Ų | 60 | 105.6 Ų | 105.6 | 50% | 0.496 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -62 | -37.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | K388 A389 E395 A396 | K388-A392 PolarHBondContact O-N 3.29Å; A389-A392 PolarHBondContact O-N 3.18Å; A389-A392 VanDerWaalsContact O-N 3.15Å; A392-E395 PolarHBondContact O-N 2.82Å; A392-A396 PolarHBondContact O-N 3.42Å; A392-A396 VanDerWaalsContact O-N 3.07Å |
| 393 | E | 84.1 | Confident | 78.1 | Confident | 148 Ų | 148 | 109.2 Ų | 109.2 | 69% | 0.692 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -64.9 | -40.6 | 173 | -73.1 | 171.4 | -174.4 | 0 | 0 | 112.4 | A389 K390 K391 E395 | A389-E393 WeakPolarHBondContact O-CG 3.35Å; A389-E393 PolarHBondContact O-N 3.33Å; K390-E393 PolarHBondContact O-N 3.19Å; K391-E393 VanDerWaalsContact C-N 3.3Å; K391-E393 PolarHBondContact O-N 3.5Å; E393-E395 VanDerWaalsContact C-N 3.35Å |
| 394 | T | 84.1 | Confident | 77.3 | Confident | 107 Ų | 107 | 114.8 Ų | 114.8 | 66% | 0.656 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -73.8 | -24.6 | 178.1 | 51.5 | 0 | 0 | 0 | 0 | 114 | K390 K391 | K390-T394 WeakPolarHBondContact O-CG2 3.19Å; K390-T394 PolarHBondContact O-N 2.78Å; K390-T394 VanDerWaalsContact O-N 3.08Å; K390-T394 PolarHBondContact O-OG1 3.36Å; K391-T394 WeakPolarHBondContact CA-OG1 3.41Å; K391-T394 PolarHBondContact O-N 3.25Å; K391-T394 VanDerWaalsContact O-N 3.16Å; K391-T394 PolarHBondContact O-OG1 3.12Å |
| 395 | E | 80.4 | Confident | 76.4 | Confident | 151 Ų | 151 | 119.6 Ų | 119.6 | 71% | 0.706 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -94.7 | -6.8 | -179.7 | -69.6 | 171.7 | -170.1 | 0 | 0 | 112.8 | K391 A392 E393 | K391-E395 WeakPolarHBondContact O-CB 3.44Å; K391-E395 WeakPolarHBondContact O-CG 3.45Å; K391-E395 PolarHBondContact O-N 3.31Å; A392-E395 PolarHBondContact O-N 2.82Å; E393-E395 VanDerWaalsContact C-N 3.35Å |
| 396 | A | 70.3 | Confident | 75.3 | Confident | 58 Ų | 58 | 122.2 Ų | 122.2 | 48% | 0.479 | 64% | 0.639 | S | S | . | * | S | Bend | trans | -66 | 130.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | A392 K398 | A392-A396 PolarHBondContact O-N 3.42Å; A392-A396 VanDerWaalsContact O-N 3.07Å; A396-K398 PolarHBondContact O-N 2.95Å |
| 397 | P | 60.9 | Low | 74.2 | Confident | 113 Ų | 113 | 124.8 Ų | 124.8 | 73% | 0.734 | 66% | 0.66 | S | S | * | * | trans | -61.2 | 128.2 | 178.4 | 16.2 | -18.9 | 0 | 0 | 0 | 109 | T399 | P397-T399 VanDerWaalsContact C-N 3.33Å; P397-T399 PolarHBondContact O-N 3.06Å | ||
| 398 | K | 61 | Low | 73 | Confident | 205 Ų | 205 | 128.1 Ų | 128.1 | 89% | 0.891 | 69% | 0.685 | S | S | * | * | trans | -59 | 101.8 | 167.2 | -68.5 | -178.9 | -179.8 | -179.5 | 0 | 106.4 | A396 E400 | A396-K398 PolarHBondContact O-N 2.95Å; K398-E400 VanDerWaalsContact C-N 3.35Å; K398-E400 PolarHBondContact O-N 3.43Å | ||
| 399 | T | 54.8 | Low | 71.7 | Confident | 119 Ų | 119 | 126.4 Ų | 126.4 | 73% | 0.73 | 69% | 0.687 | S | S | * | * | trans | -63.5 | 104.2 | 167.6 | 44.3 | 0 | 0 | 0 | 0 | 106.3 | P397 T401 | P397-T399 VanDerWaalsContact C-N 3.33Å; P397-T399 PolarHBondContact O-N 3.06Å; T399-T401 PolarHBondContact O-N 3.47Å | ||
| 400 | E | 49.9 | Very low | 70.3 | Confident | 177 Ų | 177 | 132.3 Ų | 132.3 | 83% | 0.827 | 71% | 0.708 | S | S | * | * | trans | -53 | 103.2 | 163.5 | -74 | 171 | 160.4 | 0 | 0 | 107 | K398 | K398-E400 VanDerWaalsContact C-N 3.35Å; K398-E400 PolarHBondContact O-N 3.43Å | ||
| 401 | T | 50.8 | Low | 68.7 | Low | 133 Ų | 133 | 134.4 Ų | 134.4 | 82% | 0.816 | 73% | 0.728 | S | S | * | * | trans | -90 | 94.4 | 158.6 | 50.3 | 0 | 0 | 0 | 0 | 106 | T399 | T399-T401 PolarHBondContact O-N 3.47Š| ||
| 402 | D | 51.6 | Low | 66.9 | Low | 224 Ų | 224 | 135.9 Ų | 135.9 | 100% | 1.198 | 75% | 0.748 | S | S | * | * | trans | -62 | 0 | 162.1 | -86.5 | -23.6 | 0 | 0 | 0 | 111.8 |
Retrieved 402 of 402 residues in 83.5 ms
(Link to these results)