| 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 | 54.4 | Low | 67.9 | Low | 207 Ų | 207 | 116.7 Ų | 116.7 | 100% | 1.02 | 63% | 0.632 | S | S | * | * | 0 | -47 | 0 | -83.1 | -154.7 | -84.6 | 0 | 0 | 113.5 | V3 A4 L5 | M1-V3 PolarHBondContact O-N 3.12Å; M1-A4 PolarHBondContact O-N 2.98Å; M1-L5 PolarHBondContact O-N 2.8Å; M1-L5 VanDerWaalsContact O-N 3.13Å | |||
| 2 | A | 57 | Low | 68.4 | Low | 71 Ų | 71 | 112.4 Ų | 112.4 | 59% | 0.587 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -57 | -42.8 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | A4 L5 D6 | A2-A4 VanDerWaalsContact C-N 3.31Å; A2-A4 PolarHBondContact O-N 3.32Å; A2-L5 PolarHBondContact O-N 3.18Å; A2-D6 PolarHBondContact O-N 3.37Å |
| 3 | V | 62.5 | Low | 68.9 | Low | 123 Ų | 123 | 112.7 Ų | 112.7 | 75% | 0.745 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -66.3 | -31.4 | 178.6 | -178.5 | 0 | 0 | 0 | 0 | 112.8 | M1 A7 | M1-V3 PolarHBondContact O-N 3.12Å; V3-A7 WeakPolarHBondContact O-CB 3.28Å; V3-A7 PolarHBondContact O-N 3.16Å; V3-A7 VanDerWaalsContact O-N 3.08Å |
| 4 | A | 63.4 | Low | 69 | Low | 62 Ų | 62 | 110.7 Ų | 110.7 | 51% | 0.512 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -73.7 | -37.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | M1 A2 A7 V8 | M1-A4 PolarHBondContact O-N 2.98Å; A2-A4 VanDerWaalsContact C-N 3.31Å; A2-A4 PolarHBondContact O-N 3.32Å; A4-A7 PolarHBondContact O-N 3.08Å; A4-V8 WeakPolarHBondContact O-CB 3.37Å; A4-V8 WeakPolarHBondContact O-CG2 3.49Å; A4-V8 PolarHBondContact O-N 3.43Å |
| 5 | L | 67.3 | Low | 68.8 | Low | 120 Ų | 120 | 108.2 Ų | 108.2 | 63% | 0.628 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -65.7 | -41.4 | 174.5 | -82.6 | 159.2 | 0 | 0 | 0 | 112 | M1 A2 V8 W9 | M1-L5 PolarHBondContact O-N 2.8Å; M1-L5 VanDerWaalsContact O-N 3.13Å; A2-L5 PolarHBondContact O-N 3.18Å; L5-V8 PolarHBondContact O-N 3.39Å; L5-W9 VanDerWaalsContact O-CB 3.28Å; L5-W9 WeakPolarHBondContact O-CB 3.26Å; L5-W9 PolarHBondContact O-N 2.96Å |
| 6 | D | 71.2 | Confident | 68.7 | Low | 110 Ų | 110 | 106.9 Ų | 106.9 | 59% | 0.588 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -66.8 | -40.7 | 175.7 | -83.8 | -19.1 | 0 | 0 | 0 | 112.3 | A2 V8 W9 V10 | A2-D6 PolarHBondContact O-N 3.37Å; D6-V8 VanDerWaalsContact C-N 3.34Å; D6-V8 PolarHBondContact O-N 3.42Å; D6-W9 PolarHBondContact O-N 3.47Å; D6-V10 WeakPolarHBondContact O-CB 3.33Å; D6-V10 VanDerWaalsContact O-CG2 3.26Å; D6-V10 WeakPolarHBondContact O-CG2 3.46Å; D6-V10 PolarHBondContact O-N 3.41Å |
| 7 | A | 68.3 | Low | 68.6 | Low | 58 Ų | 58 | 110.1 Ų | 110.1 | 48% | 0.479 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -65 | -38.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | V3 A4 R11 | V3-A7 WeakPolarHBondContact O-CB 3.28Å; V3-A7 PolarHBondContact O-N 3.16Å; V3-A7 VanDerWaalsContact O-N 3.08Å; A4-A7 PolarHBondContact O-N 3.08Å; A7-R11 WeakPolarHBondContact O-CB 3.5Å; A7-R11 PolarHBondContact O-N 3.46Å |
| 8 | V | 74.3 | Confident | 67.9 | Low | 84 Ų | 84 | 112.8 Ų | 112.8 | 51% | 0.509 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -66.2 | -43.8 | 172.8 | 169.6 | 0 | 0 | 0 | 0 | 110.4 | A4 L5 D6 V10 R11 V12 | A4-V8 WeakPolarHBondContact O-CB 3.37Å; A4-V8 WeakPolarHBondContact O-CG2 3.49Å; A4-V8 PolarHBondContact O-N 3.43Å; L5-V8 PolarHBondContact O-N 3.39Å; D6-V8 VanDerWaalsContact C-N 3.34Å; D6-V8 PolarHBondContact O-N 3.42Å; V8-V10 PolarHBondContact O-N 3.32Å; V8-R11 WeakPolarHBondContact O-CB 3.43Å; V8-R11 PolarHBondContact O-N 3.49Å; V8-V12 HydrophobicContact CG1-CG2 4.19Å; V8-V12 WeakPolarHBondContact O-CB 3.46Å; V8-V12 VanDerWaalsContact O-CG2 3.22Å; V8-V12 WeakPolarHBondContact O-CG2 2.88Å; V8-V12 PolarHBondContact O-N 3.23Å |
| 9 | W | 78.4 | Confident | 67.7 | Low | 174 Ų | 174 | 109.6 Ų | 109.6 | 66% | 0.659 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -64.6 | -40.7 | 179.1 | -172.2 | -108.5 | 0 | 0 | 0 | 112.5 | L5 D6 V12 K13 | L5-W9 VanDerWaalsContact O-CB 3.28Å; L5-W9 WeakPolarHBondContact O-CB 3.26Å; L5-W9 PolarHBondContact O-N 2.96Å; D6-W9 PolarHBondContact O-N 3.47Å; W9-V12 PolarHBondContact O-N 2.81Å; W9-K13 VanDerWaalsContact O-CB 3.27Å; W9-K13 WeakPolarHBondContact O-CB 3.21Å; W9-K13 PolarHBondContact O-N 3.14Å |
| 10 | V | 78.1 | Confident | 67.7 | Low | 81 Ų | 81 | 105.5 Ų | 105.5 | 49% | 0.491 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -65.3 | -41.2 | 174.1 | 171.8 | 0 | 0 | 0 | 0 | 111 | D6 V8 K13 N14 | D6-V10 WeakPolarHBondContact O-CB 3.33Å; D6-V10 VanDerWaalsContact O-CG2 3.26Å; D6-V10 WeakPolarHBondContact O-CG2 3.46Å; D6-V10 PolarHBondContact O-N 3.41Å; V8-V10 PolarHBondContact O-N 3.32Å; V10-K13 PolarHBondContact O-N 3.28Å; V10-N14 WeakPolarHBondContact O-CB 3.49Å; V10-N14 VanDerWaalsContact O-CG 3.31Å; V10-N14 PolarHBondContact O-N 3.17Å |
| 11 | R | 72.4 | Confident | 67.3 | Low | 194 Ų | 194 | 103 Ų | 103 | 73% | 0.732 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -61.4 | -47.9 | 172.2 | -95.5 | -178.8 | -178.8 | 169.1 | 1.7 | 111.9 | A7 V8 K13 N14 V15 | A7-R11 WeakPolarHBondContact O-CB 3.5Å; A7-R11 PolarHBondContact O-N 3.46Å; V8-R11 WeakPolarHBondContact O-CB 3.43Å; V8-R11 PolarHBondContact O-N 3.49Å; R11-K13 PolarHBondContact O-N 3.44Å; R11-N14 PolarHBondContact O-N 3.27Å; R11-V15 VanDerWaalsContact O-CG2 3.27Å; R11-V15 WeakPolarHBondContact O-CG2 3.36Å; R11-V15 PolarHBondContact O-N 3.42Å |
| 12 | V | 73.1 | Confident | 67.5 | Low | 65 Ų | 65 | 95.4 Ų | 95.4 | 39% | 0.394 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.1 | -45.3 | 178.6 | 167.2 | 0 | 0 | 0 | 0 | 110.6 | V8 W9 N14 V15 L16 | V8-V12 HydrophobicContact CG1-CG2 4.19Å; V8-V12 WeakPolarHBondContact O-CB 3.46Å; V8-V12 VanDerWaalsContact O-CG2 3.22Å; V8-V12 WeakPolarHBondContact O-CG2 2.88Å; V8-V12 PolarHBondContact O-N 3.23Å; W9-V12 PolarHBondContact O-N 2.81Å; V12-N14 VanDerWaalsContact C-N 3.34Å; V12-N14 PolarHBondContact O-N 3.26Å; V12-V15 PolarHBondContact O-N 2.94Å; V12-L16 HydrophobicContact CG1-CD1 3.68Å; V12-L16 WeakPolarHBondContact O-CB 3.38Å; V12-L16 PolarHBondContact O-N 3Å |
| 13 | K | 75.9 | Confident | 68.1 | Low | 116 Ų | 116 | 94.9 Ų | 94.9 | 50% | 0.504 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.9 | -37.9 | 176.7 | -169.9 | 174.6 | -177.2 | 175.6 | 0 | 112.6 | W9 V10 R11 K17 | W9-K13 VanDerWaalsContact O-CB 3.27Å; W9-K13 WeakPolarHBondContact O-CB 3.21Å; W9-K13 PolarHBondContact O-N 3.14Å; V10-K13 PolarHBondContact O-N 3.28Å; R11-K13 PolarHBondContact O-N 3.44Å; K13-K17 WeakPolarHBondContact O-CG 3.17Å; K13-K17 PolarHBondContact O-N 3.13Å |
| 14 | N | 70.3 | Confident | 68.7 | Low | 85 Ų | 85 | 92.8 Ų | 92.8 | 46% | 0.455 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -69.5 | -40.6 | 175.3 | -75.7 | -14 | 0 | 0 | 0 | 111.8 | V10 R11 V12 K17 Q18 | V10-N14 WeakPolarHBondContact O-CB 3.49Å; V10-N14 VanDerWaalsContact O-CG 3.31Å; V10-N14 PolarHBondContact O-N 3.17Å; R11-N14 PolarHBondContact O-N 3.27Å; V12-N14 VanDerWaalsContact C-N 3.34Å; V12-N14 PolarHBondContact O-N 3.26Å; N14-K17 PolarHBondContact O-N 3.23Å; N14-Q18 WeakPolarHBondContact O-CG 3.42Å; N14-Q18 PolarHBondContact O-N 3.37Å |
| 15 | V | 65.3 | Low | 68.8 | Low | 73 Ų | 73 | 90.4 Ų | 90.4 | 44% | 0.442 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -63.2 | -42.9 | 174.1 | 171.7 | 0 | 0 | 0 | 0 | 111.1 | R11 V12 K17 Q18 N19 I23 | R11-V15 VanDerWaalsContact O-CG2 3.27Å; R11-V15 WeakPolarHBondContact O-CG2 3.36Å; R11-V15 PolarHBondContact O-N 3.42Å; V12-V15 PolarHBondContact O-N 2.94Å; V15-K17 VanDerWaalsContact C-N 3.35Å; V15-K17 PolarHBondContact O-N 3.49Å; V15-Q18 PolarHBondContact O-N 3.12Å; V15-N19 WeakPolarHBondContact O-CB 3.15Å; V15-N19 PolarHBondContact O-N 2.88Å; V15-N19 PolarHBondContact O-ND2 3.48Å; V15-I23 HydrophobicContact CG1-CD1 4.44Å |
| 16 | L | 67.1 | Low | 68.9 | Low | 88 Ų | 88 | 86.7 Ų | 86.7 | 46% | 0.461 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -62.6 | -37.2 | 174.9 | -94.7 | 143.7 | 0 | 0 | 0 | 112.8 | V12 G20 I23 | V12-L16 HydrophobicContact CG1-CD1 3.68Å; V12-L16 WeakPolarHBondContact O-CB 3.38Å; V12-L16 PolarHBondContact O-N 3Å; L16-G20 WeakPolarHBondContact O-CA 3.49Å; L16-G20 PolarHBondContact O-N 2.99Å; L16-I23 HydrophobicContact CD2-CD1 4.36Å; L16-I23 HydrophobicContact CG-CD1 4.21Å |
| 17 | K | 66.9 | Low | 69.4 | Low | 161 Ų | 161 | 85.8 Ų | 85.8 | 70% | 0.7 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -71.4 | -36.1 | 175.8 | -80.6 | -174 | 172.7 | -169 | 0 | 113 | K13 N14 V15 | K13-K17 WeakPolarHBondContact O-CG 3.17Å; K13-K17 PolarHBondContact O-N 3.13Å; N14-K17 PolarHBondContact O-N 3.23Å; V15-K17 VanDerWaalsContact C-N 3.35Å; V15-K17 PolarHBondContact O-N 3.49Å |
| 18 | Q | 56.1 | Low | 69.9 | Low | 158 Ų | 158 | 83.2 Ų | 83.2 | 74% | 0.738 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -82 | -33.5 | -177.9 | -73 | 179 | -14.3 | 0 | 0 | 113 | N14 V15 | N14-Q18 WeakPolarHBondContact O-CG 3.42Å; N14-Q18 PolarHBondContact O-N 3.37Å; V15-Q18 PolarHBondContact O-N 3.12Å |
| 19 | N | 63.8 | Low | 69.8 | Low | 52 Ų | 52 | 79.9 Ų | 79.9 | 28% | 0.278 | 40% | 0.396 | S | S | . | . | S | Bend | trans | -118.6 | 25.1 | -175.9 | -57.4 | -64.5 | 0 | 0 | 0 | 112.4 | V15 L21 L22 I23 | V15-N19 WeakPolarHBondContact O-CB 3.15Å; V15-N19 PolarHBondContact O-N 2.88Å; V15-N19 PolarHBondContact O-ND2 3.48Å; N19-L21 PolarHBondContact O-N 2.93Å; N19-L22 HydrophobicContact CB-CB 4.38Å; N19-L22 WeakPolarHBondContact O-CB 3.26Å; N19-L22 PolarHBondContact O-N 3.37Å; N19-I23 HydrophobicContact CB-CD1 4.17Å; N19-I23 HydrophobicContact CB-CG1 4.4Å; N19-I23 WeakPolarHBondContact O-CG1 3.48Å; N19-I23 PolarHBondContact O-N 3.48Å |
| 20 | G | 67.6 | Low | 70 | Confident | 27 Ų | 27 | 75.1 Ų | 75.1 | 28% | 0.278 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -58.5 | -47.6 | -170.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | L16 L22 I23 L24 | L16-G20 WeakPolarHBondContact O-CA 3.49Å; L16-G20 PolarHBondContact O-N 2.99Å; G20-L22 VanDerWaalsContact C-N 3.31Å; G20-L22 PolarHBondContact O-N 3.42Å; G20-I23 PolarHBondContact O-N 2.86Å; G20-L24 VanDerWaalsContact O-CB 3.27Å; G20-L24 WeakPolarHBondContact O-CB 3.44Å; G20-L24 PolarHBondContact O-N 3.23Å |
| 21 | L | 61.1 | Low | 70.5 | Confident | 53 Ų | 53 | 75 Ų | 75 | 28% | 0.277 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -59.3 | -44.1 | 177.8 | -178.2 | 71.8 | 0 | 0 | 0 | 111.5 | N19 L24 S25 I270 P274 | N19-L21 PolarHBondContact O-N 2.93Å; L21-L24 PolarHBondContact O-N 3.16Å; L21-S25 PolarHBondContact O-N 2.67Å; L21-S25 PolarHBondContact O-OG 3.05Å; L21-S25 VanDerWaalsContact O-OG 3.06Å; L21-I270 HydrophobicContact CD1-CG2 3.96Å; L21-I270 HydrophobicContact CD2-CG2 3.3Å; L21-I270 HydrophobicContact CG-CG2 4.21Å; L21-P274 HydrophobicContact CD1-CG 4.03Å |
| 22 | L | 57.2 | Low | 71.1 | Confident | 48 Ų | 48 | 65.7 Ų | 65.7 | 25% | 0.251 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -62 | -49.9 | 179.3 | 177.5 | 155.2 | 0 | 0 | 0 | 112.1 | N19 G20 L24 S25 V26 A345 | N19-L22 HydrophobicContact CB-CB 4.38Å; N19-L22 WeakPolarHBondContact O-CB 3.26Å; N19-L22 PolarHBondContact O-N 3.37Å; G20-L22 VanDerWaalsContact C-N 3.31Å; G20-L22 PolarHBondContact O-N 3.42Å; L22-L24 VanDerWaalsContact C-N 3.26Å; L22-L24 PolarHBondContact O-N 2.92Å; L22-S25 PolarHBondContact O-N 3.41Å; L22-V26 WeakPolarHBondContact O-CG2 3.15Å; L22-V26 PolarHBondContact O-N 2.84Å; L22-A345 VanDerWaalsContact CD1-O 3.23Å; L22-A345 WeakPolarHBondContact CD1-O 3.45Å |
| 23 | I | 70.1 | Confident | 71.6 | Confident | 60 Ų | 60 | 64.5 Ų | 64.5 | 31% | 0.308 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -61.7 | -41.2 | 178.8 | -67 | 164.7 | 0 | 0 | 0 | 109.7 | V15 L16 N19 G20 V26 L27 | V15-I23 HydrophobicContact CG1-CD1 4.44Å; L16-I23 HydrophobicContact CD2-CD1 4.36Å; L16-I23 HydrophobicContact CG-CD1 4.21Å; N19-I23 HydrophobicContact CB-CD1 4.17Å; N19-I23 HydrophobicContact CB-CG1 4.4Å; N19-I23 WeakPolarHBondContact O-CG1 3.48Å; N19-I23 PolarHBondContact O-N 3.48Å; G20-I23 PolarHBondContact O-N 2.86Å; I23-V26 PolarHBondContact O-N 3.14Å; I23-L27 VanDerWaalsContact O-CB 3.3Å; I23-L27 WeakPolarHBondContact O-CB 3.31Å; I23-L27 PolarHBondContact O-N 3.03Å |
| 24 | L | 75.5 | Confident | 72.2 | Confident | 80 Ų | 80 | 64.6 Ų | 64.6 | 42% | 0.419 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -64.6 | -40.6 | 178.6 | -167.7 | 64.9 | 0 | 0 | 0 | 111.8 | G20 L21 L22 L27 A28 P274 | G20-L24 VanDerWaalsContact O-CB 3.27Å; G20-L24 WeakPolarHBondContact O-CB 3.44Å; G20-L24 PolarHBondContact O-N 3.23Å; L21-L24 PolarHBondContact O-N 3.16Å; L22-L24 VanDerWaalsContact C-N 3.26Å; L22-L24 PolarHBondContact O-N 2.92Å; L24-L27 PolarHBondContact O-N 3.46Å; L24-A28 WeakPolarHBondContact O-CB 3.25Å; L24-A28 PolarHBondContact O-N 3.46Å; L24-P274 HydrophobicContact CB-CB 4.21Å; L24-P274 HydrophobicContact CB-CG 4.24Å; L24-P274 HydrophobicContact CD2-CB 3.79Å; L24-P274 HydrophobicContact CD2-CG 3.79Å; L24-P274 HydrophobicContact CG-CB 3.56Å; L24-P274 HydrophobicContact CG-CG 3.93Å |
| 25 | S | 64.9 | Low | 73.2 | Confident | 11 Ų | 11 | 63.1 Ų | 63.1 | 8% | 0.077 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -65.1 | -42.6 | 175.4 | -61.7 | 0 | 0 | 0 | 0 | 112.8 | L21 L22 A28 V29 | L21-S25 PolarHBondContact O-N 2.67Å; L21-S25 PolarHBondContact O-OG 3.05Å; L21-S25 VanDerWaalsContact O-OG 3.06Å; L22-S25 PolarHBondContact O-N 3.41Å; S25-A28 WeakPolarHBondContact O-CB 3.49Å; S25-A28 PolarHBondContact O-N 2.91Å; S25-V29 WeakPolarHBondContact O-CG2 3.31Å; S25-V29 PolarHBondContact O-N 3.11Å |
| 26 | V | 69.8 | Low | 74.2 | Confident | 43 Ų | 43 | 59.7 Ų | 59.7 | 26% | 0.261 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -63.8 | -47 | 176.6 | 176.4 | 0 | 0 | 0 | 0 | 110.5 | L22 I23 A28 V29 V30 W457 | L22-V26 WeakPolarHBondContact O-CG2 3.15Å; L22-V26 PolarHBondContact O-N 2.84Å; I23-V26 PolarHBondContact O-N 3.14Å; V26-A28 VanDerWaalsContact C-N 3.27Å; V26-A28 PolarHBondContact O-N 3.34Å; V26-V29 PolarHBondContact O-N 3.03Å; V26-V30 WeakPolarHBondContact O-CG2 3.3Å; V26-V30 PolarHBondContact O-N 2.99Å; V26-W457 HydrophobicContact CB-CH2 4.44Å; V26-W457 HydrophobicContact CG1-CH2 4.22Å; V26-W457 HydrophobicContact CG1-CZ2 4.37Å; V26-W457 HydrophobicContact CG2-CD2 4.21Å; V26-W457 HydrophobicContact CG2-CE3 3.65Å; V26-W457 HydrophobicContact CG2-CH2 3.45Å; V26-W457 VanDerWaalsContact CG2-CH2 3.45Å; V26-W457 HydrophobicContact CG2-CZ2 4Å; V26-W457 HydrophobicContact CG2-CZ3 3.26Å |
| 27 | L | 80.8 | Confident | 75.1 | Confident | 90 Ų | 90 | 60.5 Ų | 60.5 | 47% | 0.471 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -60.6 | -40.3 | 177.1 | -174.7 | 65.7 | 0 | 0 | 0 | 111 | I23 L24 V30 I31 | I23-L27 VanDerWaalsContact O-CB 3.3Å; I23-L27 WeakPolarHBondContact O-CB 3.31Å; I23-L27 PolarHBondContact O-N 3.03Å; L24-L27 PolarHBondContact O-N 3.46Å; L27-V30 PolarHBondContact O-N 3.11Å; L27-I31 HydrophobicContact CD1-CD1 4.09Å; L27-I31 HydrophobicContact CD1-CG1 4.29Å; L27-I31 HydrophobicContact CD2-CD1 4.2Å; L27-I31 HydrophobicContact CG-CD1 3.67Å; L27-I31 HydrophobicContact CG-CG1 4.25Å; L27-I31 WeakPolarHBondContact O-CB 3.35Å; L27-I31 WeakPolarHBondContact O-CG1 3.47Å; L27-I31 PolarHBondContact O-N 3.49Å |
| 28 | A | 80 | Confident | 76.2 | Confident | 5 Ų | 5 | 58.3 Ų | 58.3 | 4% | 0.041 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -61 | -43.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | L24 S25 V26 G32 P274 I277 V278 | L24-A28 WeakPolarHBondContact O-CB 3.25Å; L24-A28 PolarHBondContact O-N 3.46Å; S25-A28 WeakPolarHBondContact O-CB 3.49Å; S25-A28 PolarHBondContact O-N 2.91Å; V26-A28 VanDerWaalsContact C-N 3.27Å; V26-A28 PolarHBondContact O-N 3.34Å; A28-G32 PolarHBondContact O-N 3.44Å; A28-P274 HydrophobicContact CB-CB 4.14Å; A28-P274 WeakPolarHBondContact CB-O 3.42Å; A28-I277 HydrophobicContact CB-CG2 3.9Å; A28-V278 HydrophobicContact CB-CG2 3.69Å; A28-V278 WeakPolarHBondContact O-CG2 3.35Å |
| 29 | V | 72.3 | Confident | 77.8 | Confident | 14 Ų | 14 | 52.2 Ų | 52.2 | 9% | 0.085 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -63.9 | -45.8 | 175.2 | 174.1 | 0 | 0 | 0 | 0 | 110.6 | S25 V26 I31 G32 C33 I277 | S25-V29 WeakPolarHBondContact O-CG2 3.31Å; S25-V29 PolarHBondContact O-N 3.11Å; V26-V29 PolarHBondContact O-N 3.03Å; V29-I31 PolarHBondContact O-N 3.24Å; V29-G32 PolarHBondContact O-N 3.07Å; V29-C33 WeakPolarHBondContact O-CB 3.49Å; V29-C33 PolarHBondContact O-N 3.48Å; V29-C33 PolarHBondContact O-SG 3Å; V29-C33 VanDerWaalsContact O-SG 3.35Å; V29-I277 HydrophobicContact CB-CG2 4.47Å; V29-I277 HydrophobicContact CG2-CD1 4.08Å; V29-I277 HydrophobicContact CG2-CG2 3.62Å |
| 30 | V | 80.9 | Confident | 78.8 | Confident | 74 Ų | 74 | 53.5 Ų | 53.5 | 45% | 0.448 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -61.3 | -46.9 | 178.7 | 174.5 | 0 | 0 | 0 | 0 | 110.9 | V26 L27 C33 L34 | V26-V30 WeakPolarHBondContact O-CG2 3.3Å; V26-V30 PolarHBondContact O-N 2.99Å; L27-V30 PolarHBondContact O-N 3.11Å; V30-C33 PolarHBondContact O-N 2.71Å; V30-L34 HydrophobicContact CG1-CD1 4.02Å; V30-L34 HydrophobicContact CG1-CG 4.49Å; V30-L34 VanDerWaalsContact O-CG 3.3Å; V30-L34 WeakPolarHBondContact O-CG 3.39Å; V30-L34 PolarHBondContact O-N 3.09Å |
| 31 | I | 89.3 | Confident | 79.6 | Confident | 77 Ų | 77 | 57.1 Ų | 57.1 | 40% | 0.395 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -61.7 | -44.5 | 176.1 | -69.2 | 171.9 | 0 | 0 | 0 | 110.5 | L27 V29 C33 L34 L35 V278 | L27-I31 HydrophobicContact CD1-CD1 4.09Å; L27-I31 HydrophobicContact CD1-CG1 4.29Å; L27-I31 HydrophobicContact CD2-CD1 4.2Å; L27-I31 HydrophobicContact CG-CD1 3.67Å; L27-I31 HydrophobicContact CG-CG1 4.25Å; L27-I31 WeakPolarHBondContact O-CB 3.35Å; L27-I31 WeakPolarHBondContact O-CG1 3.47Å; L27-I31 PolarHBondContact O-N 3.49Å; V29-I31 PolarHBondContact O-N 3.24Å; I31-C33 PolarHBondContact O-N 2.95Å; I31-L34 PolarHBondContact O-N 3.28Å; I31-L35 WeakPolarHBondContact O-CB 3.25Å; I31-L35 PolarHBondContact O-N 3.39Å; I31-V278 HydrophobicContact CG2-CG1 4.01Å; I31-V278 HydrophobicContact CG2-CG2 4.44Å |
| 32 | G | 86 | Confident | 80.8 | Confident | 0 Ų | 0 | 62.9 Ų | 62.9 | 0% | 0 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -59.9 | -44 | 177 | 0 | 0 | 0 | 0 | 0 | 112.3 | A28 V29 L35 G36 V278 A282 | A28-G32 PolarHBondContact O-N 3.44Å; V29-G32 PolarHBondContact O-N 3.07Å; G32-L35 PolarHBondContact O-N 2.94Å; G32-G36 PolarHBondContact O-N 3.47Å; G32-V278 WeakPolarHBondContact CA-O 3.19Å; G32-A282 WeakPolarHBondContact O-CA 3.41Å; G32-A282 VanDerWaalsContact O-CB 3.26Å; G32-A282 WeakPolarHBondContact O-CB 3.4Å |
| 33 | C | 82.7 | Confident | 82 | Confident | 40 Ų | 40 | 72 Ų | 72 | 27% | 0.27 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -60.5 | -52.5 | 174.2 | -72.9 | 0 | 0 | 0 | 0 | 111.7 | V29 V30 I31 L35 G36 F37 I285 | V29-C33 WeakPolarHBondContact O-CB 3.49Å; V29-C33 PolarHBondContact O-N 3.48Å; V29-C33 PolarHBondContact O-SG 3Å; V29-C33 VanDerWaalsContact O-SG 3.35Å; V30-C33 PolarHBondContact O-N 2.71Å; I31-C33 PolarHBondContact O-N 2.95Å; C33-L35 VanDerWaalsContact C-N 3.33Å; C33-L35 PolarHBondContact O-N 3.15Å; C33-G36 PolarHBondContact O-N 3.48Å; C33-F37 WeakPolarHBondContact O-CD2 3.29Å; C33-F37 PolarHBondContact O-N 3.13Å; C33-I285 HydrophobicContact CB-CD1 4.3Å |
| 34 | L | 89 | Confident | 82.7 | Confident | 118 Ų | 118 | 72 Ų | 72 | 62% | 0.618 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -59.8 | -43.7 | -179.9 | -69.4 | 173.1 | 0 | 0 | 0 | 111.7 | V30 I31 F38 | V30-L34 HydrophobicContact CG1-CD1 4.02Å; V30-L34 HydrophobicContact CG1-CG 4.49Å; V30-L34 VanDerWaalsContact O-CG 3.3Å; V30-L34 WeakPolarHBondContact O-CG 3.39Å; V30-L34 PolarHBondContact O-N 3.09Å; I31-L34 PolarHBondContact O-N 3.28Å; L34-F38 VanDerWaalsContact O-CB 3.28Å; L34-F38 WeakPolarHBondContact O-CB 3.1Å; L34-F38 PolarHBondContact O-N 3.46Å |
| 35 | L | 90.8 | Very high | 83.3 | Confident | 54 Ų | 54 | 71.2 Ų | 71.2 | 28% | 0.283 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -66.9 | -42.3 | 178.8 | -175.1 | 61 | 0 | 0 | 0 | 111.6 | I31 G32 C33 F38 L39 F52 V278 A282 | I31-L35 WeakPolarHBondContact O-CB 3.25Å; I31-L35 PolarHBondContact O-N 3.39Å; G32-L35 PolarHBondContact O-N 2.94Å; C33-L35 VanDerWaalsContact C-N 3.33Å; C33-L35 PolarHBondContact O-N 3.15Å; L35-F38 PolarHBondContact O-N 3.39Å; L35-L39 HydrophobicContact CD1-CD1 4.02Å; L35-L39 HydrophobicContact CD1-CG 4.07Å; L35-L39 HydrophobicContact CG-CD1 3.89Å; L35-L39 HydrophobicContact CG-CG 4.34Å; L35-L39 WeakPolarHBondContact O-CB 3.28Å; L35-L39 VanDerWaalsContact O-CG 3.28Å; L35-L39 WeakPolarHBondContact O-CG 3.19Å; L35-L39 PolarHBondContact O-N 3.34Å; L35-F52 HydrophobicContact CD2-CE2 4.03Å; L35-F52 HydrophobicContact CD2-CZ 3.69Å; L35-F52 HydrophobicContact CG-CZ 4.08Å; L35-V278 HydrophobicContact CD2-CG1 4.14Å; L35-A282 HydrophobicContact CB-CB 4.36Å; L35-A282 HydrophobicContact CG-CB 4.45Å |
| 36 | G | 86.4 | Confident | 84.2 | Confident | 0 Ų | 0 | 77.9 Ų | 77.9 | 0% | 0 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -61.2 | -48 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | G32 C33 F38 L39 R40 | G32-G36 PolarHBondContact O-N 3.47Å; C33-G36 PolarHBondContact O-N 3.48Å; G36-F38 VanDerWaalsContact C-N 3.34Å; G36-F38 PolarHBondContact O-N 3.19Å; G36-L39 PolarHBondContact O-N 2.99Å; G36-R40 WeakPolarHBondContact O-CB 3.33Å; G36-R40 PolarHBondContact O-N 3.43Å |
| 37 | F | 86.9 | Confident | 85.1 | Confident | 105 Ų | 105 | 82 Ų | 82 | 46% | 0.461 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -63.3 | -39.8 | 175.7 | -79.2 | -65.8 | 0 | 0 | 0 | 112.3 | C33 R40 I285 P291 | C33-F37 WeakPolarHBondContact O-CD2 3.29Å; C33-F37 PolarHBondContact O-N 3.13Å; F37-R40 WeakPolarHBondContact O-CB 3.41Å; F37-I285 HydrophobicContact CD1-CG2 4.32Å; F37-I285 HydrophobicContact CE1-CG2 4.42Å; F37-I285 HydrophobicContact CE2-CD1 4.37Å; F37-I285 HydrophobicContact CG-CG2 4.45Å; F37-P291 HydrophobicContact CE1-CB 3.58Å; F37-P291 HydrophobicContact CE1-CG 4.1Å; F37-P291 HydrophobicContact CZ-CB 3.94Å |
| 38 | F | 90.1 | Very high | 85.5 | Confident | 116 Ų | 116 | 82.6 Ų | 82.6 | 51% | 0.509 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -63.6 | -49.9 | 176.1 | 177.5 | -102 | 0 | 0 | 0 | 111.9 | L34 L35 G36 R40 T41 | L34-F38 VanDerWaalsContact O-CB 3.28Å; L34-F38 WeakPolarHBondContact O-CB 3.1Å; L34-F38 PolarHBondContact O-N 3.46Å; L35-F38 PolarHBondContact O-N 3.39Å; G36-F38 VanDerWaalsContact C-N 3.34Å; G36-F38 PolarHBondContact O-N 3.19Å; F38-R40 VanDerWaalsContact C-N 3.25Å; F38-R40 PolarHBondContact O-N 3.5Å; F38-T41 WeakPolarHBondContact O-CB 3.31Å; F38-T41 PolarHBondContact O-N 3.11Å; F38-T41 VanDerWaalsContact O-N 3.13Å; F38-T41 PolarHBondContact O-OG1 3.31Å |
| 39 | L | 89.7 | Confident | 85.7 | Confident | 29 Ų | 29 | 83.2 Ų | 83.2 | 15% | 0.152 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -65.3 | -29.2 | -179.1 | -72.5 | 175.7 | 0 | 0 | 0 | 112.4 | L35 G36 T41 R42 L44 F52 L286 | L35-L39 HydrophobicContact CD1-CD1 4.02Å; L35-L39 HydrophobicContact CD1-CG 4.07Å; L35-L39 HydrophobicContact CG-CD1 3.89Å; L35-L39 HydrophobicContact CG-CG 4.34Å; L35-L39 WeakPolarHBondContact O-CB 3.28Å; L35-L39 VanDerWaalsContact O-CG 3.28Å; L35-L39 WeakPolarHBondContact O-CG 3.19Å; L35-L39 PolarHBondContact O-N 3.34Å; G36-L39 PolarHBondContact O-N 2.99Å; L39-T41 PolarHBondContact O-N 2.78Å; L39-R42 WeakPolarHBondContact O-CB 3.45Å; L39-R42 PolarHBondContact O-N 3.1Å; L39-L44 HydrophobicContact CB-CD1 3.91Å; L39-L44 HydrophobicContact CD2-CD1 4.28Å; L39-L44 HydrophobicContact CG-CD1 4.48Å; L39-F52 HydrophobicContact CD1-CD1 4.29Å; L39-F52 HydrophobicContact CD1-CD2 4Å; L39-F52 HydrophobicContact CD1-CE1 3.78Å; L39-F52 HydrophobicContact CD1-CE2 3.45Å; L39-F52 VanDerWaalsContact CD1-CE2 3.45Å; L39-F52 HydrophobicContact CD1-CG 4.39Å; L39-F52 HydrophobicContact CD1-CZ 3.34Å; L39-L286 HydrophobicContact CB-CD1 4.13Å; L39-L286 HydrophobicContact CB-CD2 3.76Å; L39-L286 HydrophobicContact CB-CG 4.44Å; L39-L286 HydrophobicContact CD1-CD1 4.28Å |
| 40 | R | 83.2 | Confident | 86.3 | Confident | 79 Ų | 79 | 88.8 Ų | 88.8 | 30% | 0.298 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -59.1 | -35 | 174.3 | -167.4 | -172.8 | -175 | 86.2 | 6.4 | 112.3 | G36 F37 F38 R42 R43 I285 L286 M288 S289 P291 | G36-R40 WeakPolarHBondContact O-CB 3.33Å; G36-R40 PolarHBondContact O-N 3.43Å; F37-R40 WeakPolarHBondContact O-CB 3.41Å; F38-R40 VanDerWaalsContact C-N 3.25Å; F38-R40 PolarHBondContact O-N 3.5Å; R40-R42 PolarHBondContact O-N 3.03Å; R40-R43 PolarHBondContact O-N 3.28Å; R40-I285 PolarHBondContact NH1-O 3.36Å; R40-L286 HydrophobicContact CB-CD2 4.04Å; R40-L286 VanDerWaalsContact N-CD2 3.31Å; R40-M288 PolarHBondContact NH1-O 3.22Å; R40-M288 PolarHBondContact NH2-O 3.02Å; R40-S289 VanDerWaalsContact NH2-C 3.31Å; R40-S289 PolarHBondContact NH2-O 2.89Å; R40-P291 VanDerWaalsContact CZ-CG 3.48Å; R40-P291 VanDerWaalsContact NH1-CG 3.33Å |
| 41 | T | 85.8 | Confident | 86.8 | Confident | 103 Ų | 103 | 93.7 Ų | 93.7 | 63% | 0.632 | 43% | 0.433 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.2 | -18.6 | 176.7 | 69.9 | 0 | 0 | 0 | 0 | 113.2 | F38 L39 | F38-T41 WeakPolarHBondContact O-CB 3.31Å; F38-T41 PolarHBondContact O-N 3.11Å; F38-T41 VanDerWaalsContact O-N 3.13Å; F38-T41 PolarHBondContact O-OG1 3.31Å; L39-T41 PolarHBondContact O-N 2.78Å |
| 42 | R | 86.2 | Confident | 86.8 | Confident | 174 Ų | 174 | 92.1 Ų | 92.1 | 66% | 0.657 | 42% | 0.424 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.7 | -3.5 | -176.7 | -61.9 | -64.5 | -173.1 | 169.8 | 0 | 114.5 | L39 R40 L44 | L39-R42 WeakPolarHBondContact O-CB 3.45Å; L39-R42 PolarHBondContact O-N 3.1Å; R40-R42 PolarHBondContact O-N 3.03Å; R42-L44 PolarHBondContact O-N 2.81Å |
| 43 | R | 81.2 | Confident | 86.6 | Confident | 240 Ų | 240 | 93.5 Ų | 93.5 | 91% | 0.906 | 43% | 0.43 | S | S | * | . | trans | 43.9 | 61.4 | -179.7 | -66.9 | -170.7 | 176.2 | -172.2 | -0.9 | 113.1 | R40 | R40-R43 PolarHBondContact O-N 3.28Š| ||
| 44 | L | 84.3 | Confident | 86.9 | Confident | 59 Ų | 59 | 97.1 Ų | 97.1 | 31% | 0.309 | 44% | 0.441 | S | S | . | . | trans | -61.6 | 150.5 | 177.2 | -69.6 | 153.8 | 0 | 0 | 0 | 112 | L39 R42 E48 V49 L286 | L39-L44 HydrophobicContact CB-CD1 3.91Å; L39-L44 HydrophobicContact CD2-CD1 4.28Å; L39-L44 HydrophobicContact CG-CD1 4.48Å; R42-L44 PolarHBondContact O-N 2.81Å; L44-E48 HydrophobicContact CB-CB 4.38Å; L44-E48 HydrophobicContact CD2-CB 4.04Å; L44-V49 HydrophobicContact CB-CG2 3.92Å; L44-L286 HydrophobicContact CD1-CD1 3.98Å; L44-L286 HydrophobicContact CD1-CD2 4.34Å | ||
| 45 | S | 88.5 | Confident | 86.8 | Confident | 64 Ų | 64 | 92.5 Ų | 92.5 | 45% | 0.448 | 42% | 0.419 | S | S | . | . | trans | -71.6 | 153.7 | 170.3 | 176.1 | 0 | 0 | 0 | 0 | 111.5 | Q47 E48 V49 | S45-Q47 PolarHBondContact O-N 2.89Å; S45-E48 PolarHBondContact N-OE2 2.9Å; S45-E48 WeakPolarHBondContact O-CB 3.43Å; S45-E48 PolarHBondContact O-N 3.15Å; S45-V49 WeakPolarHBondContact O-CG2 3.49Å; S45-V49 PolarHBondContact O-N 2.79Å | ||
| 46 | E | 85 | Confident | 85.9 | Confident | 151 Ų | 151 | 90 Ų | 90 | 71% | 0.706 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -55.8 | -36 | 178.1 | -68.7 | -170.2 | 177.6 | 0 | 0 | 113.2 | V49 K50 | E46-V49 PolarHBondContact O-N 3.27Å; E46-K50 WeakPolarHBondContact O-CG 3.46Å; E46-K50 PolarHBondContact O-N 3.46Å; E46-K50 VanDerWaalsContact O-N 3.08Å |
| 47 | Q | 88.2 | Confident | 85.3 | Confident | 131 Ų | 131 | 93.9 Ų | 93.9 | 61% | 0.612 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -66.2 | -40.1 | 176.9 | -72.4 | -178.8 | -15.2 | 0 | 0 | 111.8 | S45 K50 Y51 | S45-Q47 PolarHBondContact O-N 2.89Å; Q47-K50 PolarHBondContact O-N 2.88Å; Q47-Y51 PolarHBondContact O-N 3.12Å |
| 48 | E | 88.8 | Confident | 84.9 | Confident | 102 Ų | 102 | 92 Ų | 92 | 48% | 0.477 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -68.8 | -38.2 | 178.8 | -61.1 | 174.3 | 136.9 | 0 | 0 | 111.1 | L44 S45 K50 Y51 F52 | L44-E48 HydrophobicContact CB-CB 4.38Å; L44-E48 HydrophobicContact CD2-CB 4.04Å; S45-E48 PolarHBondContact N-OE2 2.9Å; S45-E48 WeakPolarHBondContact O-CB 3.43Å; S45-E48 PolarHBondContact O-N 3.15Å; E48-K50 VanDerWaalsContact C-N 3.34Å; E48-Y51 PolarHBondContact O-N 3.35Å; E48-F52 VanDerWaalsContact O-CB 3.28Å; E48-F52 WeakPolarHBondContact O-CB 3.2Å; E48-F52 PolarHBondContact O-N 3.22Å |
| 49 | V | 85.4 | Confident | 84 | Confident | 17 Ų | 17 | 86.6 Ų | 86.6 | 10% | 0.103 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -60.8 | -44.1 | 173.7 | 175.9 | 0 | 0 | 0 | 0 | 110.7 | L44 S45 E46 F52 Q53 L286 E287 | L44-V49 HydrophobicContact CB-CG2 3.92Å; S45-V49 WeakPolarHBondContact O-CG2 3.49Å; S45-V49 PolarHBondContact O-N 2.79Å; E46-V49 PolarHBondContact O-N 3.27Å; V49-F52 PolarHBondContact O-N 3.37Å; V49-Q53 HydrophobicContact CG1-CG 4.41Å; V49-Q53 WeakPolarHBondContact O-CB 3.34Å; V49-Q53 VanDerWaalsContact O-CG 3.31Å; V49-Q53 WeakPolarHBondContact O-CG 3.45Å; V49-Q53 PolarHBondContact O-N 2.79Å; V49-L286 HydrophobicContact CG1-CB 4.22Å; V49-L286 HydrophobicContact CG2-CB 4.38Å; V49-L286 HydrophobicContact CG2-CD1 4.41Å; V49-E287 HydrophobicContact CG1-CG 4.43Å |
| 50 | K | 84.5 | Confident | 82.8 | Confident | 132 Ų | 132 | 86.5 Ų | 86.5 | 57% | 0.574 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -61.2 | -45.4 | 176.3 | -73.6 | 175.8 | -175.4 | 175.5 | 0 | 112.3 | E46 Q47 E48 F52 Q53 F54 | E46-K50 WeakPolarHBondContact O-CG 3.46Å; E46-K50 PolarHBondContact O-N 3.46Å; E46-K50 VanDerWaalsContact O-N 3.08Å; Q47-K50 PolarHBondContact O-N 2.88Å; E48-K50 VanDerWaalsContact C-N 3.34Å; K50-F52 VanDerWaalsContact C-N 3.33Å; K50-F52 PolarHBondContact O-N 3.24Å; K50-Q53 PolarHBondContact O-N 3.48Å; K50-F54 PolarHBondContact O-N 3.49Å |
| 51 | Y | 91.8 | Very high | 82.3 | Confident | 177 Ų | 177 | 90.1 Ų | 90.1 | 69% | 0.694 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -65.5 | -37.9 | 177.4 | -64 | -24.7 | 0 | 0 | 0 | 112.6 | Q47 E48 F54 | Q47-Y51 PolarHBondContact O-N 3.12Å; E48-Y51 PolarHBondContact O-N 3.35Å; Y51-F54 WeakPolarHBondContact O-CB 3.37Å; Y51-F54 PolarHBondContact O-N 2.85Å |
| 52 | F | 88.6 | Confident | 81.6 | Confident | 43 Ų | 43 | 87.9 Ų | 87.9 | 19% | 0.189 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -65.5 | -38.1 | 175.8 | 177.2 | -98.8 | 0 | 0 | 0 | 112.4 | L35 L39 E48 V49 K50 F54 P55 F279 A282 L286 | L35-F52 HydrophobicContact CD2-CE2 4.03Å; L35-F52 HydrophobicContact CD2-CZ 3.69Å; L35-F52 HydrophobicContact CG-CZ 4.08Å; L39-F52 HydrophobicContact CD1-CD1 4.29Å; L39-F52 HydrophobicContact CD1-CD2 4Å; L39-F52 HydrophobicContact CD1-CE1 3.78Å; L39-F52 HydrophobicContact CD1-CE2 3.45Å; L39-F52 VanDerWaalsContact CD1-CE2 3.45Å; L39-F52 HydrophobicContact CD1-CG 4.39Å; L39-F52 HydrophobicContact CD1-CZ 3.34Å; E48-F52 VanDerWaalsContact O-CB 3.28Å; E48-F52 WeakPolarHBondContact O-CB 3.2Å; E48-F52 PolarHBondContact O-N 3.22Å; V49-F52 PolarHBondContact O-N 3.37Å; K50-F52 VanDerWaalsContact C-N 3.33Å; K50-F52 PolarHBondContact O-N 3.24Å; F52-F54 VanDerWaalsContact C-N 3.3Å; F52-F54 PolarHBondContact O-N 2.82Å; F52-P55 WeakPolarHBondContact O-CD 3.44Å; F52-F279 HydrophobicContact CD2-CD1 4.2Å; F52-F279 HydrophobicContact CD2-CE1 4.42Å; F52-F279 HydrophobicContact CE1-CD1 4.38Å; F52-F279 AromaticContact CE2-CD1 3.79Å; F52-F279 HydrophobicContact CE2-CD1 3.79Å; F52-F279 AromaticContact CE2-CE1 3.93Å; F52-F279 HydrophobicContact CE2-CE1 3.93Å; F52-F279 AromaticContact CZ-CD1 3.89Å; F52-F279 HydrophobicContact CZ-CD1 3.89Å; F52-F279 HydrophobicContact CZ-CE1 4.38Å; F52-F279 VanDerWaalsContact O-CD1 3.3Å; F52-F279 WeakPolarHBondContact O-CD1 3.36Å; F52-A282 HydrophobicContact CE1-CB 3.55Å; F52-A282 HydrophobicContact CZ-CB 3.75Å; F52-L286 HydrophobicContact CD1-CD1 3.97Å; F52-L286 HydrophobicContact CE1-CD1 4.17Å |
| 53 | Q | 81.6 | Confident | 80.4 | Confident | 30 Ų | 30 | 80.7 Ų | 80.7 | 14% | 0.14 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -73 | -16.9 | 179.1 | -80.1 | 176.8 | 5.7 | 0 | 0 | 114.7 | V49 K50 P55 G56 E57 G283 E287 | V49-Q53 HydrophobicContact CG1-CG 4.41Å; V49-Q53 WeakPolarHBondContact O-CB 3.34Å; V49-Q53 VanDerWaalsContact O-CG 3.31Å; V49-Q53 WeakPolarHBondContact O-CG 3.45Å; V49-Q53 PolarHBondContact O-N 2.79Å; K50-Q53 PolarHBondContact O-N 3.48Å; Q53-P55 VanDerWaalsContact C-CD 3.46Å; Q53-G56 WeakPolarHBondContact O-CA 3.22Å; Q53-G56 PolarHBondContact O-N 3.19Å; Q53-E57 PolarHBondContact O-N 2.98Å; Q53-G283 VanDerWaalsContact NE2-C 3.28Å; Q53-G283 PolarHBondContact NE2-O 2.67Å; Q53-E287 PolarHBondContact NE2-OE1 3.24Å; Q53-E287 PolarHBondContact OE1-OE1 3.21Å |
| 54 | F | 88.3 | Confident | 79.5 | Confident | 115 Ų | 115 | 73.5 Ų | 73.5 | 50% | 0.504 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -50.5 | -42.3 | -171 | 179.6 | -103.7 | 0 | 0 | 0 | 115.2 | K50 Y51 F52 G56 E57 L58 | K50-F54 PolarHBondContact O-N 3.49Å; Y51-F54 WeakPolarHBondContact O-CB 3.37Å; Y51-F54 PolarHBondContact O-N 2.85Å; F52-F54 VanDerWaalsContact C-N 3.3Å; F52-F54 PolarHBondContact O-N 2.82Å; F54-G56 VanDerWaalsContact C-N 3.3Å; F54-G56 PolarHBondContact O-N 3.44Å; F54-E57 WeakPolarHBondContact O-CB 3.47Å; F54-E57 PolarHBondContact O-N 2.99Å; F54-L58 PolarHBondContact O-N 3.39Å |
| 55 | P | 86.9 | Confident | 79.3 | Confident | 22 Ų | 22 | 76.3 Ų | 76.3 | 14% | 0.143 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -62.5 | -35.2 | 175.5 | -23.3 | 35.4 | 0 | 0 | 0 | 113.7 | F52 Q53 L59 Y272 F275 F279 | F52-P55 WeakPolarHBondContact O-CD 3.44Å; Q53-P55 VanDerWaalsContact C-CD 3.46Å; P55-L59 PolarHBondContact O-N 3.13Å; P55-Y272 PolarHBondContact O-OH 3.16Å; P55-F275 HydrophobicContact CB-CD1 4.46Å; P55-F275 HydrophobicContact CB-CE1 3.84Å; P55-F275 HydrophobicContact CG-CE1 4.46Å; P55-F279 HydrophobicContact CB-CB 4.14Å; P55-F279 HydrophobicContact CB-CD2 3.63Å; P55-F279 HydrophobicContact CB-CE2 4.21Å; P55-F279 HydrophobicContact CB-CG 3.87Å; P55-F279 HydrophobicContact CG-CB 4.37Å; P55-F279 HydrophobicContact CG-CD1 4.12Å; P55-F279 HydrophobicContact CG-CD2 3.92Å; P55-F279 HydrophobicContact CG-CE1 4.4Å; P55-F279 HydrophobicContact CG-CE2 4.24Å; P55-F279 HydrophobicContact CG-CG 3.86Å; P55-F279 HydrophobicContact CG-CZ 4.46Å |
| 56 | G | 71.7 | Confident | 78.4 | Confident | 2 Ų | 2 | 73.7 Ų | 73.7 | 2% | 0.021 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -69.5 | -39.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112 | Q53 F54 L58 L59 M60 G276 | Q53-G56 WeakPolarHBondContact O-CA 3.22Å; Q53-G56 PolarHBondContact O-N 3.19Å; F54-G56 VanDerWaalsContact C-N 3.3Å; F54-G56 PolarHBondContact O-N 3.44Å; G56-L58 VanDerWaalsContact C-N 3.34Å; G56-L59 WeakPolarHBondContact O-CB 3.28Å; G56-L59 PolarHBondContact O-N 3.35Å; G56-M60 PolarHBondContact O-N 3.48Å; G56-G276 WeakPolarHBondContact CA-O 3.44Å |
| 57 | E | 73.8 | Confident | 77.5 | Confident | 81 Ų | 81 | 66.7 Ų | 66.7 | 38% | 0.379 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -62.3 | -41.9 | 173.7 | -166 | -164.4 | 150.7 | 0 | 0 | 111.7 | Q53 F54 L59 M60 R61 | Q53-E57 PolarHBondContact O-N 2.98Å; F54-E57 WeakPolarHBondContact O-CB 3.47Å; F54-E57 PolarHBondContact O-N 2.99Å; E57-L59 VanDerWaalsContact C-N 3.31Å; E57-L59 PolarHBondContact O-N 3.27Å; E57-M60 WeakPolarHBondContact O-CB 3.27Å; E57-M60 PolarHBondContact O-N 3.37Å; E57-M60 VanDerWaalsContact O-N 3.12Å; E57-R61 WeakPolarHBondContact O-CG 3.39Å; E57-R61 PolarHBondContact O-N 2.87Å; E57-R61 IonicContact OE1-CZ 2.87Å; E57-R61 IonicContact OE1-NE 2.77Å; E57-R61 PolarHBondContact OE1-NE 3.03Å; E57-R61 IonicContact OE1-NH2 3.9Å; E57-R61 PolarHBondContact OE1-NH2 3.37Å |
| 58 | L | 79.8 | Confident | 77.1 | Confident | 66 Ų | 66 | 63.1 Ų | 63.1 | 35% | 0.346 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -60.3 | -42.4 | 177.3 | -172 | 66.1 | 0 | 0 | 0 | 111.3 | F54 G56 M60 R61 M62 | F54-L58 PolarHBondContact O-N 3.39Å; G56-L58 VanDerWaalsContact C-N 3.34Å; L58-M60 VanDerWaalsContact C-N 3.32Å; L58-M60 PolarHBondContact O-N 3.17Å; L58-R61 PolarHBondContact O-N 3.09Å; L58-M62 VanDerWaalsContact O-CG 3.3Å; L58-M62 WeakPolarHBondContact O-CG 3.43Å; L58-M62 PolarHBondContact O-N 3.38Å |
| 59 | L | 71.1 | Confident | 76.7 | Confident | 1 Ų | 1 | 60.2 Ų | 60.2 | 1% | 0.005 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -56.2 | -47.5 | 173.5 | 175.5 | 63.9 | 0 | 0 | 0 | 111.1 | P55 G56 E57 R61 M62 L63 V269 Y272 F273 | P55-L59 PolarHBondContact O-N 3.13Å; G56-L59 WeakPolarHBondContact O-CB 3.28Å; G56-L59 PolarHBondContact O-N 3.35Å; E57-L59 VanDerWaalsContact C-N 3.31Å; E57-L59 PolarHBondContact O-N 3.27Å; L59-R61 VanDerWaalsContact C-N 3.33Å; L59-R61 PolarHBondContact O-N 3.37Å; L59-M62 PolarHBondContact O-N 3.42Å; L59-L63 HydrophobicContact CD1-CD1 4.41Å; L59-L63 HydrophobicContact CD1-CG 4.43Å; L59-L63 HydrophobicContact CG-CD1 4.36Å; L59-L63 WeakPolarHBondContact O-CG 3.34Å; L59-L63 PolarHBondContact O-N 3.49Å; L59-V269 HydrophobicContact CD1-CG1 4.23Å; L59-Y272 HydrophobicContact CB-CD1 4.13Å; L59-Y272 HydrophobicContact CB-CE1 3.88Å; L59-Y272 HydrophobicContact CD1-CD1 3.93Å; L59-F273 HydrophobicContact CD1-CB 4.4Å; L59-F273 HydrophobicContact CD1-CD2 4.01Å; L59-F273 HydrophobicContact CD2-CD2 3.79Å; L59-F273 HydrophobicContact CD2-CE2 4.1Å; L59-F273 HydrophobicContact CD2-CG 4.46Å; L59-F273 HydrophobicContact CG-CD2 4.42Å |
| 60 | M | 63.3 | Low | 76 | Confident | 27 Ų | 27 | 60 Ų | 60 | 13% | 0.133 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -62.7 | -39.1 | 178.9 | -65.5 | -56.4 | -69.8 | 0 | 0 | 112.3 | G56 E57 L58 L63 K64 L280 I449 I453 | G56-M60 PolarHBondContact O-N 3.48Å; E57-M60 WeakPolarHBondContact O-CB 3.27Å; E57-M60 PolarHBondContact O-N 3.37Å; E57-M60 VanDerWaalsContact O-N 3.12Å; L58-M60 VanDerWaalsContact C-N 3.32Å; L58-M60 PolarHBondContact O-N 3.17Å; M60-L63 PolarHBondContact O-N 3.42Å; M60-K64 WeakPolarHBondContact O-CB 3.19Å; M60-K64 WeakPolarHBondContact O-CG 3.41Å; M60-K64 PolarHBondContact O-N 3.39Å; M60-L280 HydrophobicContact CG-CD1 3.77Å; M60-L280 HydrophobicContact SD-CD1 3.75Å; M60-I449 HydrophobicContact CE-CG2 4.48Å; M60-I453 HydrophobicContact CE-CD1 4Å; M60-I453 HydrophobicContact SD-CD1 3.51Å; M60-I453 VanDerWaalsContact SD-CD1 3.51Å |
| 61 | R | 73.4 | Confident | 75.3 | Confident | 155 Ų | 155 | 53.9 Ų | 53.9 | 59% | 0.585 | 25% | 0.249 | S | C | * | . | H | α-helix | trans | -65 | -42 | 175.3 | -69.9 | 177.3 | 178.2 | -135.6 | 4 | 112.1 | E57 L58 L59 L63 K64 M65 | E57-R61 WeakPolarHBondContact O-CG 3.39Å; E57-R61 PolarHBondContact O-N 2.87Å; E57-R61 IonicContact OE1-CZ 2.87Å; E57-R61 IonicContact OE1-NE 2.77Å; E57-R61 PolarHBondContact OE1-NE 3.03Å; E57-R61 IonicContact OE1-NH2 3.9Å; E57-R61 PolarHBondContact OE1-NH2 3.37Å; L58-R61 PolarHBondContact O-N 3.09Å; L59-R61 VanDerWaalsContact C-N 3.33Å; L59-R61 PolarHBondContact O-N 3.37Å; R61-L63 PolarHBondContact O-N 3.21Å; R61-K64 PolarHBondContact O-N 3.04Å; R61-M65 PolarHBondContact O-N 3.37Å |
| 62 | M | 71 | Confident | 74.9 | Confident | 57 Ų | 57 | 47.4 Ų | 47.4 | 28% | 0.281 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -61.7 | -42.6 | 176.2 | -68.2 | 177.3 | 90.4 | 0 | 0 | 111.6 | L58 L59 M65 L66 V269 Y272 | L58-M62 VanDerWaalsContact O-CG 3.3Å; L58-M62 WeakPolarHBondContact O-CG 3.43Å; L58-M62 PolarHBondContact O-N 3.38Å; L59-M62 PolarHBondContact O-N 3.42Å; M62-M65 PolarHBondContact O-N 2.92Å; M62-L66 WeakPolarHBondContact O-CG 3.07Å; M62-V269 HydrophobicContact CB-CG1 3.94Å; M62-V269 HydrophobicContact CB-CG2 4.34Å; M62-V269 HydrophobicContact CE-CG2 3.79Å; M62-Y272 HydrophobicContact SD-CD1 4.04Å; M62-Y272 HydrophobicContact SD-CE1 4.41Å |
| 63 | L | 61.4 | Low | 74.5 | Confident | 23 Ų | 23 | 45.3 Ų | 45.3 | 12% | 0.12 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -65.9 | -44.2 | 175.8 | -66.4 | 176.2 | 0 | 0 | 0 | 111.9 | L59 M60 R61 M65 L66 I67 V269 V433 | L59-L63 HydrophobicContact CD1-CD1 4.41Å; L59-L63 HydrophobicContact CD1-CG 4.43Å; L59-L63 HydrophobicContact CG-CD1 4.36Å; L59-L63 WeakPolarHBondContact O-CG 3.34Å; L59-L63 PolarHBondContact O-N 3.49Å; M60-L63 PolarHBondContact O-N 3.42Å; R61-L63 PolarHBondContact O-N 3.21Å; L63-M65 VanDerWaalsContact C-N 3.26Å; L63-M65 PolarHBondContact O-N 2.92Å; L63-L66 PolarHBondContact O-N 3.44Å; L63-L66 VanDerWaalsContact O-N 3.15Å; L63-I67 WeakPolarHBondContact O-CG1 3.07Å; L63-V269 HydrophobicContact CD2-CG1 3.99Å; L63-V433 HydrophobicContact CB-CG2 4.32Å |
| 64 | K | 62.6 | Low | 74.1 | Confident | 88 Ų | 88 | 44.2 Ų | 44.2 | 38% | 0.383 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -62.5 | -28.9 | 176.8 | -75.8 | 179.9 | -179.7 | -177 | 0 | 113.6 | M60 R61 L66 I67 | M60-K64 WeakPolarHBondContact O-CB 3.19Å; M60-K64 WeakPolarHBondContact O-CG 3.41Å; M60-K64 PolarHBondContact O-N 3.39Å; R61-K64 PolarHBondContact O-N 3.04Å; K64-L66 VanDerWaalsContact C-N 3.34Å; K64-I67 HydrophobicContact CG-CD1 4.49Å; K64-I67 WeakPolarHBondContact O-CG1 3.5Å |
| 65 | M | 79.1 | Confident | 73.3 | Confident | 118 Ų | 118 | 39 Ų | 39 | 58% | 0.581 | 19% | 0.191 | S | C | * | . | H | α-helix | trans | -69.2 | -32.5 | 175.8 | -177.9 | -171.4 | 70.1 | 0 | 0 | 112.5 | R61 M62 L63 P69 | R61-M65 PolarHBondContact O-N 3.37Å; M62-M65 PolarHBondContact O-N 2.92Å; L63-M65 VanDerWaalsContact C-N 3.26Å; L63-M65 PolarHBondContact O-N 2.92Å; M65-P69 WeakPolarHBondContact O-CD 3.34Å |
| 66 | L | 69.9 | Low | 73.2 | Confident | 10 Ų | 10 | 38.6 Ų | 38.6 | 5% | 0.052 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -81.9 | -16.1 | -173.4 | -63.4 | 170.4 | 0 | 0 | 0 | 113.2 | M62 L63 K64 P69 L70 V262 I265 V266 V269 | M62-L66 WeakPolarHBondContact O-CG 3.07Å; L63-L66 PolarHBondContact O-N 3.44Å; L63-L66 VanDerWaalsContact O-N 3.15Å; K64-L66 VanDerWaalsContact C-N 3.34Å; L66-P69 WeakPolarHBondContact O-CD 3.44Å; L66-L70 WeakPolarHBondContact O-CB 3.42Å; L66-L70 PolarHBondContact O-N 2.93Å; L66-V262 HydrophobicContact CD2-CG1 4.3Å; L66-I265 HydrophobicContact CD2-CB 4.15Å; L66-I265 HydrophobicContact CD2-CG2 3.66Å; L66-V266 HydrophobicContact CB-CG2 4.49Å; L66-V266 HydrophobicContact CD1-CB 4.36Å; L66-V266 HydrophobicContact CD1-CG2 3.76Å; L66-V269 HydrophobicContact CD1-CB 4.36Å; L66-V269 HydrophobicContact CD1-CG2 3.83Å |
| 67 | I | 67.6 | Low | 73.4 | Confident | 3 Ų | 3 | 39 Ų | 39 | 2% | 0.015 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -59.2 | -56.7 | -175.1 | -42.6 | -163.7 | 0 | 0 | 0 | 111.5 | L63 K64 L70 V71 M225 V433 | L63-I67 WeakPolarHBondContact O-CG1 3.07Å; K64-I67 HydrophobicContact CG-CD1 4.49Å; K64-I67 WeakPolarHBondContact O-CG1 3.5Å; I67-L70 PolarHBondContact O-N 3.46Å; I67-V71 HydrophobicContact CG2-CG2 3.97Å; I67-V71 WeakPolarHBondContact O-CB 3.42Å; I67-V71 VanDerWaalsContact O-CG2 3.27Å; I67-V71 WeakPolarHBondContact O-CG2 3.49Å; I67-V71 PolarHBondContact O-N 2.82Å; I67-M225 HydrophobicContact CB-CE 3.69Å; I67-M225 HydrophobicContact CD1-CE 4.41Å; I67-M225 HydrophobicContact CG1-CE 4.48Å; I67-M225 HydrophobicContact CG2-CE 3.59Å; I67-V433 HydrophobicContact CB-CG1 3.99Å; I67-V433 HydrophobicContact CD1-CG1 3.36Å; I67-V433 HydrophobicContact CG1-CG1 3.22Å; I67-V433 HydrophobicContact CG2-CG1 4Å |
| 68 | L | 77.9 | Confident | 73.3 | Confident | 56 Ų | 56 | 36.1 Ų | 36.1 | 29% | 0.293 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -57.4 | -56.4 | -173.5 | 176.6 | 66.5 | 0 | 0 | 0 | 112.7 | L70 V72 T157 M225 I230 | L68-L70 VanDerWaalsContact C-N 3.31Å; L68-L70 PolarHBondContact O-N 3.27Å; L68-V72 HydrophobicContact CD1-CG2 4.14Å; L68-V72 VanDerWaalsContact O-CG2 3.31Å; L68-V72 WeakPolarHBondContact O-CG2 3.32Å; L68-V72 PolarHBondContact O-N 2.95Å; L68-V72 VanDerWaalsContact O-N 3.16Å; L68-T157 HydrophobicContact CD1-CG2 3.8Å; L68-T157 HydrophobicContact CD2-CG2 3.82Å; L68-T157 HydrophobicContact CG-CG2 4.48Å; L68-M225 HydrophobicContact CB-SD 3.86Å; L68-M225 HydrophobicContact CD1-SD 3.99Å; L68-M225 HydrophobicContact CG-SD 4.43Å; L68-I230 HydrophobicContact CD1-CD1 3.7Å; L68-I230 HydrophobicContact CD1-CG2 4.34Å |
| 69 | P | 80.8 | Confident | 73.1 | Confident | 41 Ų | 41 | 34 Ų | 34 | 27% | 0.266 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -67.6 | -32.8 | -178.1 | 28.4 | -36.5 | 0 | 0 | 0 | 112 | M65 L66 S73 V262 | M65-P69 WeakPolarHBondContact O-CD 3.34Å; L66-P69 WeakPolarHBondContact O-CD 3.44Å; P69-S73 WeakPolarHBondContact O-CB 3.35Å; P69-S73 PolarHBondContact O-N 3.09Å; P69-S73 VanDerWaalsContact O-N 3.13Å; P69-S73 PolarHBondContact O-OG 3.39Å; P69-V262 HydrophobicContact CB-CG2 3.87Å; P69-V262 HydrophobicContact CG-CG1 4.44Å; P69-V262 HydrophobicContact CG-CG2 4.21Å |
| 70 | L | 71.8 | Confident | 73.4 | Confident | 14 Ų | 14 | 34.4 Ų | 34.4 | 7% | 0.073 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -67.3 | -52.4 | 177.9 | -174.6 | 66.3 | 0 | 0 | 0 | 111.3 | L66 I67 L68 V72 S73 S74 N259 V262 L263 A425 | L66-L70 WeakPolarHBondContact O-CB 3.42Å; L66-L70 PolarHBondContact O-N 2.93Å; I67-L70 PolarHBondContact O-N 3.46Å; L68-L70 VanDerWaalsContact C-N 3.31Å; L68-L70 PolarHBondContact O-N 3.27Å; L70-V72 PolarHBondContact O-N 2.85Å; L70-S73 PolarHBondContact O-N 3.12Å; L70-S73 PolarHBondContact O-OG 3.4Å; L70-S74 WeakPolarHBondContact O-CB 3.21Å; L70-S74 PolarHBondContact O-N 2.88Å; L70-S74 PolarHBondContact O-OG 3.35Å; L70-N259 WeakPolarHBondContact CD1-OD1 3.46Å; L70-V262 HydrophobicContact CB-CG1 3.97Å; L70-V262 HydrophobicContact CD1-CG1 4.1Å; L70-L263 HydrophobicContact CD1-CD2 4.05Å; L70-L263 HydrophobicContact CD1-CG 4.39Å; L70-A425 HydrophobicContact CD1-CB 4.33Å; L70-A425 HydrophobicContact CD2-CB 3.99Å |
| 71 | V | 69.3 | Low | 73.6 | Confident | 3 Ų | 3 | 36 Ų | 36 | 2% | 0.018 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -60.6 | -47.5 | -177.9 | 170.1 | 0 | 0 | 0 | 0 | 110.8 | I67 S74 L75 I230 V231 | I67-V71 HydrophobicContact CG2-CG2 3.97Å; I67-V71 WeakPolarHBondContact O-CB 3.42Å; I67-V71 VanDerWaalsContact O-CG2 3.27Å; I67-V71 WeakPolarHBondContact O-CG2 3.49Å; I67-V71 PolarHBondContact O-N 2.82Å; V71-S74 PolarHBondContact O-OG 2.99Å; V71-L75 HydrophobicContact CG1-CD1 3.68Å; V71-L75 HydrophobicContact CG1-CG 4.45Å; V71-L75 VanDerWaalsContact O-CB 3.27Å; V71-L75 WeakPolarHBondContact O-CB 3.38Å; V71-L75 VanDerWaalsContact O-CG 3.27Å; V71-L75 WeakPolarHBondContact O-CG 3.28Å; V71-L75 PolarHBondContact O-N 2.86Å; V71-L75 VanDerWaalsContact O-N 3.08Å; V71-I230 HydrophobicContact CG1-CG2 4.38Å; V71-V231 HydrophobicContact CG1-CG2 3.63Å |
| 72 | V | 82.6 | Confident | 73.2 | Confident | 40 Ų | 40 | 30.5 Ų | 30.5 | 24% | 0.242 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -63.2 | -50 | -178.9 | 173.8 | 0 | 0 | 0 | 0 | 111.1 | L68 L70 M76 I230 S234 | L68-V72 HydrophobicContact CD1-CG2 4.14Å; L68-V72 VanDerWaalsContact O-CG2 3.31Å; L68-V72 WeakPolarHBondContact O-CG2 3.32Å; L68-V72 PolarHBondContact O-N 2.95Å; L68-V72 VanDerWaalsContact O-N 3.16Å; L70-V72 PolarHBondContact O-N 2.85Å; V72-M76 HydrophobicContact CG1-SD 3.71Å; V72-M76 VanDerWaalsContact O-CB 3.26Å; V72-M76 WeakPolarHBondContact O-CB 3.44Å; V72-M76 WeakPolarHBondContact O-CG 3.42Å; V72-M76 PolarHBondContact O-N 2.93Å; V72-M76 VanDerWaalsContact O-N 3.14Å; V72-I230 HydrophobicContact CG2-CG2 3.46Å; V72-I230 VanDerWaalsContact CG2-CG2 3.46Å; V72-S234 WeakPolarHBondContact CA-OG 3.35Å |
| 73 | S | 80.9 | Confident | 72.6 | Confident | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -71.9 | -40.1 | -175 | 65 | 0 | 0 | 0 | 0 | 113 | P69 L70 S77 C255 N259 | P69-S73 WeakPolarHBondContact O-CB 3.35Å; P69-S73 PolarHBondContact O-N 3.09Å; P69-S73 VanDerWaalsContact O-N 3.13Å; P69-S73 PolarHBondContact O-OG 3.39Å; L70-S73 PolarHBondContact O-N 3.12Å; L70-S73 PolarHBondContact O-OG 3.4Å; S73-S77 VanDerWaalsContact O-CB 3.31Å; S73-S77 WeakPolarHBondContact O-CB 3.18Å; S73-S77 PolarHBondContact O-N 3.37Å; S73-S77 VanDerWaalsContact O-N 3.07Å; S73-S77 PolarHBondContact O-OG 3.09Å; S73-C255 WeakPolarHBondContact CB-O 3.34Å; S73-N259 WeakPolarHBondContact OG-CA 3.43Å; S73-N259 WeakPolarHBondContact OG-CB 3.48Å |
| 74 | S | 73 | Confident | 72.2 | Confident | 6 Ų | 6 | 33 Ų | 33 | 4% | 0.042 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -68.6 | -45.5 | 179.2 | 63.1 | 0 | 0 | 0 | 0 | 112.3 | L70 V71 S77 G78 | L70-S74 WeakPolarHBondContact O-CB 3.21Å; L70-S74 PolarHBondContact O-N 2.88Å; L70-S74 PolarHBondContact O-OG 3.35Å; V71-S74 PolarHBondContact O-OG 2.99Å; S74-S77 PolarHBondContact O-OG 2.91Å; S74-G78 WeakPolarHBondContact O-CA 3.44Å; S74-G78 PolarHBondContact O-N 3.28Å |
| 75 | L | 72.6 | Confident | 71.7 | Confident | 5 Ų | 5 | 38 Ų | 38 | 3% | 0.026 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -68.2 | -43.9 | 179 | -69.9 | 176.9 | 0 | 0 | 0 | 112.1 | V71 L79 V231 I422 | V71-L75 HydrophobicContact CG1-CD1 3.68Å; V71-L75 HydrophobicContact CG1-CG 4.45Å; V71-L75 VanDerWaalsContact O-CB 3.27Å; V71-L75 WeakPolarHBondContact O-CB 3.38Å; V71-L75 VanDerWaalsContact O-CG 3.27Å; V71-L75 WeakPolarHBondContact O-CG 3.28Å; V71-L75 PolarHBondContact O-N 2.86Å; V71-L75 VanDerWaalsContact O-N 3.08Å; L75-L79 WeakPolarHBondContact O-CB 3.38Å; L75-L79 WeakPolarHBondContact O-CG 3.48Å; L75-L79 PolarHBondContact O-N 3.25Å; L75-V231 HydrophobicContact CD1-CB 3.99Å; L75-V231 HydrophobicContact CD1-CG1 3.78Å; L75-V231 HydrophobicContact CD1-CG2 3.92Å; L75-I422 HydrophobicContact CD2-CB 4.4Å; L75-I422 HydrophobicContact CD2-CG2 3.62Å |
| 76 | M | 83.4 | Confident | 70 | Confident | 15 Ų | 15 | 38.5 Ų | 38.5 | 7% | 0.074 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -63.2 | -46.9 | 179.2 | -73.3 | 178.5 | 64.7 | 0 | 0 | 111.4 | V72 A80 S234 M237 G238 L241 L251 C255 | V72-M76 HydrophobicContact CG1-SD 3.71Å; V72-M76 VanDerWaalsContact O-CB 3.26Å; V72-M76 WeakPolarHBondContact O-CB 3.44Å; V72-M76 WeakPolarHBondContact O-CG 3.42Å; V72-M76 PolarHBondContact O-N 2.93Å; V72-M76 VanDerWaalsContact O-N 3.14Å; M76-A80 WeakPolarHBondContact O-CB 3.43Å; M76-A80 PolarHBondContact O-N 3.45Å; M76-A80 VanDerWaalsContact O-N 3.1Å; M76-S234 WeakPolarHBondContact CG-O 3.49Å; M76-M237 HydrophobicContact CE-CB 4.32Å; M76-M237 HydrophobicContact CE-CG 3.61Å; M76-M237 HydrophobicContact CG-CB 4.49Å; M76-M237 HydrophobicContact SD-CG 4.45Å; M76-G238 WeakPolarHBondContact O-CA 3.29Å; M76-L241 HydrophobicContact CE-CD1 3.6Å; M76-L251 HydrophobicContact CE-CD2 4.24Å; M76-L251 HydrophobicContact CE-CG 4.43Å; M76-C255 HydrophobicContact CB-CB 4.38Å |
| 77 | S | 77.3 | Confident | 69.4 | Low | 10 Ų | 10 | 39.3 Ų | 39.3 | 7% | 0.07 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -71.8 | -39.3 | 179.2 | 60.1 | 0 | 0 | 0 | 0 | 113 | S73 S74 A80 A81 | S73-S77 VanDerWaalsContact O-CB 3.31Å; S73-S77 WeakPolarHBondContact O-CB 3.18Å; S73-S77 PolarHBondContact O-N 3.37Å; S73-S77 VanDerWaalsContact O-N 3.07Å; S73-S77 PolarHBondContact O-OG 3.09Å; S74-S77 PolarHBondContact O-OG 2.91Å; S77-A80 PolarHBondContact O-N 3.36Å; S77-A81 PolarHBondContact O-N 3.42Å; S77-A81 VanDerWaalsContact O-N 3.14Å |
| 78 | G | 71.3 | Confident | 69.1 | Low | 20 Ų | 20 | 42.6 Ų | 42.6 | 21% | 0.206 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -63.7 | -46 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | S74 | S74-G78 WeakPolarHBondContact O-CA 3.44Å; S74-G78 PolarHBondContact O-N 3.28Å |
| 79 | L | 75.5 | Confident | 69.1 | Low | 21 Ų | 21 | 46.2 Ų | 46.2 | 11% | 0.11 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -79.9 | -25 | 178.6 | -62.3 | -173.8 | 0 | 0 | 0 | 113.5 | L75 A81 L82 A235 I239 I381 | L75-L79 WeakPolarHBondContact O-CB 3.38Å; L75-L79 WeakPolarHBondContact O-CG 3.48Å; L75-L79 PolarHBondContact O-N 3.25Å; L79-A81 VanDerWaalsContact C-N 3.34Å; L79-L82 HydrophobicContact CD2-CD1 3.84Å; L79-L82 WeakPolarHBondContact O-CB 3.39Å; L79-L82 PolarHBondContact O-N 2.73Å; L79-A235 VanDerWaalsContact CD1-CA 3.45Å; L79-A235 HydrophobicContact CD1-CB 3.5Å; L79-A235 WeakPolarHBondContact CD1-O 3.28Å; L79-I239 HydrophobicContact CB-CG1 4.04Å; L79-I239 HydrophobicContact CD1-CD1 4.2Å; L79-I239 HydrophobicContact CD1-CG1 4.01Å; L79-I381 HydrophobicContact CD2-CD1 3.82Å |
| 80 | A | 77.6 | Confident | 69.2 | Low | 10 Ų | 10 | 44.8 Ų | 44.8 | 8% | 0.083 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -72.8 | -26.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | M76 S77 L82 G238 L241 G242 V252 | M76-A80 WeakPolarHBondContact O-CB 3.43Å; M76-A80 PolarHBondContact O-N 3.45Å; M76-A80 VanDerWaalsContact O-N 3.1Å; S77-A80 PolarHBondContact O-N 3.36Å; A80-L82 PolarHBondContact O-N 2.97Å; A80-G238 WeakPolarHBondContact CA-O 3.43Å; A80-G238 VanDerWaalsContact CB-O 3.29Å; A80-G238 WeakPolarHBondContact CB-O 3.36Å; A80-G238 PolarHBondContact N-O 2.94Å; A80-L241 HydrophobicContact CB-CB 4.13Å; A80-G242 WeakPolarHBondContact O-CA 3.46Å; A80-V252 HydrophobicContact CB-CB 4.41Å; A80-V252 HydrophobicContact CB-CG1 4.07Å; A80-V252 HydrophobicContact CB-CG2 3.43Å; A80-V252 VanDerWaalsContact CB-CG2 3.43Å |
| 81 | A | 67.1 | Low | 69.5 | Low | 60 Ų | 60 | 44.5 Ų | 44.5 | 50% | 0.496 | 26% | 0.259 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.1 | -10.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | S77 L79 D83 | S77-A81 PolarHBondContact O-N 3.42Å; S77-A81 VanDerWaalsContact O-N 3.14Å; L79-A81 VanDerWaalsContact C-N 3.34Å; A81-D83 PolarHBondContact O-N 3.28Å |
| 82 | L | 65.1 | Low | 70 | Confident | 40 Ų | 40 | 49.9 Ų | 49.9 | 21% | 0.209 | 29% | 0.287 | C | S | . | . | S | Bend | trans | -74.7 | 89.8 | 174.5 | -61.5 | 172.4 | 0 | 0 | 0 | 109.6 | L79 A80 A84 V95 F373 V377 | L79-L82 HydrophobicContact CD2-CD1 3.84Å; L79-L82 WeakPolarHBondContact O-CB 3.39Å; L79-L82 PolarHBondContact O-N 2.73Å; A80-L82 PolarHBondContact O-N 2.97Å; L82-A84 PolarHBondContact O-N 2.84Å; L82-V95 HydrophobicContact CD1-CG2 3.97Å; L82-V95 HydrophobicContact CD2-CG2 4.24Å; L82-F373 HydrophobicContact CD2-CZ 4.12Å; L82-V377 HydrophobicContact CD2-CG1 4.27Å; L82-V377 HydrophobicContact CD2-CG2 4.25Å |
| 83 | D | 57.1 | Low | 70.3 | Confident | 94 Ų | 94 | 50.1 Ų | 50.1 | 50% | 0.503 | 29% | 0.287 | S | S | . | . | trans | -63 | 123.5 | -177.2 | -168.2 | 1.4 | 0 | 0 | 0 | 112.5 | A81 K85 | A81-D83 PolarHBondContact O-N 3.28Å; D83-K85 PolarHBondContact OD1-N 3.47Å | ||
| 84 | A | 53.8 | Low | 70.6 | Confident | 40 Ų | 40 | 50.1 Ų | 50.1 | 33% | 0.331 | 29% | 0.287 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.6 | -15.3 | -174.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | L82 R243 | L82-A84 PolarHBondContact O-N 2.84Å; A84-R243 HydrophobicContact CB-CG 4.41Å |
| 85 | K | 51.7 | Low | 71.2 | Confident | 193 Ų | 193 | 51.2 Ų | 51.2 | 84% | 0.839 | 29% | 0.293 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.8 | -27.4 | -166 | -87.6 | -178.1 | 175.6 | 178.7 | 0 | 117.6 | D83 | D83-K85 PolarHBondContact OD1-N 3.47Š|
| 86 | C | 44.3 | Very low | 72 | Confident | 127 Ų | 127 | 54.1 Ų | 54.1 | 86% | 0.858 | 31% | 0.313 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -124 | -13.7 | 177.4 | -78.5 | 0 | 0 | 0 | 0 | 115.2 | ||
| 87 | S | 55.9 | Low | 72.4 | Confident | 28 Ų | 28 | 54.4 Ų | 54.4 | 20% | 0.196 | 31% | 0.314 | C | S | . | . | S | Bend | trans | -129.6 | 19.9 | -175 | -161.4 | 0 | 0 | 0 | 0 | 113 | R89 L90 G91 | S87-R89 VanDerWaalsContact C-N 3.27Å; S87-R89 PolarHBondContact O-N 3.3Å; S87-L90 PolarHBondContact O-N 3.13Å; S87-G91 PolarHBondContact O-N 3.19Å |
| 88 | S | 62.6 | Low | 73.2 | Confident | 71 Ų | 71 | 54 Ų | 54 | 50% | 0.497 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -61.3 | -34.8 | -173.5 | 61.4 | 0 | 0 | 0 | 0 | 112.9 | L92 | S88-L92 WeakPolarHBondContact O-CB 3.48Å; S88-L92 PolarHBondContact O-N 3.23Å |
| 89 | R | 77.6 | Confident | 74.1 | Confident | 133 Ų | 133 | 56.5 Ų | 56.5 | 50% | 0.502 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -74.1 | -47.9 | 178.6 | -173.4 | 176 | 167.3 | -148.5 | -12.5 | 112.6 | S87 G91 I93 D485 | S87-R89 VanDerWaalsContact C-N 3.27Å; S87-R89 PolarHBondContact O-N 3.3Å; R89-G91 VanDerWaalsContact C-N 3.32Å; R89-I93 HydrophobicContact CG-CD1 3.75Å; R89-I93 HydrophobicContact CG-CG1 4.48Å; R89-I93 WeakPolarHBondContact O-CB 3.33Å; R89-I93 WeakPolarHBondContact O-CD1 3.36Å; R89-I93 WeakPolarHBondContact O-CG1 3.34Å; R89-I93 PolarHBondContact O-N 3.15Å; R89-D485 IonicContact CZ-OD1 2.97Å; R89-D485 IonicContact CZ-OD2 2.71Å; R89-D485 IonicContact NE-OD2 3.26Å; R89-D485 VanDerWaalsContact NH1-CG 3.32Å; R89-D485 IonicContact NH1-OD1 3.88Å; R89-D485 PolarHBondContact NH1-OD1 2.95Å; R89-D485 IonicContact NH1-OD2 3.87Å; R89-D485 PolarHBondContact NH1-OD2 3Å; R89-D485 IonicContact NH2-OD2 3.99Å |
| 90 | L | 82.1 | Confident | 74.9 | Confident | 10 Ų | 10 | 62.7 Ų | 62.7 | 5% | 0.052 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -60.8 | -45.9 | 175.6 | 177.5 | 71.2 | 0 | 0 | 0 | 110.1 | S87 T94 F373 M478 C482 F486 | S87-L90 PolarHBondContact O-N 3.13Å; L90-T94 VanDerWaalsContact O-CB 3.25Å; L90-T94 WeakPolarHBondContact O-CB 3.27Å; L90-T94 PolarHBondContact O-N 2.93Å; L90-T94 PolarHBondContact O-OG1 3.01Å; L90-F373 HydrophobicContact CD2-CB 4.17Å; L90-F373 HydrophobicContact CD2-CD1 3.58Å; L90-F373 HydrophobicContact CD2-CE1 4.19Å; L90-F373 HydrophobicContact CD2-CG 3.91Å; L90-F373 HydrophobicContact CG-CD1 3.93Å; L90-F373 HydrophobicContact CG-CE1 4.12Å; L90-M478 HydrophobicContact CD1-CB 3.91Å; L90-M478 HydrophobicContact CD1-CG 4.36Å; L90-C482 HydrophobicContact CD1-CB 4.2Å; L90-C482 VanDerWaalsContact CD1-SG 3.57Å; L90-F486 HydrophobicContact CD2-CZ 4.09Å |
| 91 | G | 78.3 | Confident | 75.8 | Confident | 8 Ų | 8 | 62.2 Ų | 62.2 | 8% | 0.082 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -58.5 | -52.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | S87 R89 I93 T94 V95 F373 | S87-G91 PolarHBondContact O-N 3.19Å; R89-G91 VanDerWaalsContact C-N 3.32Å; G91-I93 PolarHBondContact O-N 3.41Å; G91-T94 PolarHBondContact O-N 3.33Å; G91-V95 WeakPolarHBondContact O-CG2 3.47Å; G91-V95 PolarHBondContact O-N 2.81Å; G91-F373 VanDerWaalsContact CA-CZ 3.49Å |
| 92 | L | 81.5 | Confident | 77.1 | Confident | 117 Ų | 117 | 59.5 Ų | 59.5 | 61% | 0.613 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -61.6 | -46.5 | -179.3 | -175.4 | 65.7 | 0 | 0 | 0 | 111.6 | S88 T94 V95 S96 | S88-L92 WeakPolarHBondContact O-CB 3.48Å; S88-L92 PolarHBondContact O-N 3.23Å; L92-T94 VanDerWaalsContact C-N 3.31Å; L92-T94 PolarHBondContact O-N 3.26Å; L92-V95 PolarHBondContact O-N 3.49Å; L92-S96 VanDerWaalsContact O-CB 3.29Å; L92-S96 WeakPolarHBondContact O-CB 3.4Å; L92-S96 PolarHBondContact O-N 3.05Å; L92-S96 PolarHBondContact O-OG 2.84Å |
| 93 | I | 87.6 | Confident | 78.5 | Confident | 45 Ų | 45 | 61.4 Ų | 61.4 | 23% | 0.231 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -63.7 | -40.4 | 178.7 | -62.5 | 168.8 | 0 | 0 | 0 | 110.5 | R89 G91 Y97 M478 I481 | R89-I93 HydrophobicContact CG-CD1 3.75Å; R89-I93 HydrophobicContact CG-CG1 4.48Å; R89-I93 WeakPolarHBondContact O-CB 3.33Å; R89-I93 WeakPolarHBondContact O-CD1 3.36Å; R89-I93 WeakPolarHBondContact O-CG1 3.34Å; R89-I93 PolarHBondContact O-N 3.15Å; G91-I93 PolarHBondContact O-N 3.41Å; I93-Y97 VanDerWaalsContact O-CB 3.26Å; I93-Y97 WeakPolarHBondContact O-CB 3.43Å; I93-Y97 PolarHBondContact O-N 2.95Å; I93-M478 HydrophobicContact CB-SD 4.24Å; I93-M478 HydrophobicContact CG2-CE 3.94Å; I93-M478 HydrophobicContact CG2-SD 3.64Å; I93-I481 HydrophobicContact CD1-CG2 4.15Å; I93-I481 HydrophobicContact CG2-CD1 4.28Å |
| 94 | T | 88.1 | Confident | 80.4 | Confident | 0 Ų | 0 | 58.3 Ų | 58.3 | 0% | 0 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -63.5 | -50.4 | 178.5 | -58 | 0 | 0 | 0 | 0 | 111.6 | L90 G91 L92 Y97 Y98 V374 M478 | L90-T94 VanDerWaalsContact O-CB 3.25Å; L90-T94 WeakPolarHBondContact O-CB 3.27Å; L90-T94 PolarHBondContact O-N 2.93Å; L90-T94 PolarHBondContact O-OG1 3.01Å; G91-T94 PolarHBondContact O-N 3.33Å; L92-T94 VanDerWaalsContact C-N 3.31Å; L92-T94 PolarHBondContact O-N 3.26Å; T94-Y97 WeakPolarHBondContact O-CB 3.46Å; T94-Y97 PolarHBondContact O-N 2.87Å; T94-Y98 HydrophobicContact CG2-CD2 3.9Å; T94-Y98 HydrophobicContact CG2-CE1 4.44Å; T94-Y98 HydrophobicContact CG2-CE2 3.39Å; T94-Y98 VanDerWaalsContact O-CG 3.32Å; T94-Y98 PolarHBondContact O-N 2.98Å; T94-V374 HydrophobicContact CG2-CG1 4Å; T94-V374 HydrophobicContact CG2-CG2 4.29Å; T94-M478 WeakPolarHBondContact OG1-CG 3.14Å; T94-M478 PolarHBondContact OG1-SD 2.85Å |
| 95 | V | 85.1 | Confident | 82.5 | Confident | 29 Ų | 29 | 56.4 Ų | 56.4 | 18% | 0.176 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -64.9 | -43.5 | 179.3 | 173.1 | 0 | 0 | 0 | 0 | 111.1 | L82 G91 L92 Y97 Y98 L99 | L82-V95 HydrophobicContact CD1-CG2 3.97Å; L82-V95 HydrophobicContact CD2-CG2 4.24Å; G91-V95 WeakPolarHBondContact O-CG2 3.47Å; G91-V95 PolarHBondContact O-N 2.81Å; L92-V95 PolarHBondContact O-N 3.49Å; V95-Y97 VanDerWaalsContact C-N 3.3Å; V95-Y97 PolarHBondContact O-N 3.36Å; V95-Y98 PolarHBondContact O-N 3.47Å; V95-L99 HydrophobicContact CG1-CD1 4.1Å; V95-L99 HydrophobicContact CG1-CG 4.37Å; V95-L99 WeakPolarHBondContact O-CG 3.29Å; V95-L99 PolarHBondContact O-N 2.83Å |
| 96 | S | 88.9 | Confident | 84.7 | Confident | 65 Ų | 65 | 47.2 Ų | 47.2 | 46% | 0.455 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -61.2 | -38.9 | 175.4 | -66.8 | 0 | 0 | 0 | 0 | 112.3 | L92 W100 | L92-S96 VanDerWaalsContact O-CB 3.29Å; L92-S96 WeakPolarHBondContact O-CB 3.4Å; L92-S96 PolarHBondContact O-N 3.05Å; L92-S96 PolarHBondContact O-OG 2.84Å; S96-W100 WeakPolarHBondContact O-CB 3.37Å; S96-W100 PolarHBondContact O-N 2.96Å; S96-W100 VanDerWaalsContact O-N 3.09Å |
| 97 | Y | 93.3 | Very high | 87.2 | Confident | 21 Ų | 21 | 44.4 Ų | 44.4 | 8% | 0.082 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -63.2 | -48.4 | 174.4 | 177.6 | -90.1 | 0 | 0 | 0 | 111.3 | I93 T94 V95 W100 T101 I324 A474 I477 M478 | I93-Y97 VanDerWaalsContact O-CB 3.26Å; I93-Y97 WeakPolarHBondContact O-CB 3.43Å; I93-Y97 PolarHBondContact O-N 2.95Å; T94-Y97 WeakPolarHBondContact O-CB 3.46Å; T94-Y97 PolarHBondContact O-N 2.87Å; V95-Y97 VanDerWaalsContact C-N 3.3Å; V95-Y97 PolarHBondContact O-N 3.36Å; Y97-W100 WeakPolarHBondContact O-CB 3.41Å; Y97-W100 PolarHBondContact O-N 3.34Å; Y97-T101 HydrophobicContact CD1-CG2 3.94Å; Y97-T101 HydrophobicContact CD2-CG2 4.3Å; Y97-T101 HydrophobicContact CE1-CG2 3.43Å; Y97-T101 VanDerWaalsContact CE1-CG2 3.43Å; Y97-T101 HydrophobicContact CE2-CG2 3.87Å; Y97-T101 HydrophobicContact CG-CG2 4.33Å; Y97-T101 WeakPolarHBondContact O-CG2 3.48Å; Y97-T101 PolarHBondContact O-N 3.02Å; Y97-T101 PolarHBondContact O-OG1 3.01Å; Y97-I324 HydrophobicContact CE2-CD1 4.34Å; Y97-A474 HydrophobicContact CD1-CB 3.79Å; Y97-A474 HydrophobicContact CE1-CB 3.52Å; Y97-I477 HydrophobicContact CE1-CD1 4.48Å; Y97-I477 HydrophobicContact CE2-CD1 3.62Å; Y97-I477 WeakPolarHBondContact OH-CD1 3.45Å; Y97-M478 VanDerWaalsContact CB-CE 3.48Å; Y97-M478 HydrophobicContact CD1-CE 4.21Å; Y97-M478 HydrophobicContact CD2-CE 4.35Å; Y97-M478 HydrophobicContact CG-CE 3.76Å |
| 98 | Y | 92.1 | Very high | 89.1 | Confident | 1 Ų | 1 | 43.7 Ų | 43.7 | 0% | 0.004 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -60.1 | -47.4 | 178.4 | -67 | -28.6 | 0 | 0 | 0 | 112.9 | T94 V95 W100 T101 T102 V374 V377 G378 I381 N382 A474 | T94-Y98 HydrophobicContact CG2-CD2 3.9Å; T94-Y98 HydrophobicContact CG2-CE1 4.44Å; T94-Y98 HydrophobicContact CG2-CE2 3.39Å; T94-Y98 VanDerWaalsContact O-CG 3.32Å; T94-Y98 PolarHBondContact O-N 2.98Å; V95-Y98 PolarHBondContact O-N 3.47Å; Y98-W100 PolarHBondContact O-N 2.87Å; Y98-T101 PolarHBondContact O-N 3.31Å; Y98-T101 PolarHBondContact O-OG1 3.36Å; Y98-T101 VanDerWaalsContact O-OG1 3.06Å; Y98-T102 WeakPolarHBondContact O-CB 3.3Å; Y98-T102 PolarHBondContact O-N 2.87Å; Y98-T102 PolarHBondContact O-OG1 3.32Å; Y98-V374 WeakPolarHBondContact OH-CG1 3.49Å; Y98-V374 PolarHBondContact OH-O 3.48Å; Y98-V377 HydrophobicContact CE2-CG1 4.19Å; Y98-G378 VanDerWaalsContact CE2-CA 3.48Å; Y98-G378 WeakPolarHBondContact OH-CA 3.42Å; Y98-I381 HydrophobicContact CD2-CG2 4.41Å; Y98-N382 HydrophobicContact CD1-CB 3.45Å; Y98-N382 VanDerWaalsContact CD1-CB 3.45Å; Y98-N382 WeakPolarHBondContact CD1-OD1 3.29Å; Y98-N382 HydrophobicContact CD2-CB 3.88Å; Y98-N382 HydrophobicContact CE1-CB 3.68Å; Y98-N382 WeakPolarHBondContact CE1-ND2 3.28Å; Y98-N382 HydrophobicContact CE2-CB 4.1Å; Y98-N382 HydrophobicContact CG-CB 3.55Å; Y98-A474 HydrophobicContact CD1-CB 4.22Å; Y98-A474 HydrophobicContact CE1-CB 3.37Å |
| 99 | L | 90.3 | Very high | 90.8 | Very high | 74 Ų | 74 | 40.3 Ų | 40.3 | 39% | 0.387 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -59.1 | -38.5 | 176.3 | -69 | 176.7 | 0 | 0 | 0 | 111.7 | V95 F103 I422 | V95-L99 HydrophobicContact CG1-CD1 4.1Å; V95-L99 HydrophobicContact CG1-CG 4.37Å; V95-L99 WeakPolarHBondContact O-CG 3.29Å; V95-L99 PolarHBondContact O-N 2.83Å; L99-F103 VanDerWaalsContact O-CB 3.26Å; L99-F103 WeakPolarHBondContact O-CB 3.4Å; L99-F103 PolarHBondContact O-N 2.9Å; L99-I422 HydrophobicContact CD2-CD1 3.64Å |
| 100 | W | 94.1 | Very high | 91.6 | Very high | 151 Ų | 151 | 34.8 Ų | 34.8 | 57% | 0.572 | 18% | 0.177 | S | C | * | . | H | α-helix | trans | -68.7 | -46 | 177.2 | -178.5 | -108.3 | 0 | 0 | 0 | 112.6 | S96 Y97 Y98 T102 F103 V104 | S96-W100 WeakPolarHBondContact O-CB 3.37Å; S96-W100 PolarHBondContact O-N 2.96Å; S96-W100 VanDerWaalsContact O-N 3.09Å; Y97-W100 WeakPolarHBondContact O-CB 3.41Å; Y97-W100 PolarHBondContact O-N 3.34Å; Y98-W100 PolarHBondContact O-N 2.87Å; W100-T102 PolarHBondContact O-N 3.25Å; W100-F103 HydrophobicContact CZ3-CD1 4.26Å; W100-F103 PolarHBondContact O-N 3.42Å; W100-V104 HydrophobicContact CD2-CG2 4.32Å; W100-V104 HydrophobicContact CZ2-CG2 4.09Å; W100-V104 VanDerWaalsContact O-CG2 3.31Å; W100-V104 WeakPolarHBondContact O-CG2 3.3Å; W100-V104 PolarHBondContact O-N 3.14Å |
| 101 | T | 95.6 | Very high | 92.3 | Very high | 0 Ų | 0 | 39.2 Ų | 39.2 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -65.9 | -40 | -179.5 | 56.4 | 0 | 0 | 0 | 0 | 112.1 | Y97 Y98 V104 A105 H312 L317 M320 N382 D384 | Y97-T101 HydrophobicContact CD1-CG2 3.94Å; Y97-T101 HydrophobicContact CD2-CG2 4.3Å; Y97-T101 HydrophobicContact CE1-CG2 3.43Å; Y97-T101 VanDerWaalsContact CE1-CG2 3.43Å; Y97-T101 HydrophobicContact CE2-CG2 3.87Å; Y97-T101 HydrophobicContact CG-CG2 4.33Å; Y97-T101 WeakPolarHBondContact O-CG2 3.48Å; Y97-T101 PolarHBondContact O-N 3.02Å; Y97-T101 PolarHBondContact O-OG1 3.01Å; Y98-T101 PolarHBondContact O-N 3.31Å; Y98-T101 PolarHBondContact O-OG1 3.36Å; Y98-T101 VanDerWaalsContact O-OG1 3.06Å; T101-V104 PolarHBondContact O-N 3.32Å; T101-A105 PolarHBondContact O-N 2.94Å; T101-H312 PolarHBondContact O-CE1 3.47Å; T101-L317 HydrophobicContact CG2-CD2 4.21Å; T101-M320 HydrophobicContact CG2-CE 3.36Å; T101-M320 HydrophobicContact CG2-SD 4.24Å; T101-N382 PolarHBondContact OG1-OD1 3.35Å; T101-D384 PolarHBondContact OG1-OD1 3.33Å |
| 102 | T | 94.9 | Very high | 93.1 | Very high | 3 Ų | 3 | 39.9 Ų | 39.9 | 2% | 0.018 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -66.6 | -43 | 176.8 | -59.4 | 0 | 0 | 0 | 0 | 111 | Y98 W100 V104 A105 V106 D384 A387 T418 S421 | Y98-T102 WeakPolarHBondContact O-CB 3.3Å; Y98-T102 PolarHBondContact O-N 2.87Å; Y98-T102 PolarHBondContact O-OG1 3.32Å; W100-T102 PolarHBondContact O-N 3.25Å; T102-V104 PolarHBondContact O-N 2.87Å; T102-A105 WeakPolarHBondContact O-CB 3.29Å; T102-A105 PolarHBondContact O-N 3.25Å; T102-A105 VanDerWaalsContact O-N 3.17Å; T102-V106 WeakPolarHBondContact O-CG2 3.19Å; T102-V106 PolarHBondContact O-N 2.81Å; T102-D384 WeakPolarHBondContact CA-OD1 3.3Å; T102-D384 WeakPolarHBondContact CB-OD1 3.08Å; T102-D384 PolarHBondContact N-OD1 3.1Å; T102-D384 VanDerWaalsContact N-OD1 3.07Å; T102-D384 PolarHBondContact OG1-OD1 3.31Å; T102-A387 HydrophobicContact CG2-CB 3.45Å; T102-A387 VanDerWaalsContact CG2-CB 3.45Å; T102-T418 HydrophobicContact CG2-CG2 4.03Å; T102-S421 WeakPolarHBondContact CG2-OG 3.45Å |
| 103 | F | 94.8 | Very high | 93.7 | Very high | 79 Ų | 79 | 34.3 Ų | 34.3 | 35% | 0.346 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -60.2 | -44.3 | 174.3 | -178.4 | -105.2 | 0 | 0 | 0 | 111.9 | L99 W100 A105 V106 I107 | L99-F103 VanDerWaalsContact O-CB 3.26Å; L99-F103 WeakPolarHBondContact O-CB 3.4Å; L99-F103 PolarHBondContact O-N 2.9Å; W100-F103 HydrophobicContact CZ3-CD1 4.26Å; W100-F103 PolarHBondContact O-N 3.42Å; F103-A105 VanDerWaalsContact C-N 3.32Å; F103-A105 PolarHBondContact O-N 2.87Å; F103-V106 WeakPolarHBondContact O-CB 3.49Å; F103-V106 PolarHBondContact O-N 3.49Å; F103-I107 HydrophobicContact CD1-CG1 4.38Å; F103-I107 HydrophobicContact CE1-CD1 4.39Å; F103-I107 HydrophobicContact CE1-CG1 3.99Å; F103-I107 HydrophobicContact CE2-CD1 4.36Å; F103-I107 HydrophobicContact CZ-CD1 3.98Å; F103-I107 HydrophobicContact CZ-CG1 4.06Å; F103-I107 WeakPolarHBondContact O-CG1 3.41Å; F103-I107 PolarHBondContact O-N 3.39Å |
| 104 | V | 96.8 | Very high | 93.9 | Very high | 30 Ų | 30 | 35 Ų | 35 | 18% | 0.182 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -60.6 | -41.2 | 174.5 | 171.2 | 0 | 0 | 0 | 0 | 111.4 | W100 T101 T102 V106 I107 V108 I316 | W100-V104 HydrophobicContact CD2-CG2 4.32Å; W100-V104 HydrophobicContact CZ2-CG2 4.09Å; W100-V104 VanDerWaalsContact O-CG2 3.31Å; W100-V104 WeakPolarHBondContact O-CG2 3.3Å; W100-V104 PolarHBondContact O-N 3.14Å; T101-V104 PolarHBondContact O-N 3.32Å; T102-V104 PolarHBondContact O-N 2.87Å; V104-V106 VanDerWaalsContact C-N 3.32Å; V104-V106 PolarHBondContact O-N 3.18Å; V104-I107 PolarHBondContact O-N 3.26Å; V104-V108 HydrophobicContact CG1-CG2 4.43Å; V104-V108 VanDerWaalsContact O-CG2 3.23Å; V104-V108 WeakPolarHBondContact O-CG2 3.33Å; V104-V108 PolarHBondContact O-N 2.94Å; V104-I316 HydrophobicContact CG1-CD1 4.44Å; V104-I316 HydrophobicContact CG1-CG2 3.88Å |
| 105 | A | 97.4 | Very high | 94.1 | Very high | 0 Ų | 0 | 40.8 Ų | 40.8 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -60.5 | -41.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | T101 T102 F103 V108 G109 D384 L388 | T101-A105 PolarHBondContact O-N 2.94Å; T102-A105 WeakPolarHBondContact O-CB 3.29Å; T102-A105 PolarHBondContact O-N 3.25Å; T102-A105 VanDerWaalsContact O-N 3.17Å; F103-A105 VanDerWaalsContact C-N 3.32Å; F103-A105 PolarHBondContact O-N 2.87Å; A105-V108 WeakPolarHBondContact O-CB 3.5Å; A105-V108 PolarHBondContact O-N 3.24Å; A105-G109 PolarHBondContact O-N 2.84Å; A105-D384 HydrophobicContact CB-CB 3.99Å; A105-D384 WeakPolarHBondContact CB-O 3.14Å; A105-L388 HydrophobicContact CB-CB 4.23Å; A105-L388 WeakPolarHBondContact O-CD1 3.36Å; A105-L388 WeakPolarHBondContact O-CG 3.25Å |
| 106 | V | 96.9 | Very high | 94.4 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -63 | -46.9 | 175.9 | 168.6 | 0 | 0 | 0 | 0 | 111.4 | T102 F103 V104 V108 G109 I110 A387 A391 S414 A417 | T102-V106 WeakPolarHBondContact O-CG2 3.19Å; T102-V106 PolarHBondContact O-N 2.81Å; F103-V106 WeakPolarHBondContact O-CB 3.49Å; F103-V106 PolarHBondContact O-N 3.49Å; V104-V106 VanDerWaalsContact C-N 3.32Å; V104-V106 PolarHBondContact O-N 3.18Å; V106-V108 VanDerWaalsContact C-N 3.29Å; V106-V108 PolarHBondContact O-N 2.9Å; V106-G109 WeakPolarHBondContact O-CA 3.25Å; V106-G109 PolarHBondContact O-N 2.82Å; V106-G109 VanDerWaalsContact O-N 3.1Å; V106-I110 HydrophobicContact CG1-CD1 3.87Å; V106-I110 HydrophobicContact CG1-CG1 4.43Å; V106-I110 WeakPolarHBondContact O-CG1 3.24Å; V106-I110 PolarHBondContact O-N 2.99Å; V106-A387 HydrophobicContact CG2-CB 3.47Å; V106-A387 VanDerWaalsContact CG2-CB 3.47Å; V106-A391 HydrophobicContact CG1-CB 3.99Å; V106-S414 WeakPolarHBondContact CG1-OG 3.05Å; V106-A417 HydrophobicContact CG2-CB 4.19Å |
| 107 | I | 96.8 | Very high | 94.5 | Very high | 67 Ų | 67 | 43.2 Ų | 43.2 | 34% | 0.344 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -59.4 | -42.4 | 176.5 | -64.1 | -58.5 | 0 | 0 | 0 | 111 | F103 V104 G109 I110 M111 | F103-I107 HydrophobicContact CD1-CG1 4.38Å; F103-I107 HydrophobicContact CE1-CD1 4.39Å; F103-I107 HydrophobicContact CE1-CG1 3.99Å; F103-I107 HydrophobicContact CE2-CD1 4.36Å; F103-I107 HydrophobicContact CZ-CD1 3.98Å; F103-I107 HydrophobicContact CZ-CG1 4.06Å; F103-I107 WeakPolarHBondContact O-CG1 3.41Å; F103-I107 PolarHBondContact O-N 3.39Å; V104-I107 PolarHBondContact O-N 3.26Å; I107-G109 VanDerWaalsContact C-N 3.33Å; I107-G109 PolarHBondContact O-N 2.97Å; I107-I110 PolarHBondContact O-N 3.36Å; I107-M111 HydrophobicContact CG2-CG 4.42Å; I107-M111 HydrophobicContact CG2-SD 4.24Å; I107-M111 WeakPolarHBondContact O-CB 3.36Å; I107-M111 VanDerWaalsContact O-CG 3.31Å; I107-M111 WeakPolarHBondContact O-CG 3.31Å; I107-M111 PolarHBondContact O-N 3.02Å |
| 108 | V | 97.2 | Very high | 94.3 | Very high | 13 Ų | 13 | 42.2 Ų | 42.2 | 8% | 0.079 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -59.9 | -45 | 174.7 | 172 | 0 | 0 | 0 | 0 | 110.9 | V104 A105 V106 M111 M112 L311 I316 L388 | V104-V108 HydrophobicContact CG1-CG2 4.43Å; V104-V108 VanDerWaalsContact O-CG2 3.23Å; V104-V108 WeakPolarHBondContact O-CG2 3.33Å; V104-V108 PolarHBondContact O-N 2.94Å; A105-V108 WeakPolarHBondContact O-CB 3.5Å; A105-V108 PolarHBondContact O-N 3.24Å; V106-V108 VanDerWaalsContact C-N 3.29Å; V106-V108 PolarHBondContact O-N 2.9Å; V108-M111 PolarHBondContact O-N 3.45Å; V108-M112 HydrophobicContact CG1-CG 4.35Å; V108-M112 WeakPolarHBondContact O-CB 3.49Å; V108-M112 VanDerWaalsContact O-CG 3.28Å; V108-M112 WeakPolarHBondContact O-CG 3.21Å; V108-M112 PolarHBondContact O-N 2.92Å; V108-L311 HydrophobicContact CG1-CD2 3.93Å; V108-L311 HydrophobicContact CG1-CG 4.41Å; V108-I316 HydrophobicContact CG2-CD1 3.32Å; V108-L388 HydrophobicContact CB-CD1 4.41Å; V108-L388 HydrophobicContact CG1-CD1 4.14Å |
| 109 | G | 97 | Very high | 93.7 | Very high | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -56.8 | -51.2 | 175 | 0 | 0 | 0 | 0 | 0 | 112.6 | A105 V106 I107 M111 M112 V113 V392 | A105-G109 PolarHBondContact O-N 2.84Å; V106-G109 WeakPolarHBondContact O-CA 3.25Å; V106-G109 PolarHBondContact O-N 2.82Å; V106-G109 VanDerWaalsContact O-N 3.1Å; I107-G109 VanDerWaalsContact C-N 3.33Å; I107-G109 PolarHBondContact O-N 2.97Å; G109-M111 VanDerWaalsContact C-N 3.33Å; G109-M111 PolarHBondContact O-N 3.14Å; G109-M112 PolarHBondContact O-N 3.37Å; G109-V113 WeakPolarHBondContact O-CG1 3.43Å; G109-V113 PolarHBondContact O-N 3.48Å; G109-V392 WeakPolarHBondContact O-CG2 3.31Å |
| 110 | I | 96 | Very high | 92.9 | Very high | 17 Ų | 17 | 39.6 Ų | 39.6 | 9% | 0.087 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -59.7 | -43.6 | 178.5 | -65.7 | 172.2 | 0 | 0 | 0 | 110.8 | V106 I107 V113 S114 A391 I395 I410 | V106-I110 HydrophobicContact CG1-CD1 3.87Å; V106-I110 HydrophobicContact CG1-CG1 4.43Å; V106-I110 WeakPolarHBondContact O-CG1 3.24Å; V106-I110 PolarHBondContact O-N 2.99Å; I107-I110 PolarHBondContact O-N 3.36Å; I110-V113 WeakPolarHBondContact O-CG1 3.4Å; I110-S114 VanDerWaalsContact O-CB 3.24Å; I110-S114 WeakPolarHBondContact O-CB 3.13Å; I110-S114 PolarHBondContact O-N 2.91Å; I110-S114 PolarHBondContact O-OG 3.47Å; I110-A391 HydrophobicContact CG1-CB 3.95Å; I110-I395 HydrophobicContact CB-CD1 4.26Å; I110-I395 HydrophobicContact CG1-CD1 3.91Å; I110-I395 HydrophobicContact CG2-CD1 4.03Å; I110-I410 HydrophobicContact CD1-CG2 4.14Å; I110-I410 HydrophobicContact CG2-CG2 3.82Å |
| 111 | M | 95.6 | Very high | 91.1 | Very high | 104 Ų | 104 | 35.1 Ų | 35.1 | 51% | 0.512 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -62.2 | -46.2 | 176.3 | -73.8 | -176.2 | 72.6 | 0 | 0 | 111.6 | I107 V108 G109 S114 I115 | I107-M111 HydrophobicContact CG2-CG 4.42Å; I107-M111 HydrophobicContact CG2-SD 4.24Å; I107-M111 WeakPolarHBondContact O-CB 3.36Å; I107-M111 VanDerWaalsContact O-CG 3.31Å; I107-M111 WeakPolarHBondContact O-CG 3.31Å; I107-M111 PolarHBondContact O-N 3.02Å; V108-M111 PolarHBondContact O-N 3.45Å; G109-M111 VanDerWaalsContact C-N 3.33Å; G109-M111 PolarHBondContact O-N 3.14Å; M111-S114 PolarHBondContact O-N 2.91Å; M111-I115 WeakPolarHBondContact O-CB 3.41Å; M111-I115 WeakPolarHBondContact O-CD1 3.43Å; M111-I115 WeakPolarHBondContact O-CG1 3.41Å; M111-I115 PolarHBondContact O-N 2.66Å |
| 112 | M | 95 | Very high | 89.1 | Confident | 22 Ų | 22 | 37 Ų | 37 | 11% | 0.108 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -63.7 | -46.3 | -178.7 | -71.7 | -55.3 | 105 | 0 | 0 | 112.3 | V108 G109 S114 I115 I116 T304 F307 L311 | V108-M112 HydrophobicContact CG1-CG 4.35Å; V108-M112 WeakPolarHBondContact O-CB 3.49Å; V108-M112 VanDerWaalsContact O-CG 3.28Å; V108-M112 WeakPolarHBondContact O-CG 3.21Å; V108-M112 PolarHBondContact O-N 2.92Å; G109-M112 PolarHBondContact O-N 3.37Å; M112-S114 VanDerWaalsContact C-N 3.33Å; M112-S114 PolarHBondContact O-N 2.97Å; M112-I115 HydrophobicContact CE-CD1 4.27Å; M112-I115 PolarHBondContact O-N 2.97Å; M112-I116 WeakPolarHBondContact O-CB 3.34Å; M112-I116 WeakPolarHBondContact O-CG1 3.36Å; M112-I116 PolarHBondContact O-N 3.2Å; M112-T304 HydrophobicContact CB-CG2 4.02Å; M112-F307 HydrophobicContact CG-CD1 4.43Å; M112-F307 HydrophobicContact SD-CD1 3.47Å; M112-F307 WeakPolarHBondContact SD-CD1 3.34Å; M112-F307 HydrophobicContact SD-CE1 3.55Å; M112-F307 VanDerWaalsContact SD-CE1 3.55Å; M112-L311 HydrophobicContact CE-CD2 3.99Å; M112-L311 HydrophobicContact SD-CD2 4.32Å |
| 113 | V | 95.1 | Very high | 86.9 | Confident | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -70 | -30.8 | -179.9 | 70 | 0 | 0 | 0 | 0 | 112.7 | G109 I110 H117 P118 T304 V392 I395 Q399 | G109-V113 WeakPolarHBondContact O-CG1 3.43Å; G109-V113 PolarHBondContact O-N 3.48Å; I110-V113 WeakPolarHBondContact O-CG1 3.4Å; V113-H117 VanDerWaalsContact O-CA 3.28Å; V113-H117 WeakPolarHBondContact O-CA 3.47Å; V113-H117 PolarHBondContact O-N 3.24Å; V113-P118 HydrophobicContact CG2-CG 3.86Å; V113-P118 WeakPolarHBondContact O-CD 3.23Å; V113-T304 HydrophobicContact CB-CG2 4.15Å; V113-V392 HydrophobicContact CB-CB 4.45Å; V113-V392 HydrophobicContact CB-CG1 4.09Å; V113-V392 HydrophobicContact CB-CG2 4.33Å; V113-V392 HydrophobicContact CG2-CG1 4.14Å; V113-I395 HydrophobicContact CB-CG2 4.47Å; V113-I395 HydrophobicContact CG1-CB 3.77Å; V113-I395 HydrophobicContact CG1-CD1 3.58Å; V113-I395 HydrophobicContact CG1-CG1 4.25Å; V113-I395 HydrophobicContact CG1-CG2 3.73Å; V113-I395 HydrophobicContact CG2-CB 4.1Å; V113-I395 HydrophobicContact CG2-CG2 3.89Å; V113-Q399 PolarHBondContact O-NE2 3.42Å |
| 114 | S | 91.3 | Very high | 84.5 | Confident | 59 Ų | 59 | 45.9 Ų | 45.9 | 41% | 0.413 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -72 | -38 | 175.8 | -57.6 | 0 | 0 | 0 | 0 | 111.8 | I110 M111 M112 | I110-S114 VanDerWaalsContact O-CB 3.24Å; I110-S114 WeakPolarHBondContact O-CB 3.13Å; I110-S114 PolarHBondContact O-N 2.91Å; I110-S114 PolarHBondContact O-OG 3.47Å; M111-S114 PolarHBondContact O-N 2.91Å; M112-S114 VanDerWaalsContact C-N 3.33Å; M112-S114 PolarHBondContact O-N 2.97Å |
| 115 | I | 92.3 | Very high | 81.9 | Confident | 121 Ų | 121 | 52.6 Ų | 52.6 | 62% | 0.621 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -73.8 | -46.6 | 179.1 | -68.6 | 165.2 | 0 | 0 | 0 | 111.3 | M111 M112 | M111-I115 WeakPolarHBondContact O-CB 3.41Å; M111-I115 WeakPolarHBondContact O-CD1 3.43Å; M111-I115 WeakPolarHBondContact O-CG1 3.41Å; M111-I115 PolarHBondContact O-N 2.66Å; M112-I115 HydrophobicContact CE-CD1 4.27Å; M112-I115 PolarHBondContact O-N 2.97Å |
| 116 | I | 91.9 | Very high | 79.2 | Confident | 54 Ų | 54 | 59.8 Ų | 59.8 | 28% | 0.277 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -79.4 | -31.3 | -175.6 | -63.9 | 172.4 | 0 | 0 | 0 | 111.2 | M112 F300 T304 | M112-I116 WeakPolarHBondContact O-CB 3.34Å; M112-I116 WeakPolarHBondContact O-CG1 3.36Å; M112-I116 PolarHBondContact O-N 3.2Å; I116-F300 HydrophobicContact CG2-CD1 4.42Å; I116-T304 HydrophobicContact CD1-CG2 4.12Å; I116-T304 WeakPolarHBondContact CG2-OG1 3Å |
| 117 | H | 90.4 | Very high | 76.5 | Confident | 91 Ų | 91 | 64.7 Ų | 64.7 | 42% | 0.421 | 35% | 0.352 | S | S | . | . | trans | 51.2 | 55.8 | 179.2 | -147.9 | 92.6 | 0 | 0 | 0 | 113.9 | V113 G119 G120 A121 Q399 | V113-H117 VanDerWaalsContact O-CA 3.28Å; V113-H117 WeakPolarHBondContact O-CA 3.47Å; V113-H117 PolarHBondContact O-N 3.24Å; H117-G119 VanDerWaalsContact C-N 3.27Å; H117-G119 PolarHBondContact O-N 3.4Å; H117-G119 VanDerWaalsContact O-N 3.17Å; H117-G120 PolarHBondContact O-N 2.92Å; H117-A121 PolarHBondContact O-N 2.9Å; H117-Q399 PolarHBondContact CE1-NE2 3.37Å; H117-Q399 PolarHBondContact ND1-NE2 3.33Å | ||
| 118 | P | 87.9 | Confident | 73.9 | Confident | 0 Ų | 0 | 70 Ų | 70 | 0% | 0 | 38% | 0.375 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62 | -26.8 | -169.3 | 23.7 | -33.6 | 0 | 0 | 0 | 114.8 | V113 F300 F396 | V113-P118 HydrophobicContact CG2-CG 3.86Å; V113-P118 WeakPolarHBondContact O-CD 3.23Å; P118-F300 HydrophobicContact CB-CB 3.78Å; P118-F396 HydrophobicContact CB-CD2 4Å; P118-F396 HydrophobicContact CB-CE2 4.29Å; P118-F396 HydrophobicContact CG-CD2 3.87Å |
| 119 | G | 80.6 | Confident | 71.2 | Confident | 0 Ų | 0 | 76.9 Ų | 76.9 | 0% | 0 | 41% | 0.411 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.5 | -26.5 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | H117 K297 | H117-G119 VanDerWaalsContact C-N 3.27Å; H117-G119 PolarHBondContact O-N 3.4Å; H117-G119 VanDerWaalsContact O-N 3.17Å; G119-K297 WeakPolarHBondContact O-CD 3.24Å; G119-K297 WeakPolarHBondContact O-CE 3.35Å; G119-K297 PolarHBondContact O-NZ 2.77Å |
| 120 | G | 72.8 | Confident | 68.6 | Low | 20 Ų | 20 | 81.2 Ų | 81.2 | 21% | 0.206 | 44% | 0.442 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -93.1 | -13.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | H117 A122 Q123 | H117-G120 PolarHBondContact O-N 2.92Å; G120-A122 PolarHBondContact O-N 3.05Å; G120-Q123 PolarHBondContact O-N 3.41Å |
| 121 | A | 57.9 | Low | 66 | Low | 58 Ų | 58 | 82.9 Ų | 82.9 | 48% | 0.479 | 46% | 0.464 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.2 | -10.4 | -177.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | H117 F300 | H117-A121 PolarHBondContact O-N 2.9Å; A121-F300 HydrophobicContact CB-CD2 4.13Å; A121-F300 HydrophobicContact CB-CE2 4.38Å; A121-F300 HydrophobicContact CB-CG 4.44Å |
| 122 | A | 52.2 | Low | 63.6 | Low | 40 Ų | 40 | 85.1 Ų | 85.1 | 33% | 0.331 | 47% | 0.47 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -115.6 | 2.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | G120 A293 K297 | G120-A122 PolarHBondContact O-N 3.05Å; A122-A293 HydrophobicContact CB-CB 4.4Å; A122-K297 HydrophobicContact CB-CD 4.37Å; A122-K297 HydrophobicContact CB-CG 3.77Å |
| 123 | Q | 49.6 | Very low | 61.4 | Low | 59 Ų | 59 | 93 Ų | 93 | 28% | 0.276 | 51% | 0.506 | S | S | . | . | trans | -108.5 | 91.8 | 172.4 | -83.2 | 176.4 | -5.2 | 0 | 0 | 108.6 | G120 N402 | G120-Q123 PolarHBondContact O-N 3.41Å; Q123-N402 PolarHBondContact NE2-ND2 2.76Å; Q123-N402 PolarHBondContact NE2-OD1 3.49Å; Q123-N402 PolarHBondContact OE1-OD1 3.17Å | ||
| 124 | K | 43.7 | Very low | 59.5 | Low | 208 Ų | 208 | 95.1 Ų | 95.1 | 90% | 0.904 | 52% | 0.518 | S | S | * | . | S | Bend | trans | -112.6 | 0.9 | 163.1 | -115.2 | -177.1 | 179.8 | -177.1 | 0 | 113.5 | ||
| 125 | E | 41.4 | Very low | 57.8 | Low | 172 Ų | 172 | 94 Ų | 94 | 80% | 0.804 | 51% | 0.506 | S | S | * | . | S | Bend | trans | -145 | 131.2 | 177.2 | -61.7 | -179 | 171.8 | 0 | 0 | 106 | ||
| 126 | D | 41.9 | Very low | 56.6 | Low | 150 Ų | 150 | 91.6 Ų | 91.6 | 80% | 0.802 | 50% | 0.5 | S | S | * | . | trans | 81.8 | 71.8 | -179.9 | -49.7 | -23.3 | 0 | 0 | 0 | 117.8 | ||||
| 127 | S | 39.8 | Very low | 55.2 | Low | 104 Ų | 104 | 90.7 Ų | 90.7 | 73% | 0.727 | 50% | 0.499 | S | S | * | . | trans | -101 | 84.9 | 156 | -58.8 | 0 | 0 | 0 | 0 | 109 | D129 | S127-D129 PolarHBondContact O-N 3.26Š| ||
| 128 | E | 42.3 | Very low | 54.1 | Low | 178 Ų | 178 | 89.1 Ų | 89.1 | 83% | 0.832 | 50% | 0.501 | S | S | * | . | trans | -68.5 | 119.8 | 152.2 | -79 | -170.2 | 159.2 | 0 | 0 | 107.2 | S130 | E128-S130 PolarHBondContact O-N 3.35Š| ||
| 129 | D | 40.9 | Very low | 53.4 | Low | 157 Ų | 157 | 90.3 Ų | 90.3 | 84% | 0.84 | 51% | 0.508 | S | S | * | . | trans | -64.3 | 76.6 | -180 | -166.4 | 12.7 | 0 | 0 | 0 | 110.3 | S127 G131 | S127-D129 PolarHBondContact O-N 3.26Å; D129-G131 PolarHBondContact O-N 3.47Å | ||
| 130 | S | 41.4 | Very low | 52.8 | Low | 91 Ų | 91 | 91 Ų | 91 | 64% | 0.636 | 51% | 0.513 | S | S | * | . | trans | -76.6 | 74.2 | 167.2 | -77.3 | 0 | 0 | 0 | 0 | 108.1 | E128 K132 | E128-S130 PolarHBondContact O-N 3.35Å; S130-K132 PolarHBondContact O-N 3.47Å | ||
| 131 | G | 42 | Very low | 52.5 | Low | 53 Ų | 53 | 93.7 Ų | 93.7 | 55% | 0.546 | 52% | 0.522 | S | S | . | . | trans | -61.5 | 72.4 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | D129 H133 | D129-G131 PolarHBondContact O-N 3.47Å; G131-H133 PolarHBondContact O-N 3.2Å | ||
| 132 | K | 46.1 | Very low | 53.4 | Low | 150 Ų | 150 | 94.7 Ų | 94.7 | 65% | 0.652 | 52% | 0.519 | S | S | * | . | trans | -72.1 | 83 | 155.5 | -80.8 | -177.9 | -177.7 | 168.4 | 0 | 106.5 | S130 I134 Y403 | S130-K132 PolarHBondContact O-N 3.47Å; K132-I134 PolarHBondContact O-N 3.08Å; K132-Y403 HydrophobicContact CB-CD1 4.42Å; K132-Y403 HydrophobicContact CB-CE1 3.98Å; K132-Y403 HydrophobicContact CD-CE1 3.82Å | ||
| 133 | H | 47.6 | Very low | 54.5 | Low | 187 Ų | 187 | 93.1 Ų | 93.1 | 87% | 0.866 | 51% | 0.505 | S | S | * | . | trans | -55.1 | 110.6 | 171.8 | -103.4 | -80.2 | 0 | 0 | 0 | 109 | G131 | G131-H133 PolarHBondContact O-N 3.2Š| ||
| 134 | I | 55 | Low | 55.6 | Low | 46 Ų | 46 | 90.6 Ų | 90.6 | 24% | 0.236 | 49% | 0.494 | C | S | . | . | trans | -71.6 | 151.9 | 164 | -54.9 | 172 | 0 | 0 | 0 | 107.5 | K132 Y403 | K132-I134 PolarHBondContact O-N 3.08Å; I134-Y403 HydrophobicContact CD1-CD1 3.84Å; I134-Y403 HydrophobicContact CD1-CG 4.07Å; I134-Y403 HydrophobicContact CG1-CD1 4.17Å | ||
| 135 | M | 56.9 | Low | 57.2 | Low | 36 Ų | 36 | 84.6 Ų | 84.6 | 18% | 0.177 | 47% | 0.471 | C | S | . | . | trans | -35.7 | 147.8 | 175.3 | -90.2 | 155.9 | 55.9 | 0 | 0 | 113.2 | S137 D139 A140 D143 Q162 | M135-S137 PolarHBondContact O-N 3.19Å; M135-D139 HydrophobicContact CB-CB 4.41Å; M135-D139 VanDerWaalsContact CE-C 3.49Å; M135-D139 HydrophobicContact CE-CB 3.84Å; M135-D139 HydrophobicContact CG-CB 4.47Å; M135-A140 HydrophobicContact CE-CB 4.28Å; M135-D143 HydrophobicContact CE-CB 4.15Å; M135-D143 WeakPolarHBondContact CE-OD2 3.34Å; M135-Q162 HydrophobicContact SD-CG 4.05Å | ||
| 136 | S | 66.4 | Low | 59.2 | Low | 70 Ų | 70 | 80.9 Ų | 80.9 | 49% | 0.49 | 45% | 0.449 | S | S | . | . | trans | -48.3 | 135.2 | 163.6 | 177.9 | 0 | 0 | 0 | 0 | 109.6 | A138 D139 A140 | S136-A138 PolarHBondContact O-N 3.47Å; S136-D139 WeakPolarHBondContact O-CA 3.21Å; S136-D139 WeakPolarHBondContact O-CB 3.37Å; S136-D139 PolarHBondContact O-N 3.38Å; S136-A140 PolarHBondContact O-N 2.93Å | ||
| 137 | S | 62 | Low | 60.7 | Low | 35 Ų | 35 | 74.5 Ų | 74.5 | 25% | 0.245 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -64.8 | -24.3 | -176.9 | 25.2 | 0 | 0 | 0 | 0 | 114.3 | M135 A140 L141 D406 | M135-S137 PolarHBondContact O-N 3.19Å; S137-A140 PolarHBondContact O-N 3.39Å; S137-L141 WeakPolarHBondContact O-CB 3.46Å; S137-L141 PolarHBondContact O-N 3.01Å; S137-D406 WeakPolarHBondContact CB-OD2 3.37Å; S137-D406 PolarHBondContact OG-OD2 3.03Å |
| 138 | A | 68.8 | Low | 62.6 | Low | 58 Ų | 58 | 72.2 Ų | 72.2 | 48% | 0.479 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -61.8 | -44.8 | 167.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | S136 A140 L141 L142 | S136-A138 PolarHBondContact O-N 3.47Å; A138-A140 VanDerWaalsContact C-N 3.34Å; A138-A140 PolarHBondContact O-N 3.37Å; A138-L141 PolarHBondContact O-N 2.84Å; A138-L142 WeakPolarHBondContact O-CB 3.44Å; A138-L142 VanDerWaalsContact O-CG 3.23Å; A138-L142 WeakPolarHBondContact O-CG 3.45Å; A138-L142 PolarHBondContact O-N 2.93Å |
| 139 | D | 72.4 | Confident | 64.7 | Low | 25 Ų | 25 | 70.7 Ų | 70.7 | 13% | 0.134 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -66.4 | -38.3 | 177.3 | -64 | -32.5 | 0 | 0 | 0 | 111.2 | M135 S136 L142 D143 T163 T217 | M135-D139 HydrophobicContact CB-CB 4.41Å; M135-D139 VanDerWaalsContact CE-C 3.49Å; M135-D139 HydrophobicContact CE-CB 3.84Å; M135-D139 HydrophobicContact CG-CB 4.47Å; S136-D139 WeakPolarHBondContact O-CA 3.21Å; S136-D139 WeakPolarHBondContact O-CB 3.37Å; S136-D139 PolarHBondContact O-N 3.38Å; D139-L142 PolarHBondContact O-N 3.39Å; D139-D143 VanDerWaalsContact O-CB 3.25Å; D139-D143 WeakPolarHBondContact O-CB 3.23Å; D139-D143 PolarHBondContact O-N 3.5Å; D139-T163 HydrophobicContact CB-CG2 4.29Å; D139-T217 WeakPolarHBondContact OD2-CG2 3.49Å |
| 140 | A | 66.9 | Low | 66.8 | Low | 13 Ų | 13 | 64.8 Ų | 64.8 | 11% | 0.107 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -63.7 | -41.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | M135 S136 S137 A138 L144 Q409 | M135-A140 HydrophobicContact CE-CB 4.28Å; S136-A140 PolarHBondContact O-N 2.93Å; S137-A140 PolarHBondContact O-N 3.39Å; A138-A140 VanDerWaalsContact C-N 3.34Å; A138-A140 PolarHBondContact O-N 3.37Å; A140-L144 WeakPolarHBondContact O-CB 3.31Å; A140-L144 PolarHBondContact O-N 3.26Å; A140-Q409 HydrophobicContact CB-CG 4.29Å |
| 141 | L | 66.6 | Low | 69.1 | Low | 77 Ų | 77 | 66 Ų | 66 | 40% | 0.403 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -69 | -40.8 | 175.9 | -177.7 | 65.2 | 0 | 0 | 0 | 111.9 | S137 A138 D143 L144 I145 | S137-L141 WeakPolarHBondContact O-CB 3.46Å; S137-L141 PolarHBondContact O-N 3.01Å; A138-L141 PolarHBondContact O-N 2.84Å; L141-D143 VanDerWaalsContact C-N 3.34Å; L141-L144 HydrophobicContact CD1-CD2 4.36Å; L141-L144 WeakPolarHBondContact O-CB 3.47Å; L141-L144 PolarHBondContact O-N 3.32Å; L141-I145 WeakPolarHBondContact O-CG1 3.47Å; L141-I145 PolarHBondContact O-N 3.5Å; L141-I145 VanDerWaalsContact O-N 3.11Å |
| 142 | L | 77.9 | Confident | 71.5 | Confident | 79 Ų | 79 | 67.2 Ų | 67.2 | 41% | 0.414 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -65.6 | -40.2 | 176.2 | -70.7 | 174.9 | 0 | 0 | 0 | 111.2 | A138 D139 L144 I145 R146 | A138-L142 WeakPolarHBondContact O-CB 3.44Å; A138-L142 VanDerWaalsContact O-CG 3.23Å; A138-L142 WeakPolarHBondContact O-CG 3.45Å; A138-L142 PolarHBondContact O-N 2.93Å; D139-L142 PolarHBondContact O-N 3.39Å; L142-L144 VanDerWaalsContact C-N 3.33Å; L142-I145 PolarHBondContact O-N 2.88Å; L142-R146 WeakPolarHBondContact O-CB 3.36Å; L142-R146 VanDerWaalsContact O-CG 3.23Å; L142-R146 WeakPolarHBondContact O-CG 3.33Å; L142-R146 PolarHBondContact O-N 3.28Å |
| 143 | D | 75.4 | Confident | 73.6 | Confident | 7 Ų | 7 | 63.3 Ų | 63.3 | 4% | 0.037 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -66.5 | -35.8 | 175 | -76.2 | -0.2 | 0 | 0 | 0 | 112.1 | M135 D139 L141 R146 N147 Y161 Q162 T163 | M135-D143 HydrophobicContact CE-CB 4.15Å; M135-D143 WeakPolarHBondContact CE-OD2 3.34Å; D139-D143 VanDerWaalsContact O-CB 3.25Å; D139-D143 WeakPolarHBondContact O-CB 3.23Å; D139-D143 PolarHBondContact O-N 3.5Å; L141-D143 VanDerWaalsContact C-N 3.34Å; D143-R146 PolarHBondContact O-N 3.42Å; D143-R146 IonicContact OD1-CZ 3.81Å; D143-R146 IonicContact OD1-NH1 2.85Å; D143-R146 PolarHBondContact OD1-NH1 2.94Å; D143-N147 VanDerWaalsContact O-CB 3.26Å; D143-N147 WeakPolarHBondContact O-CB 3.27Å; D143-N147 VanDerWaalsContact O-CG 3.32Å; D143-N147 PolarHBondContact O-N 3.43Å; D143-N147 PolarHBondContact O-ND2 2.98Å; D143-Y161 WeakPolarHBondContact OD1-CD1 3.45Å; D143-Y161 WeakPolarHBondContact OD1-CE1 3.39Å; D143-Q162 WeakPolarHBondContact OD2-CA 3.3Å; D143-T163 VanDerWaalsContact CG-OG1 3.28Å; D143-T163 PolarHBondContact OD1-OG1 3.38Å; D143-T163 VanDerWaalsContact OD2-CB 3.31Å; D143-T163 WeakPolarHBondContact OD2-CB 3.33Å; D143-T163 PolarHBondContact OD2-N 3.25Å; D143-T163 PolarHBondContact OD2-OG1 3.41Å; D143-T163 VanDerWaalsContact OD2-OG1 3.13Å |
| 144 | L | 71.8 | Confident | 75.7 | Confident | 7 Ų | 7 | 59.3 Ų | 59.3 | 4% | 0.037 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -56.3 | -53.2 | 171.2 | -180 | 65.5 | 0 | 0 | 0 | 110.5 | A140 L141 L142 R146 N147 M148 L228 T412 I415 T416 | A140-L144 WeakPolarHBondContact O-CB 3.31Å; A140-L144 PolarHBondContact O-N 3.26Å; L141-L144 HydrophobicContact CD1-CD2 4.36Å; L141-L144 WeakPolarHBondContact O-CB 3.47Å; L141-L144 PolarHBondContact O-N 3.32Å; L142-L144 VanDerWaalsContact C-N 3.33Å; L144-R146 PolarHBondContact O-N 2.73Å; L144-N147 CarbonylContact O-C 3.53Å; L144-N147 PolarHBondContact O-N 3.22Å; L144-N147 VanDerWaalsContact O-N 3.17Å; L144-M148 WeakPolarHBondContact O-CG 3.35Å; L144-M148 PolarHBondContact O-N 3.35Å; L144-L228 HydrophobicContact CD1-CD2 3.27Å; L144-L228 HydrophobicContact CG-CD2 4.26Å; L144-T412 HydrophobicContact CD1-CG2 3.76Å; L144-T412 HydrophobicContact CD2-CG2 4.11Å; L144-T412 HydrophobicContact CG-CG2 4.36Å; L144-I415 HydrophobicContact CD2-CD1 4.47Å; L144-T416 HydrophobicContact CD1-CG2 3.77Å |
| 145 | I | 78.8 | Confident | 77.3 | Confident | 82 Ų | 82 | 60 Ų | 60 | 42% | 0.421 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -63 | -42.1 | -179.5 | -64.4 | 168.2 | 0 | 0 | 0 | 111.1 | L141 L142 N147 M148 F149 | L141-I145 WeakPolarHBondContact O-CG1 3.47Å; L141-I145 PolarHBondContact O-N 3.5Å; L141-I145 VanDerWaalsContact O-N 3.11Å; L142-I145 PolarHBondContact O-N 2.88Å; I145-N147 VanDerWaalsContact C-N 3.29Å; I145-N147 PolarHBondContact O-N 3.06Å; I145-M148 WeakPolarHBondContact O-CB 3.48Å; I145-M148 PolarHBondContact O-N 2.85Å; I145-M148 VanDerWaalsContact O-N 3.17Å; I145-F149 PolarHBondContact O-N 3.07Å |
| 146 | R | 81.6 | Confident | 78.5 | Confident | 94 Ų | 94 | 58.5 Ų | 58.5 | 36% | 0.355 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -61.7 | -39 | 175.6 | -70.9 | 169.2 | -173.2 | 144.6 | -4.2 | 111.5 | L142 D143 L144 M148 F149 Y161 T163 | L142-R146 WeakPolarHBondContact O-CB 3.36Å; L142-R146 VanDerWaalsContact O-CG 3.23Å; L142-R146 WeakPolarHBondContact O-CG 3.33Å; L142-R146 PolarHBondContact O-N 3.28Å; D143-R146 PolarHBondContact O-N 3.42Å; D143-R146 IonicContact OD1-CZ 3.81Å; D143-R146 IonicContact OD1-NH1 2.85Å; D143-R146 PolarHBondContact OD1-NH1 2.94Å; L144-R146 PolarHBondContact O-N 2.73Å; R146-M148 VanDerWaalsContact C-N 3.34Å; R146-F149 CarbonylContact O-C 3.58Å; R146-F149 VanDerWaalsContact O-C 3.28Å; R146-F149 PolarHBondContact O-N 3.12Å; R146-F149 VanDerWaalsContact O-O 3.11Å; R146-Y161 HydrophobicContact CB-CD1 4.18Å; R146-Y161 HydrophobicContact CB-CG 4.29Å; R146-T163 PolarHBondContact NH1-OG1 3.42Å |
| 147 | N | 74.4 | Confident | 79.2 | Confident | 16 Ų | 16 | 57.3 Ų | 57.3 | 9% | 0.086 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -72.9 | -25.1 | 176.6 | -77 | -48.2 | 0 | 0 | 0 | 112.9 | D143 L144 I145 F149 Y161 N226 G229 | D143-N147 VanDerWaalsContact O-CB 3.26Å; D143-N147 WeakPolarHBondContact O-CB 3.27Å; D143-N147 VanDerWaalsContact O-CG 3.32Å; D143-N147 PolarHBondContact O-N 3.43Å; D143-N147 PolarHBondContact O-ND2 2.98Å; L144-N147 CarbonylContact O-C 3.53Å; L144-N147 PolarHBondContact O-N 3.22Å; L144-N147 VanDerWaalsContact O-N 3.17Å; I145-N147 VanDerWaalsContact C-N 3.29Å; I145-N147 PolarHBondContact O-N 3.06Å; N147-F149 PolarHBondContact O-N 3.33Å; N147-Y161 PolarHBondContact ND2-O 3.26Å; N147-Y161 WeakPolarHBondContact OD1-CB 3.49Å; N147-Y161 PolarHBondContact OD1-N 2.87Å; N147-N226 PolarHBondContact O-ND2 3.48Å; N147-N226 PolarHBondContact O-OD1 3.21Å; N147-N226 PolarHBondContact OD1-ND2 3.28Å; N147-G229 WeakPolarHBondContact O-CA 3.42Å; N147-G229 PolarHBondContact O-N 3.46Å |
| 148 | M | 79.7 | Confident | 80 | Confident | 56 Ų | 56 | 60.8 Ų | 60.8 | 28% | 0.276 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -62.7 | -31.2 | 171.2 | -68.4 | 176.6 | 67.5 | 0 | 0 | 112.6 | L144 I145 R146 P150 L228 I232 | L144-M148 WeakPolarHBondContact O-CG 3.35Å; L144-M148 PolarHBondContact O-N 3.35Å; I145-M148 WeakPolarHBondContact O-CB 3.48Å; I145-M148 PolarHBondContact O-N 2.85Å; I145-M148 VanDerWaalsContact O-N 3.17Å; R146-M148 VanDerWaalsContact C-N 3.34Å; M148-P150 WeakPolarHBondContact O-CD 3.15Å; M148-L228 HydrophobicContact CG-CD2 3.68Å; M148-L228 HydrophobicContact CG-CG 4.1Å; M148-I232 HydrophobicContact CB-CD1 3.43Å; M148-I232 VanDerWaalsContact CB-CD1 3.43Å; M148-I232 HydrophobicContact CE-CD1 3.46Å; M148-I232 VanDerWaalsContact CE-CD1 3.46Å; M148-I232 HydrophobicContact CG-CD1 3.37Å; M148-I232 HydrophobicContact SD-CD1 4.21Å |
| 149 | F | 86.8 | Confident | 80.5 | Confident | 146 Ų | 146 | 60.2 Ų | 60.2 | 64% | 0.64 | 32% | 0.315 | S | S | * | . | S | Bend | trans | -123 | 75.8 | -179.4 | -59.6 | -79.2 | 0 | 0 | 0 | 110.5 | I145 R146 N147 S151 | I145-F149 PolarHBondContact O-N 3.07Å; R146-F149 CarbonylContact O-C 3.58Å; R146-F149 VanDerWaalsContact O-C 3.28Å; R146-F149 PolarHBondContact O-N 3.12Å; R146-F149 VanDerWaalsContact O-O 3.11Å; N147-F149 PolarHBondContact O-N 3.33Å; F149-S151 PolarHBondContact O-N 3.01Å |
| 150 | P | 84.8 | Confident | 80.3 | Confident | 32 Ų | 32 | 60 Ų | 60 | 21% | 0.208 | 31% | 0.313 | C | S | . | . | trans | -62.4 | 139.7 | -178.4 | 26.2 | -33.5 | 0 | 0 | 0 | 110.9 | M148 N152 L153 A156 | M148-P150 WeakPolarHBondContact O-CD 3.15Å; P150-N152 PolarHBondContact O-N 3.27Å; P150-L153 HydrophobicContact CG-CD2 4.11Å; P150-A156 HydrophobicContact CB-CB 3.77Å; P150-A156 HydrophobicContact CG-CB 4.04Å | ||
| 151 | S | 88.9 | Confident | 80.7 | Confident | 117 Ų | 117 | 61.8 Ų | 61.8 | 82% | 0.818 | 32% | 0.318 | S | S | * | . | S | Bend | trans | -62.1 | -26.5 | 176.7 | 54.4 | 0 | 0 | 0 | 0 | 112.8 | F149 | F149-S151 PolarHBondContact O-N 3.01Š|
| 152 | N | 92.4 | Very high | 81.1 | Confident | 78 Ų | 78 | 60.9 Ų | 60.9 | 42% | 0.417 | 31% | 0.311 | S | S | . | . | trans | -148.8 | 128.4 | 176.9 | -176.1 | -56.7 | 0 | 0 | 0 | 110.8 | P150 V154 Q155 A156 | P150-N152 PolarHBondContact O-N 3.27Å; N152-V154 WeakPolarHBondContact OD1-CA 3.36Å; N152-V154 WeakPolarHBondContact OD1-CB 3.26Å; N152-V154 PolarHBondContact OD1-N 3.17Å; N152-Q155 HydrophobicContact CB-CB 3.82Å; N152-Q155 PolarHBondContact O-N 2.95Å; N152-Q155 PolarHBondContact OD1-N 2.9Å; N152-A156 WeakPolarHBondContact O-CB 3.1Å; N152-A156 PolarHBondContact O-N 3.41Å | ||
| 153 | L | 89.8 | Confident | 81 | Confident | 68 Ų | 68 | 57.4 Ų | 57.4 | 36% | 0.356 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -69.6 | -35.3 | -178.3 | -68.6 | 170.5 | 0 | 0 | 0 | 113.5 | P150 A156 T157 F233 | P150-L153 HydrophobicContact CG-CD2 4.11Å; L153-A156 WeakPolarHBondContact O-CB 3.39Å; L153-A156 PolarHBondContact O-N 3.27Å; L153-T157 WeakPolarHBondContact O-CG2 3.41Å; L153-T157 PolarHBondContact O-N 3.48Å; L153-F233 HydrophobicContact CD1-CD1 3.89Å; L153-F233 HydrophobicContact CD1-CD2 3.68Å; L153-F233 HydrophobicContact CD1-CE1 3.66Å; L153-F233 HydrophobicContact CD1-CE2 3.44Å; L153-F233 VanDerWaalsContact CD1-CE2 3.44Å; L153-F233 HydrophobicContact CD1-CG 3.9Å; L153-F233 HydrophobicContact CD1-CZ 3.42Å; L153-F233 VanDerWaalsContact CD1-CZ 3.42Å; L153-F233 HydrophobicContact CD2-CB 3.76Å; L153-F233 HydrophobicContact CD2-CD1 3.86Å; L153-F233 HydrophobicContact CD2-CD2 3.88Å; L153-F233 HydrophobicContact CD2-CE1 4.47Å; L153-F233 HydrophobicContact CD2-CE2 4.49Å; L153-F233 HydrophobicContact CD2-CG 3.52Å; L153-F233 HydrophobicContact CG-CD2 4.39Å; L153-F233 HydrophobicContact CG-CG 4.37Å |
| 154 | V | 93.1 | Very high | 80.7 | Confident | 103 Ų | 103 | 63.6 Ų | 63.6 | 62% | 0.624 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -68.7 | -44.7 | 176.7 | -177.5 | 0 | 0 | 0 | 0 | 109.2 | N152 A156 T157 F158 | N152-V154 WeakPolarHBondContact OD1-CA 3.36Å; N152-V154 WeakPolarHBondContact OD1-CB 3.26Å; N152-V154 PolarHBondContact OD1-N 3.17Å; V154-A156 VanDerWaalsContact C-N 3.29Å; V154-A156 PolarHBondContact O-N 3.09Å; V154-T157 WeakPolarHBondContact O-CB 3.49Å; V154-T157 PolarHBondContact O-N 3.04Å; V154-T157 VanDerWaalsContact O-N 3.08Å; V154-T157 PolarHBondContact O-OG1 3.46Å; V154-F158 HydrophobicContact CG1-CE1 4.47Å; V154-F158 WeakPolarHBondContact O-CD1 3.5Å; V154-F158 VanDerWaalsContact O-CE1 3.25Å; V154-F158 WeakPolarHBondContact O-CE1 3.29Å |
| 155 | Q | 88.2 | Confident | 80.2 | Confident | 62 Ų | 62 | 66.1 Ų | 66.1 | 29% | 0.29 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -60.1 | -40.3 | 174.2 | -172.1 | 177.5 | -0.6 | 0 | 0 | 111.8 | N152 T157 F158 Q159 | N152-Q155 HydrophobicContact CB-CB 3.82Å; N152-Q155 PolarHBondContact O-N 2.95Å; N152-Q155 PolarHBondContact OD1-N 2.9Å; Q155-T157 PolarHBondContact O-N 3.04Å; Q155-F158 HydrophobicContact CB-CZ 4.43Å; Q155-F158 HydrophobicContact CG-CE2 4.48Å; Q155-F158 HydrophobicContact CG-CZ 4.34Å; Q155-F158 PolarHBondContact O-N 3.43Å; Q155-Q159 HydrophobicContact CG-CB 4.01Å; Q155-Q159 PolarHBondContact O-N 3.02Å |
| 156 | A | 81.8 | Confident | 79.4 | Confident | 3 Ų | 3 | 66.9 Ų | 66.9 | 3% | 0.025 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -58.1 | -21.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | P150 N152 L153 V154 F158 Q159 M225 N226 I230 | P150-A156 HydrophobicContact CB-CB 3.77Å; P150-A156 HydrophobicContact CG-CB 4.04Å; N152-A156 WeakPolarHBondContact O-CB 3.1Å; N152-A156 PolarHBondContact O-N 3.41Å; L153-A156 WeakPolarHBondContact O-CB 3.39Å; L153-A156 PolarHBondContact O-N 3.27Å; V154-A156 VanDerWaalsContact C-N 3.29Å; V154-A156 PolarHBondContact O-N 3.09Å; A156-F158 VanDerWaalsContact C-N 3.26Å; A156-F158 PolarHBondContact O-N 2.89Å; A156-Q159 WeakPolarHBondContact CA-O 3.41Å; A156-M225 CarbonylContact O-C 3.57Å; A156-N226 HydrophobicContact CB-CB 4.13Å; A156-N226 PolarHBondContact O-N 2.98Å; A156-I230 HydrophobicContact CB-CG1 4.37Å |
| 157 | T | 80.7 | Confident | 78.4 | Confident | 46 Ų | 46 | 68.3 Ų | 68.3 | 28% | 0.282 | 35% | 0.35 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.3 | -18.2 | 176.8 | 69.4 | 0 | 0 | 0 | 0 | 114 | L68 L153 V154 Q155 M225 I230 | L68-T157 HydrophobicContact CD1-CG2 3.8Å; L68-T157 HydrophobicContact CD2-CG2 3.82Å; L68-T157 HydrophobicContact CG-CG2 4.48Å; L153-T157 WeakPolarHBondContact O-CG2 3.41Å; L153-T157 PolarHBondContact O-N 3.48Å; V154-T157 WeakPolarHBondContact O-CB 3.49Å; V154-T157 PolarHBondContact O-N 3.04Å; V154-T157 VanDerWaalsContact O-N 3.08Å; V154-T157 PolarHBondContact O-OG1 3.46Å; Q155-T157 PolarHBondContact O-N 3.04Å; T157-M225 WeakPolarHBondContact O-CB 3.27Å; T157-M225 WeakPolarHBondContact O-CG 3.2Å; T157-I230 HydrophobicContact CG2-CD1 4.4Å |
| 158 | F | 79.8 | Confident | 77.8 | Confident | 107 Ų | 107 | 71 Ų | 71 | 47% | 0.469 | 36% | 0.363 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -137.6 | -7.5 | -177.8 | 60.7 | -92.1 | 0 | 0 | 0 | 114.9 | V154 Q155 A156 G224 | V154-F158 HydrophobicContact CG1-CE1 4.47Å; V154-F158 WeakPolarHBondContact O-CD1 3.5Å; V154-F158 VanDerWaalsContact O-CE1 3.25Å; V154-F158 WeakPolarHBondContact O-CE1 3.29Å; Q155-F158 HydrophobicContact CB-CZ 4.43Å; Q155-F158 HydrophobicContact CG-CE2 4.48Å; Q155-F158 HydrophobicContact CG-CZ 4.34Å; Q155-F158 PolarHBondContact O-N 3.43Å; A156-F158 VanDerWaalsContact C-N 3.26Å; A156-F158 PolarHBondContact O-N 2.89Å; F158-G224 CarbonylContact C-O 3.59Å; F158-G224 VanDerWaalsContact C-O 3.24Å; F158-G224 CarbonylContact O-C 3.54Å; F158-G224 PolarHBondContact O-N 2.93Å |
| 159 | Q | 79.2 | Confident | 76.8 | Confident | 46 Ų | 46 | 72.1 Ų | 72.1 | 22% | 0.215 | 37% | 0.374 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.6 | 149.3 | 177.1 | -80.2 | 173.7 | -3.9 | 0 | 0 | 112.4 | Q155 A156 S222 G224 N226 | Q155-Q159 HydrophobicContact CG-CB 4.01Å; Q155-Q159 PolarHBondContact O-N 3.02Å; A156-Q159 WeakPolarHBondContact CA-O 3.41Å; Q159-S222 WeakPolarHBondContact CA-O 3.35Å; Q159-G224 CarbonylContact C-O 3.28Å; Q159-G224 WeakPolarHBondContact CA-O 3.3Å; Q159-G224 PolarHBondContact N-O 3.4Å; Q159-G224 VanDerWaalsContact N-O 3.09Å; Q159-N226 WeakPolarHBondContact O-CB 3.43Å |
| 160 | Q | 68.4 | Low | 75.4 | Confident | 20 Ų | 20 | 70 Ų | 70 | 9% | 0.093 | 36% | 0.364 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.3 | 154.4 | 172.9 | 66.9 | 178.5 | 20.2 | 0 | 0 | 111.2 | T221 S222 G224 N226 T440 | Q160-T221 CarbonylContact O-C 3.24Å; Q160-T221 VanDerWaalsContact O-CA 3.27Å; Q160-T221 WeakPolarHBondContact O-CA 3.36Å; Q160-S222 WeakPolarHBondContact CG-OG 3.43Å; Q160-S222 PolarHBondContact N-O 2.9Å; Q160-S222 PolarHBondContact NE2-OG 3.14Å; Q160-S222 PolarHBondContact O-N 3.47Å; Q160-G224 PolarHBondContact N-O 3.06Å; Q160-G224 VanDerWaalsContact N-O 3.15Å; Q160-N226 HydrophobicContact CB-CB 3.81Å; Q160-T440 PolarHBondContact NE2-O 3.42Å |
| 161 | Y | 75.9 | Confident | 73.9 | Confident | 52 Ų | 52 | 74 Ų | 74 | 20% | 0.204 | 39% | 0.39 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.8 | 131.6 | 177.8 | -169 | -82 | 0 | 0 | 0 | 109.7 | D143 R146 N147 E219 | D143-Y161 WeakPolarHBondContact OD1-CD1 3.45Å; D143-Y161 WeakPolarHBondContact OD1-CE1 3.39Å; R146-Y161 HydrophobicContact CB-CD1 4.18Å; R146-Y161 HydrophobicContact CB-CG 4.29Å; N147-Y161 PolarHBondContact ND2-O 3.26Å; N147-Y161 WeakPolarHBondContact OD1-CB 3.49Å; N147-Y161 PolarHBondContact OD1-N 2.87Å; Y161-E219 HydrophobicContact CE2-CB 4.21Å; Y161-E219 WeakPolarHBondContact OH-CB 3.47Å; Y161-E219 VanDerWaalsContact OH-CG 3.26Å; Y161-E219 WeakPolarHBondContact OH-CG 3.42Å |
| 162 | Q | 73.4 | Confident | 72.2 | Confident | 57 Ų | 57 | 76.7 Ų | 76.7 | 27% | 0.266 | 39% | 0.387 | S | S | . | . | trans | -146.7 | 122.1 | 175.6 | -171.8 | 177.1 | 14.9 | 0 | 0 | 110.9 | M135 D143 R164 G220 S222 | M135-Q162 HydrophobicContact SD-CG 4.05Å; D143-Q162 WeakPolarHBondContact OD2-CA 3.3Å; Q162-R164 PolarHBondContact O-N 3.27Å; Q162-G220 CarbonylContact C-O 3.18Å; Q162-G220 PolarHBondContact N-O 3.02Å; Q162-G220 CarbonylContact O-C 2.94Å; Q162-G220 WeakPolarHBondContact O-CA 3.38Å; Q162-G220 PolarHBondContact O-N 3.11Å; Q162-S222 PolarHBondContact OE1-OG 3.33Å | ||
| 163 | T | 76.6 | Confident | 70.2 | Confident | 6 Ų | 6 | 76.5 Ų | 76.5 | 4% | 0.037 | 39% | 0.39 | C | S | . | . | trans | -69.4 | 118.2 | 175.4 | -64 | 0 | 0 | 0 | 0 | 109 | D139 D143 R146 T217 | D139-T163 HydrophobicContact CB-CG2 4.29Å; D143-T163 VanDerWaalsContact CG-OG1 3.28Å; D143-T163 PolarHBondContact OD1-OG1 3.38Å; D143-T163 VanDerWaalsContact OD2-CB 3.31Å; D143-T163 WeakPolarHBondContact OD2-CB 3.33Å; D143-T163 PolarHBondContact OD2-N 3.25Å; D143-T163 PolarHBondContact OD2-OG1 3.41Å; D143-T163 VanDerWaalsContact OD2-OG1 3.13Å; R146-T163 PolarHBondContact NH1-OG1 3.42Å; T163-T217 HydrophobicContact CG2-CG2 3.9Å | ||
| 164 | R | 68.4 | Low | 68.3 | Low | 138 Ų | 138 | 78.2 Ų | 78.2 | 52% | 0.521 | 40% | 0.404 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.9 | 121.8 | 175.4 | -64.7 | -170.7 | -174 | -171.7 | 5 | 109.1 | Q162 Q166 R218 T221 | Q162-R164 PolarHBondContact O-N 3.27Å; R164-Q166 PolarHBondContact O-N 3.5Å; R164-R218 PolarHBondContact N-O 3.42Å; R164-R218 PolarHBondContact O-N 3.36Å; R164-T221 PolarHBondContact NH2-O 3.37Å |
| 165 | S | 62.7 | Low | 66.3 | Low | 60 Ų | 60 | 79 Ų | 79 | 42% | 0.42 | 41% | 0.408 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.1 | 115.3 | 170.2 | -71.5 | 0 | 0 | 0 | 0 | 109.2 | ||
| 166 | Q | 60.7 | Low | 64.4 | Low | 97 Ų | 97 | 80.2 Ų | 80.2 | 45% | 0.453 | 42% | 0.424 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.1 | 124.2 | 170.3 | -69.5 | -172.6 | -15 | 0 | 0 | 108.9 | R164 I168 R216 | R164-Q166 PolarHBondContact O-N 3.5Å; Q166-I168 PolarHBondContact O-N 2.75Å; Q166-R216 PolarHBondContact N-O 3.12Å; Q166-R216 PolarHBondContact O-N 3.25Å; Q166-R216 VanDerWaalsContact O-N 3.08Å |
| 167 | L | 60 | Low | 62.6 | Low | 125 Ų | 125 | 86.2 Ų | 86.2 | 65% | 0.654 | 45% | 0.451 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -77.8 | 102.2 | 172.3 | -60.8 | 179.9 | 0 | 0 | 0 | 107.9 | V213 V215 | L167-V213 HydrophobicContact CB-CG1 3.73Å; L167-V213 HydrophobicContact CD2-CG1 3.84Å; L167-V213 HydrophobicContact CG-CG1 4.25Å; L167-V215 HydrophobicContact CD2-CG2 3.81Å |
| 168 | I | 61.8 | Low | 60.9 | Low | 71 Ų | 71 | 85.4 Ų | 85.4 | 36% | 0.364 | 45% | 0.449 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.9 | 107.9 | 173.5 | -57 | 178.6 | 0 | 0 | 0 | 106.9 | Q166 K170 L214 R216 | Q166-I168 PolarHBondContact O-N 2.75Å; I168-K170 PolarHBondContact O-N 3.32Å; I168-L214 PolarHBondContact N-O 3.25Å; I168-L214 PolarHBondContact O-N 3.42Å; I168-R216 HydrophobicContact CD1-CB 4.08Å; I168-R216 HydrophobicContact CD1-CG 4.09Å |
| 169 | V | 60.3 | Low | 59.4 | Low | 81 Ų | 81 | 87.5 Ų | 87.5 | 49% | 0.491 | 46% | 0.461 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -65.7 | 121.9 | 171 | -177.8 | 0 | 0 | 0 | 0 | 107.7 | P171 P211 | V169-P171 WeakPolarHBondContact O-CD 3.48Å; V169-P211 HydrophobicContact CG1-CB 3.79Å; V169-P211 HydrophobicContact CG1-CG 4.13Å |
| 170 | K | 55.9 | Low | 57.8 | Low | 101 Ų | 101 | 90.2 Ų | 90.2 | 44% | 0.439 | 48% | 0.484 | S | S | . | . | P | Polyproline II helix | trans | -62 | 127 | 173.4 | -73.5 | -174.1 | -173.5 | 167.1 | 0 | 108.6 | I168 K172 D212 L214 | I168-K170 PolarHBondContact O-N 3.32Å; K170-K172 PolarHBondContact O-N 3.25Å; K170-D212 HydrophobicContact CB-CB 4.39Å; K170-D212 WeakPolarHBondContact CB-O 3.47Å; K170-D212 HydrophobicContact CD-CB 3.91Å; K170-D212 HydrophobicContact CG-CB 4.38Å; K170-D212 PolarHBondContact N-O 3.05Å; K170-D212 IonicContact NZ-OD2 3.75Å; K170-L214 HydrophobicContact CG-CB 4.47Å |
| 171 | P | 54.8 | Low | 56.7 | Low | 117 Ų | 117 | 96.7 Ų | 96.7 | 76% | 0.76 | 52% | 0.515 | S | S | * | . | P | Polyproline II helix | trans | -60.6 | 139.6 | 171 | 23.8 | -29.9 | 0 | 0 | 0 | 109.1 | V169 | V169-P171 WeakPolarHBondContact O-CD 3.48Š|
| 172 | K | 52.6 | Low | 55.3 | Low | 173 Ų | 173 | 97.9 Ų | 97.9 | 75% | 0.752 | 53% | 0.531 | S | S | * | . | P | Polyproline II helix | trans | -49.5 | 139 | 177.4 | -75.4 | 179.5 | 176.7 | 179.3 | 0 | 109.6 | K170 T174 | K170-K172 PolarHBondContact O-N 3.25Å; K172-T174 PolarHBondContact O-N 2.83Å |
| 173 | P | 49.8 | Very low | 54.1 | Low | 74 Ų | 74 | 101.6 Ų | 101.6 | 48% | 0.481 | 56% | 0.557 | S | S | . | * | P | Polyproline II helix | trans | -55 | 131 | 171.1 | 20.7 | -29.4 | 0 | 0 | 0 | 109.5 | Q177 | P173-Q177 HydrophobicContact CB-CB 3.7Å; P173-Q177 VanDerWaalsContact CB-OE1 3.3Å |
| 174 | T | 50.9 | Low | 52.8 | Low | 104 Ų | 104 | 107.4 Ų | 107.4 | 64% | 0.638 | 59% | 0.593 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 146.3 | 173.4 | -52.5 | 0 | 0 | 0 | 0 | 109.3 | K172 S176 Q177 | K172-T174 PolarHBondContact O-N 2.83Å; T174-S176 PolarHBondContact O-N 2.89Å; T174-Q177 PolarHBondContact O-N 3.26Å |
| 175 | V | 50.8 | Low | 52 | Low | 118 Ų | 118 | 109.2 Ų | 109.2 | 72% | 0.715 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -41.9 | -29.8 | -174.7 | 178.9 | 0 | 0 | 0 | 0 | 114.6 | Q177 A178 | V175-Q177 VanDerWaalsContact C-N 3.33Å; V175-Q177 PolarHBondContact O-N 2.89Å; V175-A178 PolarHBondContact O-N 2.85Å |
| 176 | S | 47.6 | Very low | 51.6 | Low | 89 Ų | 89 | 117.4 Ų | 117.4 | 62% | 0.622 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.1 | -20.8 | 175.4 | 26.6 | 0 | 0 | 0 | 0 | 115.9 | T174 | T174-S176 PolarHBondContact O-N 2.89Š|
| 177 | Q | 44.1 | Very low | 51.4 | Low | 129 Ų | 129 | 116.5 Ų | 116.5 | 60% | 0.603 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.6 | -18.2 | 174.5 | -81.7 | -178.9 | -12 | 0 | 0 | 113 | P173 T174 V175 Q179 | P173-Q177 HydrophobicContact CB-CB 3.7Å; P173-Q177 VanDerWaalsContact CB-OE1 3.3Å; T174-Q177 PolarHBondContact O-N 3.26Å; V175-Q177 VanDerWaalsContact C-N 3.33Å; V175-Q177 PolarHBondContact O-N 2.89Å; Q177-Q179 VanDerWaalsContact C-N 3.3Å; Q177-Q179 PolarHBondContact O-N 3.24Å |
| 178 | A | 45.4 | Very low | 51.3 | Low | 29 Ų | 29 | 116 Ų | 116 | 24% | 0.24 | 62% | 0.621 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -78 | -10.9 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | V175 | V175-A178 PolarHBondContact O-N 2.85Š|
| 179 | Q | 47.1 | Very low | 51.3 | Low | 151 Ų | 151 | 117.7 Ų | 117.7 | 71% | 0.706 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.3 | -23.2 | 176.5 | -74.7 | -177.8 | -20.8 | 0 | 0 | 112.7 | Q177 S182 | Q177-Q179 VanDerWaalsContact C-N 3.3Å; Q177-Q179 PolarHBondContact O-N 3.24Å; Q179-S182 PolarHBondContact O-OG 3.06Å |
| 180 | S | 45.7 | Very low | 51.4 | Low | 102 Ų | 102 | 118.9 Ų | 118.9 | 71% | 0.713 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.2 | -20.6 | -176.8 | -47.6 | 0 | 0 | 0 | 0 | 114.1 | ||
| 181 | E | 46.3 | Very low | 51.8 | Low | 156 Ų | 156 | 116.2 Ų | 116.2 | 73% | 0.729 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.5 | 27.5 | -178.8 | -68.2 | -176.9 | 164 | 0 | 0 | 112.9 | T183 | E181-T183 VanDerWaalsContact C-N 3.29Å; E181-T183 PolarHBondContact O-N 2.78Å |
| 182 | S | 46.2 | Very low | 52.3 | Low | 77 Ų | 77 | 114.3 Ų | 114.3 | 54% | 0.538 | 61% | 0.61 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -83.7 | 21.7 | -172.5 | 62.1 | 0 | 0 | 0 | 0 | 115.6 | Q179 | Q179-S182 PolarHBondContact O-OG 3.06Š|
| 183 | T | 48.7 | Very low | 52.9 | Low | 135 Ų | 135 | 111.6 Ų | 111.6 | 83% | 0.828 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.2 | -4.5 | -176.5 | -6.1 | 0 | 0 | 0 | 0 | 115.6 | E181 | E181-T183 VanDerWaalsContact C-N 3.29Å; E181-T183 PolarHBondContact O-N 2.78Å |
| 184 | T | 48.7 | Very low | 53.5 | Low | 129 Ų | 129 | 112.8 Ų | 112.8 | 79% | 0.791 | 60% | 0.602 | S | S | * | * | S | Bend | trans | -129.5 | 16.8 | -176.8 | 33.9 | 0 | 0 | 0 | 0 | 115 | R186 | T184-R186 PolarHBondContact O-N 2.82Š|
| 185 | R | 51.9 | Low | 54 | Low | 175 Ų | 175 | 116.3 Ų | 116.3 | 66% | 0.66 | 62% | 0.618 | S | S | * | * | trans | -84.1 | 88.3 | 168.5 | -72.6 | -174.8 | 170.8 | 134.8 | 2.8 | 110.3 | P187 | R185-P187 WeakPolarHBondContact O-CD 3.43Š| ||
| 186 | R | 53.6 | Low | 54.6 | Low | 233 Ų | 233 | 118.4 Ų | 118.4 | 88% | 0.879 | 63% | 0.625 | S | S | * | * | trans | -97.3 | 107.1 | 168.1 | -69.4 | -173.2 | -177.3 | -174.3 | 1.4 | 108.6 | T184 L188 | T184-R186 PolarHBondContact O-N 2.82Å; R186-L188 PolarHBondContact O-N 3.32Å | ||
| 187 | P | 57.1 | Low | 55.4 | Low | 78 Ų | 78 | 116.6 Ų | 116.6 | 51% | 0.506 | 62% | 0.62 | S | S | . | * | trans | -62.8 | 128.2 | 172.2 | 25.4 | -31.5 | 0 | 0 | 0 | 108.9 | R185 I189 | R185-P187 WeakPolarHBondContact O-CD 3.43Å; P187-I189 PolarHBondContact O-N 2.92Å | ||
| 188 | L | 58 | Low | 56.1 | Low | 113 Ų | 113 | 115.8 Ų | 115.8 | 59% | 0.592 | 63% | 0.629 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -79.9 | 108.2 | 174.2 | -164.3 | 81.2 | 0 | 0 | 0 | 107.3 | R186 L205 | R186-L188 PolarHBondContact O-N 3.32Å; L188-L205 PolarHBondContact O-N 2.9Å; L188-L205 VanDerWaalsContact O-N 3.17Å |
| 189 | I | 62.5 | Low | 56.8 | Low | 108 Ų | 108 | 119.7 Ų | 119.7 | 55% | 0.554 | 65% | 0.645 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -94.1 | 118.3 | 177.7 | -56.1 | 173.4 | 0 | 0 | 0 | 107 | P187 N202 | P187-I189 PolarHBondContact O-N 2.92Å; I189-N202 HydrophobicContact CG2-CB 3.85Å |
| 190 | Y | 62.7 | Low | 57.6 | Low | 106 Ų | 106 | 116.9 Ų | 116.9 | 42% | 0.416 | 63% | 0.634 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -118.7 | 132.6 | 169.7 | 78.8 | -78.3 | 0 | 0 | 0 | 109 | I192 F203 L205 | Y190-I192 HydrophobicContact CD2-CG1 4Å; Y190-I192 HydrophobicContact CE2-CD1 3.67Å; Y190-I192 HydrophobicContact CE2-CG1 3.52Å; Y190-F203 HydrophobicContact CD1-CB 4.33Å; Y190-F203 HydrophobicContact CE1-CB 3.78Å; Y190-F203 PolarHBondContact N-O 3.3Å; Y190-F203 PolarHBondContact O-N 3.19Å; Y190-L205 HydrophobicContact CE1-CD1 4.24Å |
| 191 | G | 64.1 | Low | 58.7 | Low | 44 Ų | 44 | 117.3 Ų | 117.3 | 45% | 0.454 | 63% | 0.625 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -93.2 | 124.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | Q201 | G191-Q201 WeakPolarHBondContact CA-O 3.41Å |
| 192 | I | 64.3 | Low | 59.7 | Low | 77 Ų | 77 | 115.3 Ų | 115.3 | 40% | 0.395 | 62% | 0.619 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -93 | 125.4 | 165.6 | -59.2 | 171.2 | 0 | 0 | 0 | 106.3 | Y190 Q201 F203 | Y190-I192 HydrophobicContact CD2-CG1 4Å; Y190-I192 HydrophobicContact CE2-CD1 3.67Å; Y190-I192 HydrophobicContact CE2-CG1 3.52Å; I192-Q201 PolarHBondContact N-O 3.5Å; I192-Q201 PolarHBondContact O-N 2.92Å; I192-Q201 VanDerWaalsContact O-N 3.11Å; I192-F203 HydrophobicContact CB-CE2 4.46Å; I192-F203 HydrophobicContact CD1-CD2 3.97Å; I192-F203 HydrophobicContact CD1-CE2 3.88Å; I192-F203 HydrophobicContact CG1-CD2 4.29Å; I192-F203 HydrophobicContact CG1-CE2 4.38Å |
| 193 | Q | 66.1 | Low | 60.7 | Low | 117 Ų | 117 | 115.7 Ų | 115.7 | 55% | 0.547 | 61% | 0.612 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -104.4 | 123.7 | 177.2 | -171.3 | 164.8 | 19.4 | 0 | 0 | 108.3 | I200 | Q193-I200 HydrophobicContact CB-CG1 4.49Å; Q193-I200 HydrophobicContact CG-CG1 4.26Å |
| 194 | D | 61.5 | Low | 61.3 | Low | 98 Ų | 98 | 112.8 Ų | 112.8 | 52% | 0.524 | 60% | 0.601 | S | S | . | * | trans | -70.9 | 149.3 | 177.1 | -74.5 | -21.6 | 0 | 0 | 0 | 110.8 | N196 G197 | D194-N196 PolarHBondContact O-N 3Å; D194-G197 PolarHBondContact O-N 3.36Å | ||
| 195 | D | 62.4 | Low | 61.7 | Low | 179 Ų | 179 | 110.7 Ų | 110.7 | 96% | 0.957 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57 | -12.8 | -174 | -72.3 | -31 | 0 | 0 | 0 | 114.9 | ||
| 196 | N | 63.3 | Low | 62 | Low | 162 Ų | 162 | 108.3 Ų | 108.3 | 87% | 0.866 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.9 | 10.7 | 176.3 | -111.9 | 27.1 | 0 | 0 | 0 | 115.1 | D194 S198 | D194-N196 PolarHBondContact O-N 3Å; N196-S198 PolarHBondContact O-N 3.36Å |
| 197 | G | 62.8 | Low | 62.1 | Low | 50 Ų | 50 | 103.2 Ų | 103.2 | 52% | 0.515 | 57% | 0.574 | S | S | . | * | S | Bend | trans | 77.5 | 14.4 | 149 | 0 | 0 | 0 | 0 | 0 | 119.5 | D194 | D194-G197 PolarHBondContact O-N 3.36Š|
| 198 | S | 60.6 | Low | 62 | Low | 113 Ų | 113 | 104.1 Ų | 104.1 | 79% | 0.79 | 58% | 0.579 | S | S | * | * | S | Bend | trans | -131.5 | -11.1 | 177 | 66.9 | 0 | 0 | 0 | 0 | 117.4 | N196 | N196-S198 PolarHBondContact O-N 3.36Š|
| 199 | D | 58.7 | Low | 62.1 | Low | 111 Ų | 111 | 103.6 Ų | 103.6 | 59% | 0.594 | 58% | 0.582 | S | S | * | * | trans | -120.1 | 123.4 | -179.6 | -126 | -13.9 | 0 | 0 | 0 | 110.5 | ||||
| 200 | I | 64.2 | Low | 61.8 | Low | 92 Ų | 92 | 103.9 Ų | 103.9 | 47% | 0.472 | 59% | 0.591 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -110.3 | 108.5 | 177.2 | -58.6 | 173.3 | 0 | 0 | 0 | 107.2 | Q193 | Q193-I200 HydrophobicContact CB-CG1 4.49Å; Q193-I200 HydrophobicContact CG-CG1 4.26Å |
| 201 | Q | 68.4 | Low | 61.6 | Low | 110 Ų | 110 | 102.7 Ų | 102.7 | 51% | 0.514 | 60% | 0.596 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -85.4 | 115.8 | 172.4 | -76.5 | -177.1 | 8.5 | 0 | 0 | 109.7 | G191 I192 F203 | G191-Q201 WeakPolarHBondContact CA-O 3.41Å; I192-Q201 PolarHBondContact N-O 3.5Å; I192-Q201 PolarHBondContact O-N 2.92Å; I192-Q201 VanDerWaalsContact O-N 3.11Å; Q201-F203 HydrophobicContact CB-CD2 4.39Å; Q201-F203 HydrophobicContact CB-CE2 3.62Å; Q201-F203 HydrophobicContact CB-CZ 4.06Å; Q201-F203 WeakPolarHBondContact O-CD2 3.41Å |
| 202 | N | 67.3 | Low | 61.2 | Low | 114 Ų | 114 | 105.7 Ų | 105.7 | 61% | 0.61 | 60% | 0.602 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -87.1 | 116.7 | 177.2 | -69.3 | -41.4 | 0 | 0 | 0 | 109.9 | I189 | I189-N202 HydrophobicContact CG2-CB 3.85Å |
| 203 | F | 67.5 | Low | 61 | Low | 86 Ų | 86 | 105.6 Ų | 105.6 | 38% | 0.377 | 61% | 0.605 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -102.3 | 126.3 | 173 | -64.9 | -86.7 | 0 | 0 | 0 | 109.4 | Y190 I192 Q201 | Y190-F203 HydrophobicContact CD1-CB 4.33Å; Y190-F203 HydrophobicContact CE1-CB 3.78Å; Y190-F203 PolarHBondContact N-O 3.3Å; Y190-F203 PolarHBondContact O-N 3.19Å; I192-F203 HydrophobicContact CB-CE2 4.46Å; I192-F203 HydrophobicContact CD1-CD2 3.97Å; I192-F203 HydrophobicContact CD1-CE2 3.88Å; I192-F203 HydrophobicContact CG1-CD2 4.29Å; I192-F203 HydrophobicContact CG1-CE2 4.38Å; Q201-F203 HydrophobicContact CB-CD2 4.39Å; Q201-F203 HydrophobicContact CB-CE2 3.62Å; Q201-F203 HydrophobicContact CB-CZ 4.06Å; Q201-F203 WeakPolarHBondContact O-CD2 3.41Å |
| 204 | A | 61.6 | Low | 60.6 | Low | 74 Ų | 74 | 103.6 Ų | 103.6 | 61% | 0.612 | 60% | 0.597 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -93.6 | 111.5 | 173.5 | 0 | 0 | 0 | 0 | 0 | 109 | ||
| 205 | L | 57.8 | Low | 60.6 | Low | 85 Ų | 85 | 103.1 Ų | 103.1 | 45% | 0.445 | 60% | 0.598 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -92 | 111.8 | 174.6 | -135.4 | 81.6 | 0 | 0 | 0 | 109.2 | L188 Y190 L207 | L188-L205 PolarHBondContact O-N 2.9Å; L188-L205 VanDerWaalsContact O-N 3.17Å; Y190-L205 HydrophobicContact CE1-CD1 4.24Å; L205-L207 HydrophobicContact CD2-CD2 4.28Å; L205-L207 PolarHBondContact O-N 2.95Å |
| 206 | D | 57.5 | Low | 60.7 | Low | 124 Ų | 124 | 102.4 Ų | 102.4 | 66% | 0.663 | 58% | 0.581 | S | S | * | * | trans | -88.1 | 93.7 | 172 | -165 | 13.6 | 0 | 0 | 0 | 109 | T208 | D206-T208 PolarHBondContact O-N 3.4Š| ||
| 207 | L | 56.5 | Low | 60.8 | Low | 126 Ų | 126 | 98.5 Ų | 98.5 | 66% | 0.66 | 56% | 0.564 | S | S | * | * | trans | -69.3 | 95.4 | 176.9 | -72.3 | 164.4 | 0 | 0 | 0 | 108.6 | L205 P209 | L205-L207 HydrophobicContact CD2-CD2 4.28Å; L205-L207 PolarHBondContact O-N 2.95Å; L207-P209 WeakPolarHBondContact O-CD 3.47Å | ||
| 208 | T | 54.7 | Low | 61.1 | Low | 97 Ų | 97 | 104 Ų | 104 | 60% | 0.595 | 57% | 0.569 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 118.8 | 172.1 | -57.9 | 0 | 0 | 0 | 0 | 108.2 | D206 | D206-T208 PolarHBondContact O-N 3.4Š|
| 209 | P | 59.4 | Low | 61.6 | Low | 102 Ų | 102 | 105.8 Ų | 105.8 | 66% | 0.662 | 57% | 0.565 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 147.7 | 174.6 | 25 | -32.1 | 0 | 0 | 0 | 109.7 | L207 | L207-P209 WeakPolarHBondContact O-CD 3.47Š|
| 210 | P | 55.9 | Low | 62.3 | Low | 114 Ų | 114 | 101.1 Ų | 101.1 | 74% | 0.74 | 54% | 0.543 | S | S | * | . | P | Polyproline II helix | trans | -56.3 | 140.1 | 177.1 | 24.4 | -32.8 | 0 | 0 | 0 | 109.5 | ||
| 211 | P | 58.3 | Low | 62.8 | Low | 81 Ų | 81 | 99.5 Ų | 99.5 | 53% | 0.526 | 54% | 0.537 | S | S | . | . | P | Polyproline II helix | trans | -64.5 | 140.3 | -176.5 | 27.7 | -34.7 | 0 | 0 | 0 | 110.7 | V169 V213 | V169-P211 HydrophobicContact CG1-CB 3.79Å; V169-P211 HydrophobicContact CG1-CG 4.13Å; P211-V213 WeakPolarHBondContact O-CG2 3.32Å; P211-V213 PolarHBondContact O-N 3.27Å |
| 212 | D | 56.7 | Low | 62.9 | Low | 108 Ų | 108 | 95 Ų | 95 | 58% | 0.578 | 52% | 0.518 | S | S | * | . | trans | -58.9 | 108.1 | 171.5 | -80.4 | -1.8 | 0 | 0 | 0 | 109.9 | K170 | K170-D212 HydrophobicContact CB-CB 4.39Å; K170-D212 WeakPolarHBondContact CB-O 3.47Å; K170-D212 HydrophobicContact CD-CB 3.91Å; K170-D212 HydrophobicContact CG-CB 4.38Å; K170-D212 PolarHBondContact N-O 3.05Å; K170-D212 IonicContact NZ-OD2 3.75Å | ||
| 213 | V | 59.5 | Low | 62.9 | Low | 74 Ų | 74 | 96.4 Ų | 96.4 | 45% | 0.448 | 53% | 0.525 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.5 | 121 | 175 | -172.7 | 0 | 0 | 0 | 0 | 108.6 | L167 P211 | L167-V213 HydrophobicContact CB-CG1 3.73Å; L167-V213 HydrophobicContact CD2-CG1 3.84Å; L167-V213 HydrophobicContact CG-CG1 4.25Å; P211-V213 WeakPolarHBondContact O-CG2 3.32Å; P211-V213 PolarHBondContact O-N 3.27Å |
| 214 | L | 58.9 | Low | 62.6 | Low | 76 Ų | 76 | 93.5 Ų | 93.5 | 40% | 0.398 | 52% | 0.52 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99 | 115.8 | 172.2 | -159.1 | 134.2 | 0 | 0 | 0 | 108.6 | I168 K170 R216 | I168-L214 PolarHBondContact N-O 3.25Å; I168-L214 PolarHBondContact O-N 3.42Å; K170-L214 HydrophobicContact CG-CB 4.47Å; L214-R216 HydrophobicContact CD2-CG 3.75Å; L214-R216 PolarHBondContact O-N 3.01Å |
| 215 | V | 60.4 | Low | 62.9 | Low | 87 Ų | 87 | 91.6 Ų | 91.6 | 53% | 0.527 | 50% | 0.499 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.7 | 115.5 | 175.2 | -172.4 | 0 | 0 | 0 | 0 | 108 | L167 | L167-V215 HydrophobicContact CD2-CG2 3.81Å |
| 216 | R | 63.9 | Low | 63.5 | Low | 164 Ų | 164 | 87.8 Ų | 87.8 | 62% | 0.619 | 48% | 0.479 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -108.1 | 127.3 | 166.6 | -80.1 | -159.3 | -175.2 | 164.5 | -0 | 109.9 | Q166 I168 L214 | Q166-R216 PolarHBondContact N-O 3.12Å; Q166-R216 PolarHBondContact O-N 3.25Å; Q166-R216 VanDerWaalsContact O-N 3.08Å; I168-R216 HydrophobicContact CD1-CB 4.08Å; I168-R216 HydrophobicContact CD1-CG 4.09Å; L214-R216 HydrophobicContact CD2-CG 3.75Å; L214-R216 PolarHBondContact O-N 3.01Å |
| 217 | T | 65.9 | Low | 63.9 | Low | 80 Ų | 80 | 82 Ų | 82 | 49% | 0.491 | 45% | 0.448 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.7 | 123.3 | 168.5 | 49.5 | 0 | 0 | 0 | 0 | 109.1 | D139 T163 | D139-T217 WeakPolarHBondContact OD2-CG2 3.49Å; T163-T217 HydrophobicContact CG2-CG2 3.9Å |
| 218 | R | 69.6 | Low | 64.3 | Low | 167 Ų | 167 | 76.6 Ų | 76.6 | 63% | 0.63 | 42% | 0.419 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -114.4 | 143.6 | 173.5 | -166 | 179 | -179 | -166.7 | -1.3 | 110 | R164 G220 | R164-R218 PolarHBondContact N-O 3.42Å; R164-R218 PolarHBondContact O-N 3.36Å; R218-G220 PolarHBondContact O-N 2.68Å |
| 219 | E | 71.5 | Confident | 65.2 | Low | 150 Ų | 150 | 72 Ų | 72 | 70% | 0.701 | 39% | 0.391 | S | S | * | . | trans | -58.6 | 127.4 | 169.2 | -45.5 | -167.6 | 151.7 | 0 | 0 | 109.3 | Y161 | Y161-E219 HydrophobicContact CE2-CB 4.21Å; Y161-E219 WeakPolarHBondContact OH-CB 3.47Å; Y161-E219 VanDerWaalsContact OH-CG 3.26Å; Y161-E219 WeakPolarHBondContact OH-CG 3.42Å | ||
| 220 | G | 72.9 | Confident | 66.1 | Low | 13 Ų | 13 | 67.4 Ų | 67.4 | 13% | 0.134 | 36% | 0.361 | C | S | . | . | trans | -138.4 | 160.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | Q162 R218 | Q162-G220 CarbonylContact C-O 3.18Å; Q162-G220 PolarHBondContact N-O 3.02Å; Q162-G220 CarbonylContact O-C 2.94Å; Q162-G220 WeakPolarHBondContact O-CA 3.38Å; Q162-G220 PolarHBondContact O-N 3.11Å; R218-G220 PolarHBondContact O-N 2.68Å | ||
| 221 | T | 75.6 | Confident | 66.9 | Low | 58 Ų | 58 | 62.5 Ų | 62.5 | 36% | 0.356 | 33% | 0.329 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.4 | 147.3 | 165.8 | 53.7 | 0 | 0 | 0 | 0 | 108.9 | Q160 R164 | Q160-T221 CarbonylContact O-C 3.24Å; Q160-T221 VanDerWaalsContact O-CA 3.27Å; Q160-T221 WeakPolarHBondContact O-CA 3.36Å; R164-T221 PolarHBondContact NH2-O 3.37Å |
| 222 | S | 69.5 | Low | 67.8 | Low | 14 Ų | 14 | 60.4 Ų | 60.4 | 10% | 0.098 | 31% | 0.313 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111 | 146.3 | 162.5 | 39.4 | 0 | 0 | 0 | 0 | 110.2 | Q159 Q160 Q162 G224 | Q159-S222 WeakPolarHBondContact CA-O 3.35Å; Q160-S222 WeakPolarHBondContact CG-OG 3.43Å; Q160-S222 PolarHBondContact N-O 2.9Å; Q160-S222 PolarHBondContact NE2-OG 3.14Å; Q160-S222 PolarHBondContact O-N 3.47Å; Q162-S222 PolarHBondContact OE1-OG 3.33Å; S222-G224 PolarHBondContact O-N 3.38Å |
| 223 | D | 66.9 | Low | 69.3 | Low | 144 Ų | 144 | 59.4 Ų | 59.4 | 77% | 0.77 | 30% | 0.304 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -72.5 | 123.7 | 174.3 | -65.5 | -32.1 | 0 | 0 | 0 | 108.4 | ||
| 224 | G | 62.5 | Low | 70.5 | Confident | 25 Ų | 25 | 55.9 Ų | 55.9 | 26% | 0.258 | 28% | 0.282 | S | S | . | . | S | Bend | trans | 148.9 | 140.1 | -170.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | F158 Q159 Q160 S222 N226 | F158-G224 CarbonylContact C-O 3.59Å; F158-G224 VanDerWaalsContact C-O 3.24Å; F158-G224 CarbonylContact O-C 3.54Å; F158-G224 PolarHBondContact O-N 2.93Å; Q159-G224 CarbonylContact C-O 3.28Å; Q159-G224 WeakPolarHBondContact CA-O 3.3Å; Q159-G224 PolarHBondContact N-O 3.4Å; Q159-G224 VanDerWaalsContact N-O 3.09Å; Q160-G224 PolarHBondContact N-O 3.06Å; Q160-G224 VanDerWaalsContact N-O 3.15Å; S222-G224 PolarHBondContact O-N 3.38Å; G224-N226 PolarHBondContact O-N 2.96Å |
| 225 | M | 67.1 | Low | 71.3 | Confident | 35 Ų | 35 | 53.3 Ų | 53.3 | 17% | 0.172 | 27% | 0.272 | C | S | . | . | trans | -67.1 | 125.1 | -179.7 | -178.4 | 169.8 | 57.7 | 0 | 0 | 110.8 | I67 L68 A156 T157 V227 I230 | I67-M225 HydrophobicContact CB-CE 3.69Å; I67-M225 HydrophobicContact CD1-CE 4.41Å; I67-M225 HydrophobicContact CG1-CE 4.48Å; I67-M225 HydrophobicContact CG2-CE 3.59Å; L68-M225 HydrophobicContact CB-SD 3.86Å; L68-M225 HydrophobicContact CD1-SD 3.99Å; L68-M225 HydrophobicContact CG-SD 4.43Å; A156-M225 CarbonylContact O-C 3.57Å; T157-M225 WeakPolarHBondContact O-CB 3.27Å; T157-M225 WeakPolarHBondContact O-CG 3.2Å; M225-V227 VanDerWaalsContact C-N 3.26Å; M225-V227 HydrophobicContact CB-CG2 4.11Å; M225-V227 HydrophobicContact CE-CG2 3.36Å; M225-V227 HydrophobicContact CG-CG2 3.74Å; M225-V227 PolarHBondContact O-N 2.9Å; M225-V227 HydrophobicContact SD-CG2 4.15Å; M225-I230 HydrophobicContact CG-CD1 3.62Å; M225-I230 HydrophobicContact SD-CD1 3.86Å | ||
| 226 | N | 71.3 | Confident | 72.5 | Confident | 5 Ų | 5 | 52.9 Ų | 52.9 | 3% | 0.027 | 27% | 0.269 | C | S | . | . | trans | -75.7 | 80.2 | 168.3 | 178.2 | 7.5 | 0 | 0 | 0 | 110 | N147 A156 Q159 Q160 G224 L228 G229 I230 | N147-N226 PolarHBondContact O-ND2 3.48Å; N147-N226 PolarHBondContact O-OD1 3.21Å; N147-N226 PolarHBondContact OD1-ND2 3.28Å; A156-N226 HydrophobicContact CB-CB 4.13Å; A156-N226 PolarHBondContact O-N 2.98Å; Q159-N226 WeakPolarHBondContact O-CB 3.43Å; Q160-N226 HydrophobicContact CB-CB 3.81Å; G224-N226 PolarHBondContact O-N 2.96Å; N226-L228 VanDerWaalsContact C-N 3.31Å; N226-L228 PolarHBondContact O-N 3.42Å; N226-L228 PolarHBondContact OD1-N 3.42Å; N226-G229 PolarHBondContact O-N 2.99Å; N226-G229 PolarHBondContact OD1-N 3.38Å; N226-I230 WeakPolarHBondContact O-CD1 3.39Å; N226-I230 WeakPolarHBondContact O-CG1 3.4Å; N226-I230 PolarHBondContact O-N 3.4Å | ||
| 227 | V | 65.5 | Low | 73.7 | Confident | 3 Ų | 3 | 48 Ų | 48 | 2% | 0.018 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -68.3 | -32.7 | -177.2 | -168 | 0 | 0 | 0 | 0 | 112.1 | M225 G229 I230 V231 I437 | M225-V227 VanDerWaalsContact C-N 3.26Å; M225-V227 HydrophobicContact CB-CG2 4.11Å; M225-V227 HydrophobicContact CE-CG2 3.36Å; M225-V227 HydrophobicContact CG-CG2 3.74Å; M225-V227 PolarHBondContact O-N 2.9Å; M225-V227 HydrophobicContact SD-CG2 4.15Å; V227-G229 PolarHBondContact O-N 2.74Å; V227-I230 WeakPolarHBondContact O-CB 3.44Å; V227-I230 PolarHBondContact O-N 3.01Å; V227-V231 HydrophobicContact CG1-CG2 4.08Å; V227-V231 VanDerWaalsContact O-CG2 3.27Å; V227-V231 WeakPolarHBondContact O-CG2 3.42Å; V227-V231 PolarHBondContact O-N 2.92Å; V227-I437 HydrophobicContact CB-CB 4.17Å; V227-I437 HydrophobicContact CB-CD1 4.01Å; V227-I437 HydrophobicContact CB-CG1 3.61Å; V227-I437 HydrophobicContact CB-CG2 3.83Å; V227-I437 HydrophobicContact CG1-CB 4.43Å; V227-I437 HydrophobicContact CG1-CD1 3.32Å; V227-I437 HydrophobicContact CG1-CG1 3.51Å; V227-I437 HydrophobicContact CG1-CG2 4.19Å; V227-I437 HydrophobicContact CG2-CG1 3.84Å |
| 228 | L | 64.8 | Low | 74.6 | Confident | 11 Ų | 11 | 44.2 Ų | 44.2 | 6% | 0.058 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -59.2 | -47.7 | 178.2 | 179.3 | 65.8 | 0 | 0 | 0 | 111.9 | L144 M148 N226 I230 V231 I232 T416 A419 | L144-L228 HydrophobicContact CD1-CD2 3.27Å; L144-L228 HydrophobicContact CG-CD2 4.26Å; M148-L228 HydrophobicContact CG-CD2 3.68Å; M148-L228 HydrophobicContact CG-CG 4.1Å; N226-L228 VanDerWaalsContact C-N 3.31Å; N226-L228 PolarHBondContact O-N 3.42Å; N226-L228 PolarHBondContact OD1-N 3.42Å; L228-I230 VanDerWaalsContact C-N 3.31Å; L228-I230 PolarHBondContact O-N 3.34Å; L228-V231 PolarHBondContact O-N 2.88Å; L228-I232 HydrophobicContact CD1-CD1 4.04Å; L228-I232 HydrophobicContact CG-CD1 4.15Å; L228-I232 WeakPolarHBondContact O-CG1 3.41Å; L228-I232 PolarHBondContact O-N 3.33Å; L228-T416 HydrophobicContact CD1-CG2 4.49Å; L228-T416 HydrophobicContact CD2-CG2 4.41Å; L228-A419 HydrophobicContact CD1-CB 4.48Å |
| 229 | G | 73.8 | Confident | 75.2 | Confident | 0 Ų | 0 | 39.3 Ų | 39.3 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -62 | -39.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | N147 N226 V227 F233 | N147-G229 WeakPolarHBondContact O-CA 3.42Å; N147-G229 PolarHBondContact O-N 3.46Å; N226-G229 PolarHBondContact O-N 2.99Å; N226-G229 PolarHBondContact OD1-N 3.38Å; V227-G229 PolarHBondContact O-N 2.74Å; G229-F233 VanDerWaalsContact O-CB 3.3Å; G229-F233 WeakPolarHBondContact O-CB 3.28Å; G229-F233 PolarHBondContact O-N 2.9Å |
| 230 | I | 78.3 | Confident | 76 | Confident | 7 Ų | 7 | 36.5 Ų | 36.5 | 4% | 0.036 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -63.7 | -45.8 | 175.8 | -65.7 | 163.9 | 0 | 0 | 0 | 110.7 | L68 V71 V72 A156 T157 M225 N226 V227 L228 I232 F233 S234 | L68-I230 HydrophobicContact CD1-CD1 3.7Å; L68-I230 HydrophobicContact CD1-CG2 4.34Å; V71-I230 HydrophobicContact CG1-CG2 4.38Å; V72-I230 HydrophobicContact CG2-CG2 3.46Å; V72-I230 VanDerWaalsContact CG2-CG2 3.46Å; A156-I230 HydrophobicContact CB-CG1 4.37Å; T157-I230 HydrophobicContact CG2-CD1 4.4Å; M225-I230 HydrophobicContact CG-CD1 3.62Å; M225-I230 HydrophobicContact SD-CD1 3.86Å; N226-I230 WeakPolarHBondContact O-CD1 3.39Å; N226-I230 WeakPolarHBondContact O-CG1 3.4Å; N226-I230 PolarHBondContact O-N 3.4Å; V227-I230 WeakPolarHBondContact O-CB 3.44Å; V227-I230 PolarHBondContact O-N 3.01Å; L228-I230 VanDerWaalsContact C-N 3.31Å; L228-I230 PolarHBondContact O-N 3.34Å; I230-I232 PolarHBondContact O-N 2.97Å; I230-F233 PolarHBondContact O-N 3.12Å; I230-S234 VanDerWaalsContact O-CB 3.25Å; I230-S234 WeakPolarHBondContact O-CB 3.47Å; I230-S234 PolarHBondContact O-N 3.42Å; I230-S234 PolarHBondContact O-OG 3.1Å; I230-S234 VanDerWaalsContact O-OG 3.1Å |
| 231 | V | 72.5 | Confident | 76.7 | Confident | 11 Ų | 11 | 36.2 Ų | 36.2 | 7% | 0.067 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -58.9 | -49.6 | 178.2 | 166.6 | 0 | 0 | 0 | 0 | 110.8 | V71 L75 V227 L228 S234 A235 | V71-V231 HydrophobicContact CG1-CG2 3.63Å; L75-V231 HydrophobicContact CD1-CB 3.99Å; L75-V231 HydrophobicContact CD1-CG1 3.78Å; L75-V231 HydrophobicContact CD1-CG2 3.92Å; V227-V231 HydrophobicContact CG1-CG2 4.08Å; V227-V231 VanDerWaalsContact O-CG2 3.27Å; V227-V231 WeakPolarHBondContact O-CG2 3.42Å; V227-V231 PolarHBondContact O-N 2.92Å; L228-V231 PolarHBondContact O-N 2.88Å; V231-S234 PolarHBondContact O-N 3.38Å; V231-A235 WeakPolarHBondContact O-CB 3.31Å; V231-A235 PolarHBondContact O-N 3.35Å |
| 232 | I | 77 | Confident | 77.1 | Confident | 37 Ų | 37 | 34.1 Ų | 34.1 | 19% | 0.19 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -65.4 | -42.4 | -178.2 | -71 | 171.5 | 0 | 0 | 0 | 111.5 | M148 L228 I230 T236 | M148-I232 HydrophobicContact CB-CD1 3.43Å; M148-I232 VanDerWaalsContact CB-CD1 3.43Å; M148-I232 HydrophobicContact CE-CD1 3.46Å; M148-I232 VanDerWaalsContact CE-CD1 3.46Å; M148-I232 HydrophobicContact CG-CD1 3.37Å; M148-I232 HydrophobicContact SD-CD1 4.21Å; L228-I232 HydrophobicContact CD1-CD1 4.04Å; L228-I232 HydrophobicContact CG-CD1 4.15Å; L228-I232 WeakPolarHBondContact O-CG1 3.41Å; L228-I232 PolarHBondContact O-N 3.33Å; I230-I232 PolarHBondContact O-N 2.97Å; I232-T236 WeakPolarHBondContact O-CB 3.35Å; I232-T236 PolarHBondContact O-N 3.17Å; I232-T236 PolarHBondContact O-OG1 3.43Å |
| 233 | F | 88.8 | Confident | 77.8 | Confident | 87 Ų | 87 | 41.6 Ų | 41.6 | 38% | 0.382 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -62.1 | -52.6 | 175.1 | 172.2 | -99.7 | 0 | 0 | 0 | 111.6 | L153 G229 I230 A235 T236 M237 | L153-F233 HydrophobicContact CD1-CD1 3.89Å; L153-F233 HydrophobicContact CD1-CD2 3.68Å; L153-F233 HydrophobicContact CD1-CE1 3.66Å; L153-F233 HydrophobicContact CD1-CE2 3.44Å; L153-F233 VanDerWaalsContact CD1-CE2 3.44Å; L153-F233 HydrophobicContact CD1-CG 3.9Å; L153-F233 HydrophobicContact CD1-CZ 3.42Å; L153-F233 VanDerWaalsContact CD1-CZ 3.42Å; L153-F233 HydrophobicContact CD2-CB 3.76Å; L153-F233 HydrophobicContact CD2-CD1 3.86Å; L153-F233 HydrophobicContact CD2-CD2 3.88Å; L153-F233 HydrophobicContact CD2-CE1 4.47Å; L153-F233 HydrophobicContact CD2-CE2 4.49Å; L153-F233 HydrophobicContact CD2-CG 3.52Å; L153-F233 HydrophobicContact CG-CD2 4.39Å; L153-F233 HydrophobicContact CG-CG 4.37Å; G229-F233 VanDerWaalsContact O-CB 3.3Å; G229-F233 WeakPolarHBondContact O-CB 3.28Å; G229-F233 PolarHBondContact O-N 2.9Å; I230-F233 PolarHBondContact O-N 3.12Å; F233-A235 VanDerWaalsContact C-N 3.28Å; F233-A235 PolarHBondContact O-N 2.88Å; F233-T236 PolarHBondContact O-N 2.92Å; F233-M237 VanDerWaalsContact O-CB 3.31Å; F233-M237 WeakPolarHBondContact O-CB 3.38Å; F233-M237 PolarHBondContact O-N 3.3Å |
| 234 | S | 83.6 | Confident | 78.7 | Confident | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -61.3 | -37.4 | 179.8 | -70.3 | 0 | 0 | 0 | 0 | 112.1 | V72 M76 I230 V231 G238 | V72-S234 WeakPolarHBondContact CA-OG 3.35Å; M76-S234 WeakPolarHBondContact CG-O 3.49Å; I230-S234 VanDerWaalsContact O-CB 3.25Å; I230-S234 WeakPolarHBondContact O-CB 3.47Å; I230-S234 PolarHBondContact O-N 3.42Å; I230-S234 PolarHBondContact O-OG 3.1Å; I230-S234 VanDerWaalsContact O-OG 3.1Å; V231-S234 PolarHBondContact O-N 3.38Å; S234-G238 PolarHBondContact O-N 3.04Å |
| 235 | A | 76.4 | Confident | 79.7 | Confident | 22 Ų | 22 | 39.9 Ų | 39.9 | 18% | 0.182 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -65.2 | -50 | 176 | 0 | 0 | 0 | 0 | 0 | 111.5 | L79 V231 F233 M237 G238 I239 | L79-A235 VanDerWaalsContact CD1-CA 3.45Å; L79-A235 HydrophobicContact CD1-CB 3.5Å; L79-A235 WeakPolarHBondContact CD1-O 3.28Å; V231-A235 WeakPolarHBondContact O-CB 3.31Å; V231-A235 PolarHBondContact O-N 3.35Å; F233-A235 VanDerWaalsContact C-N 3.28Å; F233-A235 PolarHBondContact O-N 2.88Å; A235-M237 VanDerWaalsContact C-N 3.32Å; A235-M237 PolarHBondContact O-N 3.43Å; A235-G238 PolarHBondContact O-N 3Å; A235-I239 WeakPolarHBondContact O-CG1 3.38Å; A235-I239 PolarHBondContact O-N 3.24Å |
| 236 | T | 85.5 | Confident | 80.7 | Confident | 77 Ų | 77 | 43.3 Ų | 43.3 | 47% | 0.472 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -59.8 | -45 | 178 | -56.6 | 0 | 0 | 0 | 0 | 110.9 | I232 F233 I239 M240 | I232-T236 WeakPolarHBondContact O-CB 3.35Å; I232-T236 PolarHBondContact O-N 3.17Å; I232-T236 PolarHBondContact O-OG1 3.43Å; F233-T236 PolarHBondContact O-N 2.92Å; T236-I239 PolarHBondContact O-N 2.96Å; T236-M240 WeakPolarHBondContact O-CG 3.47Å; T236-M240 PolarHBondContact O-N 3.5Å |
| 237 | M | 89.2 | Confident | 81.6 | Confident | 62 Ų | 62 | 49.7 Ų | 49.7 | 31% | 0.305 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -63.7 | -43.2 | 177.9 | -169.2 | 64.4 | -178 | 0 | 0 | 111.7 | M76 F233 A235 I239 M240 L241 L251 | M76-M237 HydrophobicContact CE-CB 4.32Å; M76-M237 HydrophobicContact CE-CG 3.61Å; M76-M237 HydrophobicContact CG-CB 4.49Å; M76-M237 HydrophobicContact SD-CG 4.45Å; F233-M237 VanDerWaalsContact O-CB 3.31Å; F233-M237 WeakPolarHBondContact O-CB 3.38Å; F233-M237 PolarHBondContact O-N 3.3Å; A235-M237 VanDerWaalsContact C-N 3.32Å; A235-M237 PolarHBondContact O-N 3.43Å; M237-I239 PolarHBondContact O-N 3.46Å; M237-M240 PolarHBondContact O-N 2.98Å; M237-L241 HydrophobicContact CE-CD1 4.36Å; M237-L241 HydrophobicContact CE-CD2 4.11Å; M237-L241 HydrophobicContact CE-CG 4.2Å; M237-L241 HydrophobicContact CG-CD1 4.15Å; M237-L241 HydrophobicContact CG-CG 4.44Å; M237-L241 WeakPolarHBondContact O-CB 3.41Å; M237-L241 VanDerWaalsContact O-CG 3.27Å; M237-L241 WeakPolarHBondContact O-CG 3.48Å; M237-L241 PolarHBondContact O-N 3.44Å; M237-L251 HydrophobicContact CE-CD2 3.94Å |
| 238 | G | 84.3 | Confident | 82.7 | Confident | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -57.5 | -47.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | M76 A80 S234 A235 M240 L241 G242 | M76-G238 WeakPolarHBondContact O-CA 3.29Å; A80-G238 WeakPolarHBondContact CA-O 3.43Å; A80-G238 VanDerWaalsContact CB-O 3.29Å; A80-G238 WeakPolarHBondContact CB-O 3.36Å; A80-G238 PolarHBondContact N-O 2.94Å; S234-G238 PolarHBondContact O-N 3.04Å; A235-G238 PolarHBondContact O-N 3Å; G238-M240 VanDerWaalsContact C-N 3.34Å; G238-M240 PolarHBondContact O-N 3.23Å; G238-L241 PolarHBondContact O-N 3.48Å; G238-G242 PolarHBondContact O-N 2.92Å |
| 239 | I | 82.1 | Confident | 83.8 | Confident | 64 Ų | 64 | 51.7 Ų | 51.7 | 33% | 0.328 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -61.9 | -42.1 | 176.9 | -63.3 | 167.4 | 0 | 0 | 0 | 111.2 | L79 A235 T236 M237 G242 R243 | L79-I239 HydrophobicContact CB-CG1 4.04Å; L79-I239 HydrophobicContact CD1-CD1 4.2Å; L79-I239 HydrophobicContact CD1-CG1 4.01Å; A235-I239 WeakPolarHBondContact O-CG1 3.38Å; A235-I239 PolarHBondContact O-N 3.24Å; T236-I239 PolarHBondContact O-N 2.96Å; M237-I239 PolarHBondContact O-N 3.46Å; I239-G242 PolarHBondContact O-N 3.36Å; I239-R243 VanDerWaalsContact CG2-NH1 3.26Å; I239-R243 PolarHBondContact O-N 3.38Å; I239-R243 VanDerWaalsContact O-N 3.17Å |
| 240 | M | 88.6 | Confident | 84.8 | Confident | 92 Ų | 92 | 55.2 Ų | 55.2 | 45% | 0.453 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -64.4 | -42.6 | 177.1 | -69.9 | -55.8 | 106 | 0 | 0 | 111.6 | T236 M237 G238 G242 R243 M244 | T236-M240 WeakPolarHBondContact O-CG 3.47Å; T236-M240 PolarHBondContact O-N 3.5Å; M237-M240 PolarHBondContact O-N 2.98Å; G238-M240 VanDerWaalsContact C-N 3.34Å; G238-M240 PolarHBondContact O-N 3.23Å; M240-G242 PolarHBondContact O-N 3.35Å; M240-R243 WeakPolarHBondContact O-CA 3.26Å; M240-R243 PolarHBondContact O-N 2.95Å; M240-M244 WeakPolarHBondContact O-CG 3.49Å; M240-M244 PolarHBondContact O-N 3.44Å |
| 241 | L | 88.3 | Confident | 85.5 | Confident | 6 Ų | 6 | 58.1 Ų | 58.1 | 3% | 0.031 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -62.9 | -40.4 | 177.7 | -71.8 | 170.1 | 0 | 0 | 0 | 112.5 | M76 A80 M237 G238 R243 M244 L251 V252 | M76-L241 HydrophobicContact CE-CD1 3.6Å; A80-L241 HydrophobicContact CB-CB 4.13Å; M237-L241 HydrophobicContact CE-CD1 4.36Å; M237-L241 HydrophobicContact CE-CD2 4.11Å; M237-L241 HydrophobicContact CE-CG 4.2Å; M237-L241 HydrophobicContact CG-CD1 4.15Å; M237-L241 HydrophobicContact CG-CG 4.44Å; M237-L241 WeakPolarHBondContact O-CB 3.41Å; M237-L241 VanDerWaalsContact O-CG 3.27Å; M237-L241 WeakPolarHBondContact O-CG 3.48Å; M237-L241 PolarHBondContact O-N 3.44Å; G238-L241 PolarHBondContact O-N 3.48Å; L241-R243 VanDerWaalsContact C-N 3.26Å; L241-R243 PolarHBondContact O-N 2.98Å; L241-M244 HydrophobicContact CD2-SD 4.06Å; L241-M244 PolarHBondContact O-N 2.96Å; L241-L251 HydrophobicContact CD1-CB 4.36Å; L241-L251 HydrophobicContact CD1-CD2 3.77Å; L241-L251 HydrophobicContact CD1-CG 3.99Å; L241-L251 HydrophobicContact CD2-CB 4.12Å; L241-L251 HydrophobicContact CD2-CD2 3.78Å; L241-L251 HydrophobicContact CD2-CG 4.36Å; L241-L251 HydrophobicContact CG-CD2 4.38Å; L241-V252 HydrophobicContact CB-CG2 3.88Å; L241-V252 HydrophobicContact CD1-CG2 4.44Å |
| 242 | G | 82.4 | Confident | 86.3 | Confident | 15 Ų | 15 | 58.3 Ų | 58.3 | 16% | 0.155 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -60.2 | -36.8 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | A80 G238 I239 M240 | A80-G242 WeakPolarHBondContact O-CA 3.46Å; G238-G242 PolarHBondContact O-N 2.92Å; I239-G242 PolarHBondContact O-N 3.36Å; M240-G242 PolarHBondContact O-N 3.35Å |
| 243 | R | 84.6 | Confident | 86.9 | Confident | 170 Ų | 170 | 60.7 Ų | 60.7 | 64% | 0.642 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -75.6 | -24.2 | 177.4 | -75 | -162.6 | 158.8 | 92.3 | 2.6 | 114.7 | A84 I239 M240 L241 G245 | A84-R243 HydrophobicContact CB-CG 4.41Å; I239-R243 VanDerWaalsContact CG2-NH1 3.26Å; I239-R243 PolarHBondContact O-N 3.38Å; I239-R243 VanDerWaalsContact O-N 3.17Å; M240-R243 WeakPolarHBondContact O-CA 3.26Å; M240-R243 PolarHBondContact O-N 2.95Å; L241-R243 VanDerWaalsContact C-N 3.26Å; L241-R243 PolarHBondContact O-N 2.98Å; R243-G245 PolarHBondContact O-N 3.17Å |
| 244 | M | 87.2 | Confident | 87.2 | Confident | 98 Ų | 98 | 62.4 Ų | 62.4 | 48% | 0.483 | 35% | 0.349 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.4 | -12.2 | 176.2 | -70.5 | 172 | 71.9 | 0 | 0 | 113.1 | M240 L241 N247 | M240-M244 WeakPolarHBondContact O-CG 3.49Å; M240-M244 PolarHBondContact O-N 3.44Å; L241-M244 HydrophobicContact CD2-SD 4.06Å; L241-M244 PolarHBondContact O-N 2.96Å; M244-N247 HydrophobicContact CB-CB 4.5Å; M244-N247 HydrophobicContact CE-CB 4.38Å; M244-N247 PolarHBondContact O-N 3.47Å |
| 245 | G | 83.2 | Confident | 87.4 | Confident | 36 Ų | 36 | 62.7 Ų | 62.7 | 37% | 0.371 | 35% | 0.35 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 58.8 | -127.1 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | R243 N247 G248 S249 | R243-G245 PolarHBondContact O-N 3.17Å; G245-N247 PolarHBondContact O-N 3.27Å; G245-G248 PolarHBondContact O-N 3.06Å; G245-G248 VanDerWaalsContact O-N 3.08Å; G245-S249 PolarHBondContact O-N 3.43Å |
| 246 | P | 86.8 | Confident | 87.8 | Confident | 107 Ų | 107 | 65.8 Ų | 65.8 | 70% | 0.695 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -61.3 | -31.8 | -175.3 | 25.3 | -33.4 | 0 | 0 | 0 | 113.1 | G248 S249 | P246-G248 VanDerWaalsContact C-N 3.28Å; P246-G248 PolarHBondContact O-N 2.98Å; P246-S249 WeakPolarHBondContact O-CB 3.43Å; P246-S249 PolarHBondContact O-N 3.46Å; P246-S249 PolarHBondContact O-OG 3.04Å |
| 247 | N | 90.8 | Very high | 88 | Confident | 138 Ų | 138 | 66 Ų | 66 | 74% | 0.738 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -68.1 | -28 | 179 | -67 | -8.2 | 0 | 0 | 0 | 112.6 | M244 G245 | M244-N247 HydrophobicContact CB-CB 4.5Å; M244-N247 HydrophobicContact CE-CB 4.38Å; M244-N247 PolarHBondContact O-N 3.47Å; G245-N247 PolarHBondContact O-N 3.27Å |
| 248 | G | 88.8 | Confident | 87.9 | Confident | 1 Ų | 1 | 65.8 Ų | 65.8 | 1% | 0.01 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -84.4 | -17.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | G245 P246 A250 L251 V252 | G245-G248 PolarHBondContact O-N 3.06Å; G245-G248 VanDerWaalsContact O-N 3.08Å; P246-G248 VanDerWaalsContact C-N 3.28Å; P246-G248 PolarHBondContact O-N 2.98Å; G248-A250 VanDerWaalsContact C-N 3.33Å; G248-A250 PolarHBondContact O-N 3.49Å; G248-L251 PolarHBondContact O-N 3.39Å; G248-L251 VanDerWaalsContact O-N 3.16Å; G248-V252 WeakPolarHBondContact O-CG2 3.49Å; G248-V252 PolarHBondContact O-N 2.71Å; G248-V252 VanDerWaalsContact O-N 3.12Å |
| 249 | S | 88.1 | Confident | 87.7 | Confident | 55 Ų | 55 | 67.4 Ų | 67.4 | 39% | 0.385 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -58.6 | -38.1 | -169.2 | 67 | 0 | 0 | 0 | 0 | 114.2 | G245 P246 L251 V252 N253 | G245-S249 PolarHBondContact O-N 3.43Å; P246-S249 WeakPolarHBondContact O-CB 3.43Å; P246-S249 PolarHBondContact O-N 3.46Å; P246-S249 PolarHBondContact O-OG 3.04Å; S249-L251 VanDerWaalsContact C-N 3.35Å; S249-L251 PolarHBondContact O-N 2.94Å; S249-V252 PolarHBondContact O-N 3.26Å; S249-N253 WeakPolarHBondContact O-CB 3.37Å; S249-N253 PolarHBondContact O-N 2.98Å; S249-N253 PolarHBondContact O-ND2 3.34Å |
| 250 | A | 94.3 | Very high | 87.4 | Confident | 74 Ų | 74 | 69 Ų | 69 | 61% | 0.612 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -60 | -44.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | G248 F254 | G248-A250 VanDerWaalsContact C-N 3.33Å; G248-A250 PolarHBondContact O-N 3.49Å; A250-F254 PolarHBondContact O-N 3.18Å |
| 251 | L | 93.4 | Very high | 87.2 | Confident | 68 Ų | 68 | 67 Ų | 67 | 36% | 0.356 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -74.6 | -35.1 | -179.6 | -170.7 | 59 | 0 | 0 | 0 | 111.7 | M76 M237 L241 G248 S249 F254 C255 | M76-L251 HydrophobicContact CE-CD2 4.24Å; M76-L251 HydrophobicContact CE-CG 4.43Å; M237-L251 HydrophobicContact CE-CD2 3.94Å; L241-L251 HydrophobicContact CD1-CB 4.36Å; L241-L251 HydrophobicContact CD1-CD2 3.77Å; L241-L251 HydrophobicContact CD1-CG 3.99Å; L241-L251 HydrophobicContact CD2-CB 4.12Å; L241-L251 HydrophobicContact CD2-CD2 3.78Å; L241-L251 HydrophobicContact CD2-CG 4.36Å; L241-L251 HydrophobicContact CG-CD2 4.38Å; G248-L251 PolarHBondContact O-N 3.39Å; G248-L251 VanDerWaalsContact O-N 3.16Å; S249-L251 VanDerWaalsContact C-N 3.35Å; S249-L251 PolarHBondContact O-N 2.94Å; L251-F254 HydrophobicContact CD1-CD1 4.12Å; L251-F254 WeakPolarHBondContact O-CB 3.4Å; L251-F254 PolarHBondContact O-N 3.22Å; L251-C255 PolarHBondContact O-N 3.06Å; L251-C255 PolarHBondContact O-SG 3.28Å; L251-C255 VanDerWaalsContact O-SG 3.32Å |
| 252 | V | 88.5 | Confident | 86.5 | Confident | 16 Ų | 16 | 67 Ų | 67 | 10% | 0.097 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -61.7 | -46.5 | 173.2 | 176.5 | 0 | 0 | 0 | 0 | 111 | A80 L241 G248 S249 F254 C255 Q256 | A80-V252 HydrophobicContact CB-CB 4.41Å; A80-V252 HydrophobicContact CB-CG1 4.07Å; A80-V252 HydrophobicContact CB-CG2 3.43Å; A80-V252 VanDerWaalsContact CB-CG2 3.43Å; L241-V252 HydrophobicContact CB-CG2 3.88Å; L241-V252 HydrophobicContact CD1-CG2 4.44Å; G248-V252 WeakPolarHBondContact O-CG2 3.49Å; G248-V252 PolarHBondContact O-N 2.71Å; G248-V252 VanDerWaalsContact O-N 3.12Å; S249-V252 PolarHBondContact O-N 3.26Å; V252-F254 VanDerWaalsContact C-N 3.32Å; V252-F254 PolarHBondContact O-N 2.95Å; V252-C255 PolarHBondContact O-N 3Å; V252-Q256 HydrophobicContact CG1-CG 4.49Å; V252-Q256 WeakPolarHBondContact O-CG 3.43Å; V252-Q256 PolarHBondContact O-N 2.97Å |
| 253 | N | 90.1 | Very high | 85.7 | Confident | 86 Ų | 86 | 68.5 Ų | 68.5 | 46% | 0.46 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -63.9 | -37.8 | 178 | -68.6 | -16.1 | 0 | 0 | 0 | 112 | S249 Q256 S257 | S249-N253 WeakPolarHBondContact O-CB 3.37Å; S249-N253 PolarHBondContact O-N 2.98Å; S249-N253 PolarHBondContact O-ND2 3.34Å; N253-Q256 PolarHBondContact O-N 3.02Å; N253-S257 WeakPolarHBondContact O-CB 3.38Å; N253-S257 PolarHBondContact O-N 3.47Å; N253-S257 PolarHBondContact O-OG 3.49Å |
| 254 | F | 94.7 | Very high | 85.3 | Confident | 124 Ų | 124 | 68.5 Ų | 68.5 | 54% | 0.544 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -60.3 | -50.6 | 171.4 | 171.4 | -96.3 | 0 | 0 | 0 | 111.3 | A250 L251 V252 Q256 S257 L258 | A250-F254 PolarHBondContact O-N 3.18Å; L251-F254 HydrophobicContact CD1-CD1 4.12Å; L251-F254 WeakPolarHBondContact O-CB 3.4Å; L251-F254 PolarHBondContact O-N 3.22Å; V252-F254 VanDerWaalsContact C-N 3.32Å; V252-F254 PolarHBondContact O-N 2.95Å; F254-Q256 VanDerWaalsContact C-N 3.32Å; F254-Q256 PolarHBondContact O-N 2.7Å; F254-S257 PolarHBondContact O-N 3.4Å; F254-L258 HydrophobicContact CE1-CD2 4.22Å; F254-L258 HydrophobicContact CZ-CD2 4.4Å; F254-L258 WeakPolarHBondContact O-CB 3.24Å; F254-L258 PolarHBondContact O-N 2.82Å |
| 255 | C | 88.3 | Confident | 84.8 | Confident | 5 Ų | 5 | 67.4 Ų | 67.4 | 3% | 0.034 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -60.4 | -40.1 | 178.1 | -70.6 | 0 | 0 | 0 | 0 | 112.2 | S73 M76 L251 V252 L258 N259 | S73-C255 WeakPolarHBondContact CB-O 3.34Å; M76-C255 HydrophobicContact CB-CB 4.38Å; L251-C255 PolarHBondContact O-N 3.06Å; L251-C255 PolarHBondContact O-SG 3.28Å; L251-C255 VanDerWaalsContact O-SG 3.32Å; V252-C255 PolarHBondContact O-N 3Å; C255-L258 PolarHBondContact O-N 3.16Å; C255-N259 WeakPolarHBondContact O-CB 3.26Å; C255-N259 PolarHBondContact O-N 3.35Å |
| 256 | Q | 84.3 | Confident | 83.9 | Confident | 87 Ų | 87 | 66.2 Ų | 66.2 | 41% | 0.407 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -62.4 | -45 | 174.9 | -73.2 | 175.2 | -9.7 | 0 | 0 | 111.9 | V252 N253 F254 L258 N259 E260 | V252-Q256 HydrophobicContact CG1-CG 4.49Å; V252-Q256 WeakPolarHBondContact O-CG 3.43Å; V252-Q256 PolarHBondContact O-N 2.97Å; N253-Q256 PolarHBondContact O-N 3.02Å; F254-Q256 VanDerWaalsContact C-N 3.32Å; F254-Q256 PolarHBondContact O-N 2.7Å; Q256-L258 VanDerWaalsContact C-N 3.35Å; Q256-L258 PolarHBondContact O-N 2.95Å; Q256-N259 PolarHBondContact O-N 3.34Å; Q256-E260 PolarHBondContact O-N 3.05Å |
| 257 | S | 89.8 | Confident | 83 | Confident | 81 Ų | 81 | 63.5 Ų | 63.5 | 57% | 0.566 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -64.4 | -40.8 | 178.6 | -57.5 | 0 | 0 | 0 | 0 | 111.6 | N253 F254 A261 | N253-S257 WeakPolarHBondContact O-CB 3.38Å; N253-S257 PolarHBondContact O-N 3.47Å; N253-S257 PolarHBondContact O-OG 3.49Å; F254-S257 PolarHBondContact O-N 3.4Å; S257-A261 WeakPolarHBondContact O-CB 3.35Å; S257-A261 PolarHBondContact O-N 3.26Å |
| 258 | L | 88.3 | Confident | 82.4 | Confident | 59 Ų | 59 | 62.7 Ų | 62.7 | 31% | 0.309 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -64.2 | -46 | 175.3 | 179.9 | 60.1 | 0 | 0 | 0 | 111.3 | F254 C255 Q256 E260 A261 V262 | F254-L258 HydrophobicContact CE1-CD2 4.22Å; F254-L258 HydrophobicContact CZ-CD2 4.4Å; F254-L258 WeakPolarHBondContact O-CB 3.24Å; F254-L258 PolarHBondContact O-N 2.82Å; C255-L258 PolarHBondContact O-N 3.16Å; Q256-L258 VanDerWaalsContact C-N 3.35Å; Q256-L258 PolarHBondContact O-N 2.95Å; L258-E260 PolarHBondContact O-N 2.84Å; L258-A261 PolarHBondContact O-N 3.03Å; L258-V262 HydrophobicContact CD1-CG2 4.09Å; L258-V262 HydrophobicContact CG-CG2 4.37Å; L258-V262 WeakPolarHBondContact O-CG2 3.45Å; L258-V262 PolarHBondContact O-N 2.79Å |
| 259 | N | 78.6 | Confident | 81.6 | Confident | 33 Ų | 33 | 62.8 Ų | 62.8 | 18% | 0.176 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -58.1 | -48.5 | 177.9 | -175.1 | 38.2 | 0 | 0 | 0 | 111.2 | L70 S73 C255 Q256 A261 V262 L263 | L70-N259 WeakPolarHBondContact CD1-OD1 3.46Å; S73-N259 WeakPolarHBondContact OG-CA 3.43Å; S73-N259 WeakPolarHBondContact OG-CB 3.48Å; C255-N259 WeakPolarHBondContact O-CB 3.26Å; C255-N259 PolarHBondContact O-N 3.35Å; Q256-N259 PolarHBondContact O-N 3.34Å; N259-A261 PolarHBondContact O-N 2.97Å; N259-V262 PolarHBondContact O-N 3.36Å; N259-L263 VanDerWaalsContact O-CG 3.28Å; N259-L263 WeakPolarHBondContact O-CG 3.4Å; N259-L263 PolarHBondContact O-N 3.31Å |
| 260 | E | 77.4 | Confident | 80.6 | Confident | 99 Ų | 99 | 61.4 Ų | 61.4 | 46% | 0.463 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -61.1 | -42.2 | 176.9 | -178.9 | 59.7 | -153.7 | 0 | 0 | 112.2 | Q256 L258 L263 R264 | Q256-E260 PolarHBondContact O-N 3.05Å; L258-E260 PolarHBondContact O-N 2.84Å; E260-L263 PolarHBondContact O-N 3.27Å; E260-R264 WeakPolarHBondContact O-CG 3.33Å; E260-R264 PolarHBondContact O-N 3.31Å; E260-R264 VanDerWaalsContact O-N 3.15Å; E260-R264 IonicContact OE1-NE 3.17Å; E260-R264 IonicContact OE1-NH2 3.02Å |
| 261 | A | 83.3 | Confident | 79.7 | Confident | 48 Ų | 48 | 66.5 Ų | 66.5 | 40% | 0.397 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -62.7 | -44.2 | 176 | 0 | 0 | 0 | 0 | 0 | 112 | S257 L258 N259 R264 I265 | S257-A261 WeakPolarHBondContact O-CB 3.35Å; S257-A261 PolarHBondContact O-N 3.26Å; L258-A261 PolarHBondContact O-N 3.03Å; N259-A261 PolarHBondContact O-N 2.97Å; A261-R264 WeakPolarHBondContact O-CB 3.49Å; A261-R264 PolarHBondContact O-N 3.1Å; A261-I265 PolarHBondContact O-N 3.47Å |
| 262 | V | 74.7 | Confident | 79 | Confident | 6 Ų | 6 | 65.9 Ų | 65.9 | 4% | 0.036 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -63.7 | -41.9 | 177.4 | 175.2 | 0 | 0 | 0 | 0 | 110.7 | L66 P69 L70 L258 N259 R264 I265 V266 | L66-V262 HydrophobicContact CD2-CG1 4.3Å; P69-V262 HydrophobicContact CB-CG2 3.87Å; P69-V262 HydrophobicContact CG-CG1 4.44Å; P69-V262 HydrophobicContact CG-CG2 4.21Å; L70-V262 HydrophobicContact CB-CG1 3.97Å; L70-V262 HydrophobicContact CD1-CG1 4.1Å; L258-V262 HydrophobicContact CD1-CG2 4.09Å; L258-V262 HydrophobicContact CG-CG2 4.37Å; L258-V262 WeakPolarHBondContact O-CG2 3.45Å; L258-V262 PolarHBondContact O-N 2.79Å; N259-V262 PolarHBondContact O-N 3.36Å; V262-R264 VanDerWaalsContact C-N 3.26Å; V262-R264 PolarHBondContact O-N 3.41Å; V262-I265 WeakPolarHBondContact O-CA 3.34Å; V262-I265 WeakPolarHBondContact O-CB 3.24Å; V262-I265 PolarHBondContact O-N 2.74Å; V262-V266 HydrophobicContact CG1-CG2 4.44Å; V262-V266 WeakPolarHBondContact O-CG2 3.32Å; V262-V266 PolarHBondContact O-N 3Å |
| 263 | L | 64.1 | Low | 78.2 | Confident | 47 Ų | 47 | 65.4 Ų | 65.4 | 25% | 0.246 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -59.5 | -35.4 | 175.8 | -72.6 | 171.9 | 0 | 0 | 0 | 112.5 | L70 N259 E260 V266 A267 A425 I427 | L70-L263 HydrophobicContact CD1-CD2 4.05Å; L70-L263 HydrophobicContact CD1-CG 4.39Å; N259-L263 VanDerWaalsContact O-CG 3.28Å; N259-L263 WeakPolarHBondContact O-CG 3.4Å; N259-L263 PolarHBondContact O-N 3.31Å; E260-L263 PolarHBondContact O-N 3.27Å; L263-V266 PolarHBondContact O-N 3.39Å; L263-A267 PolarHBondContact O-N 2.81Å; L263-A425 HydrophobicContact CD2-CB 4.23Å; L263-I427 HydrophobicContact CD2-CD1 4.03Å; L263-I427 HydrophobicContact CD2-CG2 4.13Å |
| 264 | R | 76.8 | Confident | 77.6 | Confident | 170 Ų | 170 | 61.5 Ų | 61.5 | 64% | 0.642 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -66.4 | -37.7 | 172.5 | -67.8 | 179.5 | -176.7 | -157 | 1.5 | 112.6 | E260 A261 V262 A267 I268 | E260-R264 WeakPolarHBondContact O-CG 3.33Å; E260-R264 PolarHBondContact O-N 3.31Å; E260-R264 VanDerWaalsContact O-N 3.15Å; E260-R264 IonicContact OE1-NE 3.17Å; E260-R264 IonicContact OE1-NH2 3.02Å; A261-R264 WeakPolarHBondContact O-CB 3.49Å; A261-R264 PolarHBondContact O-N 3.1Å; V262-R264 VanDerWaalsContact C-N 3.26Å; V262-R264 PolarHBondContact O-N 3.41Å; R264-A267 WeakPolarHBondContact O-CB 3.42Å; R264-A267 PolarHBondContact O-N 3.14Å; R264-I268 PolarHBondContact O-N 3.26Å |
| 265 | I | 76.8 | Confident | 77.1 | Confident | 76 Ų | 76 | 60.7 Ų | 60.7 | 39% | 0.39 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -64.6 | -43.9 | 173.7 | -59 | 169.5 | 0 | 0 | 0 | 109.7 | L66 A261 V262 A267 I268 V269 | L66-I265 HydrophobicContact CD2-CB 4.15Å; L66-I265 HydrophobicContact CD2-CG2 3.66Å; A261-I265 PolarHBondContact O-N 3.47Å; V262-I265 WeakPolarHBondContact O-CA 3.34Å; V262-I265 WeakPolarHBondContact O-CB 3.24Å; V262-I265 PolarHBondContact O-N 2.74Å; I265-A267 VanDerWaalsContact C-N 3.26Å; I265-A267 PolarHBondContact O-N 3.49Å; I265-I268 WeakPolarHBondContact O-CB 3.34Å; I265-I268 PolarHBondContact O-N 3.44Å; I265-V269 WeakPolarHBondContact O-CG2 3.5Å; I265-V269 PolarHBondContact O-N 2.83Å |
| 266 | V | 64.3 | Low | 76.7 | Confident | 11 Ų | 11 | 60.4 Ų | 60.4 | 7% | 0.067 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -57 | -42.6 | 176.5 | -178.5 | 0 | 0 | 0 | 0 | 110.8 | L66 V262 L263 I268 V269 I270 I427 | L66-V266 HydrophobicContact CB-CG2 4.49Å; L66-V266 HydrophobicContact CD1-CB 4.36Å; L66-V266 HydrophobicContact CD1-CG2 3.76Å; V262-V266 HydrophobicContact CG1-CG2 4.44Å; V262-V266 WeakPolarHBondContact O-CG2 3.32Å; V262-V266 PolarHBondContact O-N 3Å; L263-V266 PolarHBondContact O-N 3.39Å; V266-I268 PolarHBondContact O-N 3.1Å; V266-V269 PolarHBondContact O-N 3.27Å; V266-V269 VanDerWaalsContact O-N 3.08Å; V266-I270 HydrophobicContact CG1-CD1 3.86Å; V266-I270 HydrophobicContact CG1-CG1 4.16Å; V266-I270 WeakPolarHBondContact O-CG1 2.95Å; V266-I270 PolarHBondContact O-N 2.68Å; V266-I427 HydrophobicContact CB-CD1 4.14Å; V266-I427 HydrophobicContact CG1-CD1 3.47Å; V266-I427 VanDerWaalsContact CG1-CD1 3.47Å; V266-I427 HydrophobicContact CG2-CD1 4.26Å |
| 267 | A | 67.8 | Low | 76.2 | Confident | 50 Ų | 50 | 56.3 Ų | 56.3 | 41% | 0.413 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -58 | -35.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113 | L263 R264 I265 W271 | L263-A267 PolarHBondContact O-N 2.81Å; R264-A267 WeakPolarHBondContact O-CB 3.42Å; R264-A267 PolarHBondContact O-N 3.14Å; I265-A267 VanDerWaalsContact C-N 3.26Å; I265-A267 PolarHBondContact O-N 3.49Å; A267-W271 VanDerWaalsContact O-CD1 3.27Å |
| 268 | I | 79.2 | Confident | 75.8 | Confident | 120 Ų | 120 | 53.3 Ų | 53.3 | 62% | 0.615 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -69 | -45.1 | 174.5 | -61.4 | 167.7 | 0 | 0 | 0 | 110.5 | R264 I265 V266 I270 W271 | R264-I268 PolarHBondContact O-N 3.26Å; I265-I268 WeakPolarHBondContact O-CB 3.34Å; I265-I268 PolarHBondContact O-N 3.44Å; V266-I268 PolarHBondContact O-N 3.1Å; I268-I270 VanDerWaalsContact C-N 3.27Å; I268-I270 PolarHBondContact O-N 3.34Å; I268-W271 WeakPolarHBondContact O-CB 3.36Å; I268-W271 PolarHBondContact O-N 3.22Å; I268-W271 VanDerWaalsContact O-N 3.08Å |
| 269 | V | 70.4 | Confident | 75.7 | Confident | 4 Ų | 4 | 52.6 Ų | 52.6 | 2% | 0.024 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -61.7 | -36.8 | 178 | -179.6 | 0 | 0 | 0 | 0 | 111.6 | L59 M62 L63 L66 I265 V266 W271 Y272 F273 | L59-V269 HydrophobicContact CD1-CG1 4.23Å; M62-V269 HydrophobicContact CB-CG1 3.94Å; M62-V269 HydrophobicContact CB-CG2 4.34Å; M62-V269 HydrophobicContact CE-CG2 3.79Å; L63-V269 HydrophobicContact CD2-CG1 3.99Å; L66-V269 HydrophobicContact CD1-CB 4.36Å; L66-V269 HydrophobicContact CD1-CG2 3.83Å; I265-V269 WeakPolarHBondContact O-CG2 3.5Å; I265-V269 PolarHBondContact O-N 2.83Å; V266-V269 PolarHBondContact O-N 3.27Å; V266-V269 VanDerWaalsContact O-N 3.08Å; V269-W271 PolarHBondContact O-N 3.25Å; V269-Y272 WeakPolarHBondContact O-CA 3.41Å; V269-Y272 WeakPolarHBondContact O-CB 3.3Å; V269-Y272 PolarHBondContact O-N 3.08Å; V269-F273 PolarHBondContact O-N 3.25Å |
| 270 | I | 66.9 | Low | 75.3 | Confident | 26 Ų | 26 | 51.4 Ų | 51.4 | 13% | 0.133 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -59.7 | -30.9 | 175.6 | -73.5 | 171.3 | 0 | 0 | 0 | 111.8 | L21 V266 I268 Y272 F273 P274 | L21-I270 HydrophobicContact CD1-CG2 3.96Å; L21-I270 HydrophobicContact CD2-CG2 3.3Å; L21-I270 HydrophobicContact CG-CG2 4.21Å; V266-I270 HydrophobicContact CG1-CD1 3.86Å; V266-I270 HydrophobicContact CG1-CG1 4.16Å; V266-I270 WeakPolarHBondContact O-CG1 2.95Å; V266-I270 PolarHBondContact O-N 2.68Å; I268-I270 VanDerWaalsContact C-N 3.27Å; I268-I270 PolarHBondContact O-N 3.34Å; I270-Y272 VanDerWaalsContact C-N 3.35Å; I270-F273 WeakPolarHBondContact O-CB 3.41Å; I270-F273 PolarHBondContact O-N 3.08Å; I270-P274 WeakPolarHBondContact O-CD 3.21Å |
| 271 | W | 76.4 | Confident | 75.2 | Confident | 180 Ų | 180 | 47 Ų | 47 | 68% | 0.682 | 23% | 0.227 | S | C | * | . | H | α-helix | trans | -72 | -28.1 | 173.8 | -80.8 | 100.5 | 0 | 0 | 0 | 113.6 | A267 I268 V269 F273 P274 | A267-W271 VanDerWaalsContact O-CD1 3.27Å; I268-W271 WeakPolarHBondContact O-CB 3.36Å; I268-W271 PolarHBondContact O-N 3.22Å; I268-W271 VanDerWaalsContact O-N 3.08Å; V269-W271 PolarHBondContact O-N 3.25Å; W271-F273 VanDerWaalsContact C-N 3.31Å; W271-P274 WeakPolarHBondContact O-CD 3.35Å |
| 272 | Y | 79.1 | Confident | 75.2 | Confident | 56 Ų | 56 | 44.7 Ų | 44.7 | 22% | 0.22 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -75.4 | -23.7 | 171.7 | -175.3 | -104.2 | 0 | 0 | 0 | 112.2 | P55 L59 M62 V269 I270 F275 G276 | P55-Y272 PolarHBondContact O-OH 3.16Å; L59-Y272 HydrophobicContact CB-CD1 4.13Å; L59-Y272 HydrophobicContact CB-CE1 3.88Å; L59-Y272 HydrophobicContact CD1-CD1 3.93Å; M62-Y272 HydrophobicContact SD-CD1 4.04Å; M62-Y272 HydrophobicContact SD-CE1 4.41Å; V269-Y272 WeakPolarHBondContact O-CA 3.41Å; V269-Y272 WeakPolarHBondContact O-CB 3.3Å; V269-Y272 PolarHBondContact O-N 3.08Å; I270-Y272 VanDerWaalsContact C-N 3.35Å; Y272-F275 HydrophobicContact CD2-CD1 4.14Å; Y272-F275 AromaticContact CE2-CD1 3.44Å; Y272-F275 HydrophobicContact CE2-CD1 3.44Å; Y272-F275 VanDerWaalsContact CE2-CD1 3.44Å; Y272-F275 AromaticContact CE2-CE1 3.93Å; Y272-F275 HydrophobicContact CE2-CE1 3.93Å; Y272-F275 HydrophobicContact CE2-CG 4.47Å; Y272-F275 AromaticContact CZ-CD1 3.72Å; Y272-F275 WeakPolarHBondContact O-CB 3.49Å; Y272-F275 PolarHBondContact O-N 3.01Å; Y272-G276 PolarHBondContact O-N 3.36Å |
| 273 | F | 71 | Confident | 75.3 | Confident | 5 Ų | 5 | 44.4 Ų | 44.4 | 2% | 0.022 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -51.8 | -48.2 | -173.4 | -175.1 | -90.2 | 0 | 0 | 0 | 115 | L59 V269 I270 W271 F275 G276 I277 Q429 | L59-F273 HydrophobicContact CD1-CB 4.4Å; L59-F273 HydrophobicContact CD1-CD2 4.01Å; L59-F273 HydrophobicContact CD2-CD2 3.79Å; L59-F273 HydrophobicContact CD2-CE2 4.1Å; L59-F273 HydrophobicContact CD2-CG 4.46Å; L59-F273 HydrophobicContact CG-CD2 4.42Å; V269-F273 PolarHBondContact O-N 3.25Å; I270-F273 WeakPolarHBondContact O-CB 3.41Å; I270-F273 PolarHBondContact O-N 3.08Å; W271-F273 VanDerWaalsContact C-N 3.31Å; F273-F275 VanDerWaalsContact C-N 3.27Å; F273-F275 PolarHBondContact O-N 3.35Å; F273-G276 PolarHBondContact O-N 3.02Å; F273-I277 HydrophobicContact CD1-CD1 4.04Å; F273-I277 HydrophobicContact CD1-CG1 4.13Å; F273-I277 HydrophobicContact CE1-CD1 3.05Å; F273-I277 HydrophobicContact CE1-CG1 3.52Å; F273-I277 HydrophobicContact CE2-CD1 4.26Å; F273-I277 HydrophobicContact CE2-CG1 4.14Å; F273-I277 HydrophobicContact CZ-CD1 3.19Å; F273-I277 HydrophobicContact CZ-CG1 3.52Å; F273-I277 PolarHBondContact O-N 3.31Å; F273-Q429 VanDerWaalsContact CE1-CD 3.48Å; F273-Q429 HydrophobicContact CE2-CG 4.41Å; F273-Q429 HydrophobicContact CZ-CG 4.2Å |
| 274 | P | 76.7 | Confident | 75.6 | Confident | 4 Ų | 4 | 43.8 Ų | 43.8 | 3% | 0.026 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -63.3 | -34.1 | 179.7 | -21.6 | 35.1 | 0 | 0 | 0 | 112.5 | L21 L24 A28 I270 W271 | L21-P274 HydrophobicContact CD1-CG 4.03Å; L24-P274 HydrophobicContact CB-CB 4.21Å; L24-P274 HydrophobicContact CB-CG 4.24Å; L24-P274 HydrophobicContact CD2-CB 3.79Å; L24-P274 HydrophobicContact CD2-CG 3.79Å; L24-P274 HydrophobicContact CG-CB 3.56Å; L24-P274 HydrophobicContact CG-CG 3.93Å; A28-P274 HydrophobicContact CB-CB 4.14Å; A28-P274 WeakPolarHBondContact CB-O 3.42Å; I270-P274 WeakPolarHBondContact O-CD 3.21Å; W271-P274 WeakPolarHBondContact O-CD 3.35Å |
| 275 | F | 85.9 | Confident | 75.6 | Confident | 107 Ų | 107 | 36.3 Ų | 36.3 | 47% | 0.469 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -69.1 | -48.5 | 175.9 | 178 | -100.7 | 0 | 0 | 0 | 111.3 | P55 Y272 F273 I277 V278 F279 | P55-F275 HydrophobicContact CB-CD1 4.46Å; P55-F275 HydrophobicContact CB-CE1 3.84Å; P55-F275 HydrophobicContact CG-CE1 4.46Å; Y272-F275 HydrophobicContact CD2-CD1 4.14Å; Y272-F275 AromaticContact CE2-CD1 3.44Å; Y272-F275 HydrophobicContact CE2-CD1 3.44Å; Y272-F275 VanDerWaalsContact CE2-CD1 3.44Å; Y272-F275 AromaticContact CE2-CE1 3.93Å; Y272-F275 HydrophobicContact CE2-CE1 3.93Å; Y272-F275 HydrophobicContact CE2-CG 4.47Å; Y272-F275 AromaticContact CZ-CD1 3.72Å; Y272-F275 WeakPolarHBondContact O-CB 3.49Å; Y272-F275 PolarHBondContact O-N 3.01Å; F273-F275 VanDerWaalsContact C-N 3.27Å; F273-F275 PolarHBondContact O-N 3.35Å; F275-I277 VanDerWaalsContact C-N 3.34Å; F275-I277 PolarHBondContact O-N 3.31Å; F275-V278 PolarHBondContact O-N 3.39Å; F275-F279 HydrophobicContact CD1-CE2 4.47Å; F275-F279 HydrophobicContact CD2-CE2 4.07Å; F275-F279 HydrophobicContact CE1-CD2 4.47Å; F275-F279 HydrophobicContact CE1-CE2 4.04Å; F275-F279 AromaticContact CE2-CE2 3.57Å; F275-F279 HydrophobicContact CE2-CE2 3.57Å; F275-F279 HydrophobicContact CE2-CZ 4.19Å; F275-F279 HydrophobicContact CZ-CD2 4.4Å; F275-F279 AromaticContact CZ-CE2 3.55Å; F275-F279 HydrophobicContact CZ-CE2 3.55Å; F275-F279 HydrophobicContact CZ-CZ 4.15Å; F275-F279 WeakPolarHBondContact O-CD2 3.45Å |
| 276 | G | 78.3 | Confident | 75.8 | Confident | 0 Ų | 0 | 34.1 Ų | 34.1 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -62.7 | -36.8 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | G56 Y272 F273 V278 F279 L280 | G56-G276 WeakPolarHBondContact CA-O 3.44Å; Y272-G276 PolarHBondContact O-N 3.36Å; F273-G276 PolarHBondContact O-N 3.02Å; G276-V278 VanDerWaalsContact C-N 3.3Å; G276-V278 PolarHBondContact O-N 3Å; G276-F279 PolarHBondContact O-N 3.35Å; G276-L280 WeakPolarHBondContact O-CB 3.19Å; G276-L280 PolarHBondContact O-N 3.5Å |
| 277 | I | 73.8 | Confident | 76.2 | Confident | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -57.9 | -40.2 | 177.2 | -91.9 | -156.7 | 0 | 0 | 0 | 112.6 | A28 V29 F273 F275 F279 L280 V281 I453 | A28-I277 HydrophobicContact CB-CG2 3.9Å; V29-I277 HydrophobicContact CB-CG2 4.47Å; V29-I277 HydrophobicContact CG2-CD1 4.08Å; V29-I277 HydrophobicContact CG2-CG2 3.62Å; F273-I277 HydrophobicContact CD1-CD1 4.04Å; F273-I277 HydrophobicContact CD1-CG1 4.13Å; F273-I277 HydrophobicContact CE1-CD1 3.05Å; F273-I277 HydrophobicContact CE1-CG1 3.52Å; F273-I277 HydrophobicContact CE2-CD1 4.26Å; F273-I277 HydrophobicContact CE2-CG1 4.14Å; F273-I277 HydrophobicContact CZ-CD1 3.19Å; F273-I277 HydrophobicContact CZ-CG1 3.52Å; F273-I277 PolarHBondContact O-N 3.31Å; F275-I277 VanDerWaalsContact C-N 3.34Å; F275-I277 PolarHBondContact O-N 3.31Å; I277-F279 VanDerWaalsContact C-N 3.28Å; I277-F279 PolarHBondContact O-N 3.23Å; I277-L280 PolarHBondContact O-N 3.15Å; I277-V281 HydrophobicContact CG2-CG2 4.05Å; I277-V281 WeakPolarHBondContact O-CB 3.19Å; I277-V281 WeakPolarHBondContact O-CG2 3.02Å; I277-V281 PolarHBondContact O-N 3.33Å; I277-I453 HydrophobicContact CD1-CG2 4.02Å; I277-I453 HydrophobicContact CG1-CG2 4.1Å |
| 278 | V | 82.8 | Confident | 76.4 | Confident | 19 Ų | 19 | 37.2 Ų | 37.2 | 12% | 0.115 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -55.2 | -49.9 | -177 | 173.2 | 0 | 0 | 0 | 0 | 109.8 | A28 I31 G32 L35 F275 G276 A282 | A28-V278 HydrophobicContact CB-CG2 3.69Å; A28-V278 WeakPolarHBondContact O-CG2 3.35Å; I31-V278 HydrophobicContact CG2-CG1 4.01Å; I31-V278 HydrophobicContact CG2-CG2 4.44Å; G32-V278 WeakPolarHBondContact CA-O 3.19Å; L35-V278 HydrophobicContact CD2-CG1 4.14Å; F275-V278 PolarHBondContact O-N 3.39Å; G276-V278 VanDerWaalsContact C-N 3.3Å; G276-V278 PolarHBondContact O-N 3Å; V278-A282 WeakPolarHBondContact O-CB 3.01Å; V278-A282 PolarHBondContact O-N 3.46Å |
| 279 | F | 85.2 | Confident | 75.9 | Confident | 43 Ų | 43 | 37.2 Ų | 37.2 | 19% | 0.189 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -75.5 | -33.9 | -177.4 | -62.6 | -84.4 | 0 | 0 | 0 | 112.6 | F52 P55 F275 G276 I277 G283 | F52-F279 HydrophobicContact CD2-CD1 4.2Å; F52-F279 HydrophobicContact CD2-CE1 4.42Å; F52-F279 HydrophobicContact CE1-CD1 4.38Å; F52-F279 AromaticContact CE2-CD1 3.79Å; F52-F279 HydrophobicContact CE2-CD1 3.79Å; F52-F279 AromaticContact CE2-CE1 3.93Å; F52-F279 HydrophobicContact CE2-CE1 3.93Å; F52-F279 AromaticContact CZ-CD1 3.89Å; F52-F279 HydrophobicContact CZ-CD1 3.89Å; F52-F279 HydrophobicContact CZ-CE1 4.38Å; F52-F279 VanDerWaalsContact O-CD1 3.3Å; F52-F279 WeakPolarHBondContact O-CD1 3.36Å; P55-F279 HydrophobicContact CB-CB 4.14Å; P55-F279 HydrophobicContact CB-CD2 3.63Å; P55-F279 HydrophobicContact CB-CE2 4.21Å; P55-F279 HydrophobicContact CB-CG 3.87Å; P55-F279 HydrophobicContact CG-CB 4.37Å; P55-F279 HydrophobicContact CG-CD1 4.12Å; P55-F279 HydrophobicContact CG-CD2 3.92Å; P55-F279 HydrophobicContact CG-CE1 4.4Å; P55-F279 HydrophobicContact CG-CE2 4.24Å; P55-F279 HydrophobicContact CG-CG 3.86Å; P55-F279 HydrophobicContact CG-CZ 4.46Å; F275-F279 HydrophobicContact CD1-CE2 4.47Å; F275-F279 HydrophobicContact CD2-CE2 4.07Å; F275-F279 HydrophobicContact CE1-CD2 4.47Å; F275-F279 HydrophobicContact CE1-CE2 4.04Å; F275-F279 AromaticContact CE2-CE2 3.57Å; F275-F279 HydrophobicContact CE2-CE2 3.57Å; F275-F279 HydrophobicContact CE2-CZ 4.19Å; F275-F279 HydrophobicContact CZ-CD2 4.4Å; F275-F279 AromaticContact CZ-CE2 3.55Å; F275-F279 HydrophobicContact CZ-CE2 3.55Å; F275-F279 HydrophobicContact CZ-CZ 4.15Å; F275-F279 WeakPolarHBondContact O-CD2 3.45Å; G276-F279 PolarHBondContact O-N 3.35Å; I277-F279 VanDerWaalsContact C-N 3.28Å; I277-F279 PolarHBondContact O-N 3.23Å; F279-G283 WeakPolarHBondContact O-CA 3.4Å; F279-G283 PolarHBondContact O-N 3.32Å |
| 280 | L | 71.1 | Confident | 76.1 | Confident | 9 Ų | 9 | 40.8 Ų | 40.8 | 5% | 0.047 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -65.6 | -49.7 | 177 | -165.8 | 160.1 | 0 | 0 | 0 | 110.9 | M60 G276 I277 K284 T450 I453 | M60-L280 HydrophobicContact CG-CD1 3.77Å; M60-L280 HydrophobicContact SD-CD1 3.75Å; G276-L280 WeakPolarHBondContact O-CB 3.19Å; G276-L280 PolarHBondContact O-N 3.5Å; I277-L280 PolarHBondContact O-N 3.15Å; L280-K284 WeakPolarHBondContact O-CG 3.43Å; L280-K284 PolarHBondContact O-N 3.3Å; L280-T450 HydrophobicContact CD1-CG2 4.34Å; L280-T450 HydrophobicContact CD2-CG2 3.95Å; L280-T450 HydrophobicContact CG-CG2 4.22Å; L280-I453 HydrophobicContact CD1-CD1 3.78Å; L280-I453 HydrophobicContact CD2-CB 4.25Å; L280-I453 HydrophobicContact CD2-CD1 4.12Å; L280-I453 HydrophobicContact CD2-CG2 4.25Å |
| 281 | V | 75.1 | Confident | 76.3 | Confident | 6 Ų | 6 | 40.5 Ų | 40.5 | 4% | 0.036 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -65.4 | -50.3 | 177.8 | 174.4 | 0 | 0 | 0 | 0 | 110.7 | I277 G283 K284 I285 A454 | I277-V281 HydrophobicContact CG2-CG2 4.05Å; I277-V281 WeakPolarHBondContact O-CB 3.19Å; I277-V281 WeakPolarHBondContact O-CG2 3.02Å; I277-V281 PolarHBondContact O-N 3.33Å; V281-G283 VanDerWaalsContact C-N 3.31Å; V281-G283 PolarHBondContact O-N 2.82Å; V281-K284 PolarHBondContact O-N 3.2Å; V281-I285 HydrophobicContact CG1-CD1 4Å; V281-I285 WeakPolarHBondContact O-CG1 3.33Å; V281-I285 PolarHBondContact O-N 3.17Å; V281-I285 VanDerWaalsContact O-N 3.1Å; V281-A454 HydrophobicContact CG1-CB 4.44Å; V281-A454 HydrophobicContact CG2-CB 3.96Å |
| 282 | A | 82.9 | Confident | 76.2 | Confident | 0 Ų | 0 | 35.5 Ų | 35.5 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -59.7 | -44 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | G32 L35 F52 V278 I285 L286 | G32-A282 WeakPolarHBondContact O-CA 3.41Å; G32-A282 VanDerWaalsContact O-CB 3.26Å; G32-A282 WeakPolarHBondContact O-CB 3.4Å; L35-A282 HydrophobicContact CB-CB 4.36Å; L35-A282 HydrophobicContact CG-CB 4.45Å; F52-A282 HydrophobicContact CE1-CB 3.55Å; F52-A282 HydrophobicContact CZ-CB 3.75Å; V278-A282 WeakPolarHBondContact O-CB 3.01Å; V278-A282 PolarHBondContact O-N 3.46Å; A282-I285 PolarHBondContact O-N 2.93Å; A282-L286 WeakPolarHBondContact O-CG 3.44Å; A282-L286 PolarHBondContact O-N 3.03Å |
| 283 | G | 75.9 | Confident | 76.1 | Confident | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -62.2 | -41.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q53 F279 V281 L286 E287 | Q53-G283 VanDerWaalsContact NE2-C 3.28Å; Q53-G283 PolarHBondContact NE2-O 2.67Å; F279-G283 WeakPolarHBondContact O-CA 3.4Å; F279-G283 PolarHBondContact O-N 3.32Å; V281-G283 VanDerWaalsContact C-N 3.31Å; V281-G283 PolarHBondContact O-N 2.82Å; G283-L286 WeakPolarHBondContact O-CB 3.28Å; G283-L286 PolarHBondContact O-N 3.47Å; G283-E287 PolarHBondContact O-N 3.37Å |
| 284 | K | 71 | Confident | 76.3 | Confident | 33 Ų | 33 | 35.8 Ų | 35.8 | 14% | 0.143 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -68.4 | -35.5 | 176.8 | -73.6 | -71.1 | 153.6 | 179.6 | 0 | 112.8 | L280 V281 L286 E287 M288 T450 | L280-K284 WeakPolarHBondContact O-CG 3.43Å; L280-K284 PolarHBondContact O-N 3.3Å; V281-K284 PolarHBondContact O-N 3.2Å; K284-L286 PolarHBondContact O-N 2.69Å; K284-E287 WeakPolarHBondContact CD-OE2 3.35Å; K284-E287 VanDerWaalsContact CE-OE2 3.24Å; K284-E287 WeakPolarHBondContact CE-OE2 3.31Å; K284-E287 IonicContact NZ-OE2 2.67Å; K284-E287 PolarHBondContact NZ-OE2 3.16Å; K284-E287 PolarHBondContact O-N 3.16Å; K284-M288 HydrophobicContact CB-CE 4.24Å; K284-M288 VanDerWaalsContact O-CG 3.28Å; K284-M288 WeakPolarHBondContact O-CG 3.47Å; K284-M288 PolarHBondContact O-N 3.43Å; K284-M288 VanDerWaalsContact O-N 3.13Å; K284-T450 WeakPolarHBondContact CD-OG1 3.38Å; K284-T450 WeakPolarHBondContact CE-OG1 3.39Å; K284-T450 WeakPolarHBondContact CG-OG1 3.15Å; K284-T450 PolarHBondContact NZ-OG1 3.5Å |
| 285 | I | 77.9 | Confident | 76.4 | Confident | 14 Ų | 14 | 37.6 Ų | 37.6 | 7% | 0.072 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -62.1 | -30.9 | 172.9 | -68 | 167.9 | 0 | 0 | 0 | 111.5 | C33 F37 R40 V281 A282 | C33-I285 HydrophobicContact CB-CD1 4.3Å; F37-I285 HydrophobicContact CD1-CG2 4.32Å; F37-I285 HydrophobicContact CE1-CG2 4.42Å; F37-I285 HydrophobicContact CE2-CD1 4.37Å; F37-I285 HydrophobicContact CG-CG2 4.45Å; R40-I285 PolarHBondContact NH1-O 3.36Å; V281-I285 HydrophobicContact CG1-CD1 4Å; V281-I285 WeakPolarHBondContact O-CG1 3.33Å; V281-I285 PolarHBondContact O-N 3.17Å; V281-I285 VanDerWaalsContact O-N 3.1Å; A282-I285 PolarHBondContact O-N 2.93Å |
| 286 | L | 79.9 | Confident | 76.3 | Confident | 29 Ų | 29 | 39.2 Ų | 39.2 | 15% | 0.152 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -72.7 | -34.8 | 176.2 | -67.1 | 171 | 0 | 0 | 0 | 112.9 | L39 R40 L44 V49 F52 A282 G283 K284 | L39-L286 HydrophobicContact CB-CD1 4.13Å; L39-L286 HydrophobicContact CB-CD2 3.76Å; L39-L286 HydrophobicContact CB-CG 4.44Å; L39-L286 HydrophobicContact CD1-CD1 4.28Å; R40-L286 HydrophobicContact CB-CD2 4.04Å; R40-L286 VanDerWaalsContact N-CD2 3.31Å; L44-L286 HydrophobicContact CD1-CD1 3.98Å; L44-L286 HydrophobicContact CD1-CD2 4.34Å; V49-L286 HydrophobicContact CG1-CB 4.22Å; V49-L286 HydrophobicContact CG2-CB 4.38Å; V49-L286 HydrophobicContact CG2-CD1 4.41Å; F52-L286 HydrophobicContact CD1-CD1 3.97Å; F52-L286 HydrophobicContact CE1-CD1 4.17Å; A282-L286 WeakPolarHBondContact O-CG 3.44Å; A282-L286 PolarHBondContact O-N 3.03Å; G283-L286 WeakPolarHBondContact O-CB 3.28Å; G283-L286 PolarHBondContact O-N 3.47Å; K284-L286 PolarHBondContact O-N 2.69Å |
| 287 | E | 73.6 | Confident | 76.6 | Confident | 96 Ų | 96 | 40 Ų | 40 | 45% | 0.449 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -74.3 | -30.3 | 177.4 | -71.2 | 178 | 177 | 0 | 0 | 113.3 | V49 Q53 G283 K284 S289 | V49-E287 HydrophobicContact CG1-CG 4.43Å; Q53-E287 PolarHBondContact NE2-OE1 3.24Å; Q53-E287 PolarHBondContact OE1-OE1 3.21Å; G283-E287 PolarHBondContact O-N 3.37Å; K284-E287 WeakPolarHBondContact CD-OE2 3.35Å; K284-E287 VanDerWaalsContact CE-OE2 3.24Å; K284-E287 WeakPolarHBondContact CE-OE2 3.31Å; K284-E287 IonicContact NZ-OE2 2.67Å; K284-E287 PolarHBondContact NZ-OE2 3.16Å; K284-E287 PolarHBondContact O-N 3.16Å; E287-S289 PolarHBondContact O-N 3.46Å |
| 288 | M | 71 | Confident | 77.1 | Confident | 30 Ų | 30 | 41.2 Ų | 41.2 | 15% | 0.148 | 24% | 0.235 | C | C | . | . | trans | -65 | 131.9 | -177.1 | -72.3 | 165.7 | -169.3 | 0 | 0 | 111.8 | R40 K284 M294 L451 | R40-M288 PolarHBondContact NH1-O 3.22Å; R40-M288 PolarHBondContact NH2-O 3.02Å; K284-M288 HydrophobicContact CB-CE 4.24Å; K284-M288 VanDerWaalsContact O-CG 3.28Å; K284-M288 WeakPolarHBondContact O-CG 3.47Å; K284-M288 PolarHBondContact O-N 3.43Å; K284-M288 VanDerWaalsContact O-N 3.13Å; M288-M294 HydrophobicContact CE-CG 3.76Å; M288-M294 HydrophobicContact CG-CB 4.49Å; M288-M294 HydrophobicContact CG-CE 4.43Å; M288-M294 HydrophobicContact CG-CG 4.25Å; M288-M294 HydrophobicContact SD-CB 3.93Å; M288-M294 HydrophobicContact SD-CG 3.69Å; M288-L451 HydrophobicContact CE-CD2 3.33Å | ||
| 289 | S | 69.4 | Low | 77.4 | Confident | 120 Ų | 120 | 41.8 Ų | 41.8 | 84% | 0.839 | 25% | 0.245 | S | C | * | . | S | Bend | trans | -71.5 | -36.5 | 175.8 | -32.9 | 0 | 0 | 0 | 0 | 112.4 | R40 E287 | R40-S289 VanDerWaalsContact NH2-C 3.31Å; R40-S289 PolarHBondContact NH2-O 2.89Å; E287-S289 PolarHBondContact O-N 3.46Å |
| 290 | D | 74.1 | Confident | 77.6 | Confident | 79 Ų | 79 | 44.2 Ų | 44.2 | 42% | 0.422 | 26% | 0.255 | S | S | . | . | trans | -135.3 | 99.1 | 175.3 | -176.9 | 2.3 | 0 | 0 | 0 | 111.8 | S292 A293 M294 | D290-S292 PolarHBondContact O-N 3.49Å; D290-S292 WeakPolarHBondContact OD1-CB 3.48Å; D290-S292 PolarHBondContact OD1-N 2.9Å; D290-S292 PolarHBondContact OD1-OG 3.28Å; D290-S292 PolarHBondContact OD2-OG 3.49Å; D290-A293 HydrophobicContact CB-CB 4.25Å; D290-A293 PolarHBondContact OD1-N 3.04Å; D290-A293 VanDerWaalsContact OD2-CB 3.24Å; D290-A293 WeakPolarHBondContact OD2-CB 3.47Å; D290-M294 WeakPolarHBondContact O-CB 3.46Å; D290-M294 PolarHBondContact O-N 3.31Å; D290-M294 VanDerWaalsContact O-N 3.17Å | ||
| 291 | P | 71.1 | Confident | 78.6 | Confident | 21 Ų | 21 | 43.8 Ų | 43.8 | 14% | 0.136 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -64.3 | -26.1 | 178.5 | -23.8 | 34.6 | 0 | 0 | 0 | 114 | F37 R40 G295 | F37-P291 HydrophobicContact CE1-CB 3.58Å; F37-P291 HydrophobicContact CE1-CG 4.1Å; F37-P291 HydrophobicContact CZ-CB 3.94Å; R40-P291 VanDerWaalsContact CZ-CG 3.48Å; R40-P291 VanDerWaalsContact NH1-CG 3.33Å; P291-G295 PolarHBondContact O-N 3.48Å |
| 292 | S | 75.3 | Confident | 79.5 | Confident | 75 Ų | 75 | 44.5 Ų | 44.5 | 52% | 0.524 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -75.7 | -44.5 | -175.6 | 75.2 | 0 | 0 | 0 | 0 | 111.1 | D290 K296 | D290-S292 PolarHBondContact O-N 3.49Å; D290-S292 WeakPolarHBondContact OD1-CB 3.48Å; D290-S292 PolarHBondContact OD1-N 2.9Å; D290-S292 PolarHBondContact OD1-OG 3.28Å; D290-S292 PolarHBondContact OD2-OG 3.49Å; S292-K296 WeakPolarHBondContact O-CG 3.38Å; S292-K296 PolarHBondContact O-N 2.99Å; S292-K296 VanDerWaalsContact O-N 3.16Å |
| 293 | A | 75.5 | Confident | 80 | Confident | 24 Ų | 24 | 49.4 Ų | 49.4 | 20% | 0.198 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -64.5 | -44.5 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | A122 D290 G295 K296 K297 | A122-A293 HydrophobicContact CB-CB 4.4Å; D290-A293 HydrophobicContact CB-CB 4.25Å; D290-A293 PolarHBondContact OD1-N 3.04Å; D290-A293 VanDerWaalsContact OD2-CB 3.24Å; D290-A293 WeakPolarHBondContact OD2-CB 3.47Å; A293-G295 PolarHBondContact O-N 3.07Å; A293-K296 WeakPolarHBondContact O-CB 3.39Å; A293-K296 PolarHBondContact O-N 2.87Å; A293-K297 WeakPolarHBondContact O-CG 3.48Å; A293-K297 PolarHBondContact O-N 2.85Å |
| 294 | M | 76.3 | Confident | 80.9 | Confident | 43 Ų | 43 | 49.4 Ų | 49.4 | 21% | 0.212 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -64.8 | -39.3 | 178.8 | -166.3 | 65 | 87.2 | 0 | 0 | 112.1 | M288 D290 K296 K297 L298 V400 | M288-M294 HydrophobicContact CE-CG 3.76Å; M288-M294 HydrophobicContact CG-CB 4.49Å; M288-M294 HydrophobicContact CG-CE 4.43Å; M288-M294 HydrophobicContact CG-CG 4.25Å; M288-M294 HydrophobicContact SD-CB 3.93Å; M288-M294 HydrophobicContact SD-CG 3.69Å; D290-M294 WeakPolarHBondContact O-CB 3.46Å; D290-M294 PolarHBondContact O-N 3.31Å; D290-M294 VanDerWaalsContact O-N 3.17Å; M294-K296 VanDerWaalsContact C-N 3.33Å; M294-K296 PolarHBondContact O-N 3.32Å; M294-K297 PolarHBondContact O-N 3.45Å; M294-K297 HydrophobicContact SD-CD 4.47Å; M294-L298 WeakPolarHBondContact O-CB 3.48Å; M294-L298 PolarHBondContact O-N 3.23Å; M294-V400 HydrophobicContact CE-CG1 4.03Å; M294-V400 HydrophobicContact SD-CG1 4.06Å |
| 295 | G | 78.9 | Confident | 82.1 | Confident | 42 Ų | 42 | 47.9 Ų | 47.9 | 43% | 0.433 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -60.9 | -38.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | P291 A293 L298 G299 | P291-G295 PolarHBondContact O-N 3.48Å; A293-G295 PolarHBondContact O-N 3.07Å; G295-L298 PolarHBondContact O-N 3.35Å; G295-G299 PolarHBondContact O-N 3.13Å |
| 296 | K | 82.8 | Confident | 82.9 | Confident | 140 Ų | 140 | 49.3 Ų | 49.3 | 61% | 0.609 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -63.5 | -49.3 | 173.1 | -72.1 | 175.6 | -176.3 | 174.6 | 0 | 111.5 | S292 A293 M294 L298 G299 F300 | S292-K296 WeakPolarHBondContact O-CG 3.38Å; S292-K296 PolarHBondContact O-N 2.99Å; S292-K296 VanDerWaalsContact O-N 3.16Å; A293-K296 WeakPolarHBondContact O-CB 3.39Å; A293-K296 PolarHBondContact O-N 2.87Å; M294-K296 VanDerWaalsContact C-N 3.33Å; M294-K296 PolarHBondContact O-N 3.32Å; K296-L298 VanDerWaalsContact C-N 3.29Å; K296-L298 PolarHBondContact O-N 2.96Å; K296-G299 PolarHBondContact O-N 3.3Å; K296-G299 VanDerWaalsContact O-N 3.16Å; K296-F300 WeakPolarHBondContact O-CD2 3.34Å; K296-F300 PolarHBondContact O-N 2.49Å |
| 297 | K | 84.8 | Confident | 83.7 | Confident | 18 Ų | 18 | 53.2 Ų | 53.2 | 8% | 0.078 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -55.3 | -45.9 | 176.8 | -67.2 | -172.2 | -177.1 | -158.7 | 0 | 111 | G119 A122 A293 M294 G299 F300 Y301 F396 V400 | G119-K297 WeakPolarHBondContact O-CD 3.24Å; G119-K297 WeakPolarHBondContact O-CE 3.35Å; G119-K297 PolarHBondContact O-NZ 2.77Å; A122-K297 HydrophobicContact CB-CD 4.37Å; A122-K297 HydrophobicContact CB-CG 3.77Å; A293-K297 WeakPolarHBondContact O-CG 3.48Å; A293-K297 PolarHBondContact O-N 2.85Å; M294-K297 PolarHBondContact O-N 3.45Å; M294-K297 HydrophobicContact SD-CD 4.47Å; K297-G299 PolarHBondContact O-N 2.92Å; K297-F300 PolarHBondContact O-N 3.33Å; K297-Y301 WeakPolarHBondContact O-CB 3.28Å; K297-Y301 PolarHBondContact O-N 2.99Å; K297-F396 HydrophobicContact CB-CE2 4.13Å; K297-F396 HydrophobicContact CB-CZ 4.3Å; K297-V400 HydrophobicContact CD-CG2 4.19Å |
| 298 | L | 85.2 | Confident | 84.8 | Confident | 25 Ų | 25 | 48.6 Ų | 48.6 | 13% | 0.131 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -66.7 | -35.9 | 179.1 | -166.9 | 65.5 | 0 | 0 | 0 | 113 | M294 G295 K296 Y301 A302 F396 L451 I452 V455 | M294-L298 WeakPolarHBondContact O-CB 3.48Å; M294-L298 PolarHBondContact O-N 3.23Å; G295-L298 PolarHBondContact O-N 3.35Å; K296-L298 VanDerWaalsContact C-N 3.29Å; K296-L298 PolarHBondContact O-N 2.96Å; L298-Y301 HydrophobicContact CD1-CD1 3.94Å; L298-Y301 WeakPolarHBondContact O-CB 3.48Å; L298-Y301 PolarHBondContact O-N 3.48Å; L298-A302 PolarHBondContact O-N 2.99Å; L298-F396 HydrophobicContact CD1-CE1 4.35Å; L298-L451 WeakPolarHBondContact CD1-O 3.47Å; L298-I452 HydrophobicContact CD1-CG2 4.17Å; L298-V455 HydrophobicContact CD1-CG1 4.5Å; L298-V455 HydrophobicContact CD1-CG2 3.75Å; L298-V455 HydrophobicContact CD2-CG1 3.7Å; L298-V455 HydrophobicContact CD2-CG2 4.32Å; L298-V455 HydrophobicContact CG-CG1 3.8Å; L298-V455 HydrophobicContact CG-CG2 3.97Å |
| 299 | G | 87.4 | Confident | 86.1 | Confident | 31 Ų | 31 | 47.3 Ų | 47.3 | 32% | 0.32 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -63.7 | -47.5 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | G295 K296 K297 Y301 A302 I303 | G295-G299 PolarHBondContact O-N 3.13Å; K296-G299 PolarHBondContact O-N 3.3Å; K296-G299 VanDerWaalsContact O-N 3.16Å; K297-G299 PolarHBondContact O-N 2.92Å; G299-Y301 VanDerWaalsContact C-N 3.3Å; G299-Y301 PolarHBondContact O-N 3.07Å; G299-A302 PolarHBondContact O-N 3.07Å; G299-I303 WeakPolarHBondContact O-CG1 3.39Å; G299-I303 PolarHBondContact O-N 3.07Å |
| 300 | F | 90.4 | Very high | 87.3 | Confident | 93 Ų | 93 | 44.2 Ų | 44.2 | 41% | 0.408 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -62.5 | -37.9 | 174.9 | -84.5 | -75.1 | 0 | 0 | 0 | 112.2 | I116 P118 A121 K296 K297 I303 T304 | I116-F300 HydrophobicContact CG2-CD1 4.42Å; P118-F300 HydrophobicContact CB-CB 3.78Å; A121-F300 HydrophobicContact CB-CD2 4.13Å; A121-F300 HydrophobicContact CB-CE2 4.38Å; A121-F300 HydrophobicContact CB-CG 4.44Å; K296-F300 WeakPolarHBondContact O-CD2 3.34Å; K296-F300 PolarHBondContact O-N 2.49Å; K297-F300 PolarHBondContact O-N 3.33Å; F300-I303 PolarHBondContact O-N 3.27Å; F300-T304 WeakPolarHBondContact O-CB 3.42Å; F300-T304 PolarHBondContact O-N 3.27Å; F300-T304 PolarHBondContact O-OG1 3.28Å |
| 301 | Y | 93.1 | Very high | 88.4 | Confident | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -58.3 | -51 | 171.5 | 162.6 | -103.1 | 0 | 0 | 0 | 111.8 | K297 L298 G299 I303 T304 V305 Y389 V392 A393 F396 I452 V455 L459 | K297-Y301 WeakPolarHBondContact O-CB 3.28Å; K297-Y301 PolarHBondContact O-N 2.99Å; L298-Y301 HydrophobicContact CD1-CD1 3.94Å; L298-Y301 WeakPolarHBondContact O-CB 3.48Å; L298-Y301 PolarHBondContact O-N 3.48Å; G299-Y301 VanDerWaalsContact C-N 3.3Å; G299-Y301 PolarHBondContact O-N 3.07Å; Y301-I303 VanDerWaalsContact C-N 3.3Å; Y301-I303 PolarHBondContact O-N 3.35Å; Y301-T304 WeakPolarHBondContact O-CB 3.47Å; Y301-T304 PolarHBondContact O-N 3.03Å; Y301-T304 VanDerWaalsContact O-N 3.12Å; Y301-V305 HydrophobicContact CD2-CG2 4.15Å; Y301-V305 HydrophobicContact CE1-CG2 4.45Å; Y301-V305 HydrophobicContact CE2-CG2 3.65Å; Y301-V305 WeakPolarHBondContact O-CG2 3.37Å; Y301-V305 PolarHBondContact O-N 2.76Å; Y301-Y389 WeakPolarHBondContact OH-CD2 3.36Å; Y301-Y389 WeakPolarHBondContact OH-CE2 3.42Å; Y301-V392 HydrophobicContact CD2-CG1 4.04Å; Y301-V392 HydrophobicContact CE2-CG1 3.91Å; Y301-A393 HydrophobicContact CE2-CB 3.89Å; Y301-A393 WeakPolarHBondContact OH-CB 3.35Å; Y301-F396 HydrophobicContact CD1-CE1 4.43Å; Y301-F396 HydrophobicContact CD2-CB 3.76Å; Y301-F396 AromaticContact CD2-CD1 3.64Å; Y301-F396 HydrophobicContact CD2-CD1 3.64Å; Y301-F396 HydrophobicContact CD2-CD2 4.23Å; Y301-F396 HydrophobicContact CD2-CE1 4.27Å; Y301-F396 AromaticContact CD2-CG 3.6Å; Y301-F396 HydrophobicContact CD2-CG 3.6Å; Y301-F396 HydrophobicContact CE2-CB 4.25Å; Y301-F396 HydrophobicContact CE2-CD1 4.15Å; Y301-F396 HydrophobicContact CE2-CG 4.35Å; Y301-F396 AromaticContact CG-CD1 3.83Å; Y301-F396 HydrophobicContact CG-CD1 3.83Å; Y301-F396 HydrophobicContact CG-CD2 4.34Å; Y301-F396 AromaticContact CG-CE1 3.98Å; Y301-F396 HydrophobicContact CG-CE1 3.98Å; Y301-F396 HydrophobicContact CG-CE2 4.46Å; Y301-F396 HydrophobicContact CG-CG 4.01Å; Y301-F396 HydrophobicContact CG-CZ 4.28Å; Y301-I452 HydrophobicContact CD1-CG2 4.17Å; Y301-I452 HydrophobicContact CE1-CB 3.98Å; Y301-I452 HydrophobicContact CE1-CG2 3.65Å; Y301-V455 HydrophobicContact CD1-CG2 4.07Å; Y301-V455 HydrophobicContact CE1-CG2 3.9Å; Y301-L459 HydrophobicContact CD1-CD1 4.48Å; Y301-L459 HydrophobicContact CE1-CD1 3.78Å |
| 302 | A | 91.9 | Very high | 89.7 | Confident | 21 Ų | 21 | 42 Ų | 42 | 17% | 0.174 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -59.7 | -41.7 | 179 | 0 | 0 | 0 | 0 | 0 | 111.9 | L298 G299 V305 V306 L459 | L298-A302 PolarHBondContact O-N 2.99Å; G299-A302 PolarHBondContact O-N 3.07Å; A302-V305 PolarHBondContact O-N 3.41Å; A302-V306 WeakPolarHBondContact O-CG2 3.49Å; A302-V306 PolarHBondContact O-N 3.31Å; A302-L459 HydrophobicContact CB-CD1 4.46Å; A302-L459 HydrophobicContact CB-CD2 4.18Å |
| 303 | I | 93.6 | Very high | 90.6 | Very high | 104 Ų | 104 | 38.5 Ų | 38.5 | 53% | 0.533 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -62.1 | -44.5 | 175.2 | -68.3 | 166 | 0 | 0 | 0 | 110.9 | G299 F300 Y301 V305 V306 F307 | G299-I303 WeakPolarHBondContact O-CG1 3.39Å; G299-I303 PolarHBondContact O-N 3.07Å; F300-I303 PolarHBondContact O-N 3.27Å; Y301-I303 VanDerWaalsContact C-N 3.3Å; Y301-I303 PolarHBondContact O-N 3.35Å; I303-V305 PolarHBondContact O-N 3.17Å; I303-V306 PolarHBondContact O-N 3.1Å; I303-F307 WeakPolarHBondContact O-CB 3.45Å; I303-F307 PolarHBondContact O-N 3.12Å |
| 304 | T | 95.6 | Very high | 91.5 | Very high | 0 Ų | 0 | 41.9 Ų | 41.9 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -58.8 | -47.1 | 178.5 | -58.5 | 0 | 0 | 0 | 0 | 111.2 | M112 V113 I116 F300 Y301 F307 G308 V392 | M112-T304 HydrophobicContact CB-CG2 4.02Å; V113-T304 HydrophobicContact CB-CG2 4.15Å; I116-T304 HydrophobicContact CD1-CG2 4.12Å; I116-T304 WeakPolarHBondContact CG2-OG1 3Å; F300-T304 WeakPolarHBondContact O-CB 3.42Å; F300-T304 PolarHBondContact O-N 3.27Å; F300-T304 PolarHBondContact O-OG1 3.28Å; Y301-T304 WeakPolarHBondContact O-CB 3.47Å; Y301-T304 PolarHBondContact O-N 3.03Å; Y301-T304 VanDerWaalsContact O-N 3.12Å; T304-F307 PolarHBondContact O-N 3.3Å; T304-G308 PolarHBondContact O-N 3.42Å; T304-V392 HydrophobicContact CG2-CG1 3.85Å |
| 305 | V | 96 | Very high | 92.5 | Very high | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -62.7 | -51.1 | 177.5 | 174.5 | 0 | 0 | 0 | 0 | 110.8 | Y301 A302 I303 F307 G308 L309 Y389 V392 L459 | Y301-V305 HydrophobicContact CD2-CG2 4.15Å; Y301-V305 HydrophobicContact CE1-CG2 4.45Å; Y301-V305 HydrophobicContact CE2-CG2 3.65Å; Y301-V305 WeakPolarHBondContact O-CG2 3.37Å; Y301-V305 PolarHBondContact O-N 2.76Å; A302-V305 PolarHBondContact O-N 3.41Å; I303-V305 PolarHBondContact O-N 3.17Å; V305-F307 VanDerWaalsContact C-N 3.31Å; V305-F307 PolarHBondContact O-N 3.23Å; V305-G308 PolarHBondContact O-N 3.27Å; V305-L309 HydrophobicContact CG1-CD1 3.83Å; V305-L309 HydrophobicContact CG1-CG 4.27Å; V305-L309 WeakPolarHBondContact O-CB 3.23Å; V305-L309 VanDerWaalsContact O-CG 3.27Å; V305-L309 WeakPolarHBondContact O-CG 3.36Å; V305-L309 PolarHBondContact O-N 3.15Å; V305-Y389 HydrophobicContact CG1-CD2 4.21Å; V305-Y389 HydrophobicContact CG2-CD2 4.39Å; V305-V392 HydrophobicContact CG2-CB 4.12Å; V305-V392 HydrophobicContact CG2-CG1 3.58Å; V305-L459 HydrophobicContact CB-CD1 4.26Å; V305-L459 HydrophobicContact CB-CD2 4.24Å; V305-L459 HydrophobicContact CG1-CB 4.5Å; V305-L459 HydrophobicContact CG1-CD1 4.25Å; V305-L459 HydrophobicContact CG1-CD2 4.15Å; V305-L459 HydrophobicContact CG2-CD1 4.35Å |
| 306 | V | 95.6 | Very high | 93.3 | Very high | 45 Ų | 45 | 45.9 Ų | 45.9 | 27% | 0.273 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -60.5 | -43.2 | -179.4 | 171.3 | 0 | 0 | 0 | 0 | 111 | A302 I303 L309 V310 L459 F462 | A302-V306 WeakPolarHBondContact O-CG2 3.49Å; A302-V306 PolarHBondContact O-N 3.31Å; I303-V306 PolarHBondContact O-N 3.1Å; V306-L309 PolarHBondContact O-N 3.26Å; V306-V310 HydrophobicContact CG1-CG2 4.36Å; V306-V310 WeakPolarHBondContact O-CB 3.47Å; V306-V310 VanDerWaalsContact O-CG2 3.29Å; V306-V310 WeakPolarHBondContact O-CG2 3.24Å; V306-V310 PolarHBondContact O-N 3.24Å; V306-L459 HydrophobicContact CG2-CD2 3.59Å; V306-F462 HydrophobicContact CG2-CD2 4.22Å; V306-F462 HydrophobicContact CG2-CE2 4.43Å |
| 307 | F | 96.3 | Very high | 94 | Very high | 110 Ų | 110 | 39.2 Ų | 39.2 | 48% | 0.482 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -64.8 | -43.2 | 178.7 | -172.1 | -103.3 | 0 | 0 | 0 | 111.7 | M112 I303 T304 V305 V310 L311 | M112-F307 HydrophobicContact CG-CD1 4.43Å; M112-F307 HydrophobicContact SD-CD1 3.47Å; M112-F307 WeakPolarHBondContact SD-CD1 3.34Å; M112-F307 HydrophobicContact SD-CE1 3.55Å; M112-F307 VanDerWaalsContact SD-CE1 3.55Å; I303-F307 WeakPolarHBondContact O-CB 3.45Å; I303-F307 PolarHBondContact O-N 3.12Å; T304-F307 PolarHBondContact O-N 3.3Å; V305-F307 VanDerWaalsContact C-N 3.31Å; V305-F307 PolarHBondContact O-N 3.23Å; F307-V310 PolarHBondContact O-N 3Å; F307-L311 WeakPolarHBondContact O-CB 3.31Å; F307-L311 PolarHBondContact O-N 3.43Å |
| 308 | G | 97.4 | Very high | 94.5 | Very high | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -60.2 | -44.4 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | T304 V305 V310 L311 H312 L388 | T304-G308 PolarHBondContact O-N 3.42Å; V305-G308 PolarHBondContact O-N 3.27Å; G308-V310 PolarHBondContact O-N 3.02Å; G308-L311 PolarHBondContact O-N 3.48Å; G308-H312 WeakPolarHBondContact O-CB 3.13Å; G308-H312 PolarHBondContact O-N 3.36Å; G308-L388 WeakPolarHBondContact O-CD1 3.45Å |
| 309 | L | 96.6 | Very high | 95.1 | Very high | 3 Ų | 3 | 39.5 Ų | 39.5 | 2% | 0.016 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -63.8 | -39.7 | 176.3 | -70.5 | 174.3 | 0 | 0 | 0 | 112.4 | V305 V306 G313 G385 L388 F462 R463 V466 | V305-L309 HydrophobicContact CG1-CD1 3.83Å; V305-L309 HydrophobicContact CG1-CG 4.27Å; V305-L309 WeakPolarHBondContact O-CB 3.23Å; V305-L309 VanDerWaalsContact O-CG 3.27Å; V305-L309 WeakPolarHBondContact O-CG 3.36Å; V305-L309 PolarHBondContact O-N 3.15Å; V306-L309 PolarHBondContact O-N 3.26Å; L309-G313 WeakPolarHBondContact O-CA 3.45Å; L309-G313 PolarHBondContact O-N 2.98Å; L309-G385 VanDerWaalsContact CD2-CA 3.41Å; L309-L388 HydrophobicContact CD2-CD2 4.29Å; L309-L388 HydrophobicContact CG-CD2 4.31Å; L309-F462 HydrophobicContact CD1-CB 3.66Å; L309-R463 HydrophobicContact CD1-CG 3.97Å; L309-R463 HydrophobicContact CD2-CG 4.45Å; L309-V466 HydrophobicContact CB-CG2 4.14Å; L309-V466 HydrophobicContact CD2-CB 4.39Å; L309-V466 HydrophobicContact CD2-CG2 4.2Å |
| 310 | V | 96.1 | Very high | 95.4 | Very high | 55 Ų | 55 | 39.5 Ų | 39.5 | 33% | 0.333 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -65.5 | -45.1 | 175 | 164.7 | 0 | 0 | 0 | 0 | 110.7 | V306 F307 G308 L314 F315 | V306-V310 HydrophobicContact CG1-CG2 4.36Å; V306-V310 WeakPolarHBondContact O-CB 3.47Å; V306-V310 VanDerWaalsContact O-CG2 3.29Å; V306-V310 WeakPolarHBondContact O-CG2 3.24Å; V306-V310 PolarHBondContact O-N 3.24Å; F307-V310 PolarHBondContact O-N 3Å; G308-V310 PolarHBondContact O-N 3.02Å; V310-L314 HydrophobicContact CG1-CD1 4.19Å; V310-L314 WeakPolarHBondContact O-CB 3Å; V310-L314 PolarHBondContact O-N 2.82Å; V310-F315 HydrophobicContact CG1-CE2 4.2Å |
| 311 | L | 97.1 | Very high | 95.7 | Very high | 52 Ų | 52 | 35.7 Ų | 35.7 | 27% | 0.272 | 19% | 0.189 | S | C | . | . | I | π-helix | trans | -60.9 | -49.3 | 178.2 | -175.8 | 62.4 | 0 | 0 | 0 | 111.1 | V108 M112 F307 G308 F315 I316 | V108-L311 HydrophobicContact CG1-CD2 3.93Å; V108-L311 HydrophobicContact CG1-CG 4.41Å; M112-L311 HydrophobicContact CE-CD2 3.99Å; M112-L311 HydrophobicContact SD-CD2 4.32Å; F307-L311 WeakPolarHBondContact O-CB 3.31Å; F307-L311 PolarHBondContact O-N 3.43Å; G308-L311 PolarHBondContact O-N 3.48Å; L311-F315 HydrophobicContact CD1-CB 4.4Å; L311-F315 HydrophobicContact CD1-CD2 4.25Å; L311-F315 HydrophobicContact CD1-CG 4.45Å; L311-F315 VanDerWaalsContact O-CB 3.3Å; L311-F315 WeakPolarHBondContact O-CB 3.29Å; L311-F315 PolarHBondContact O-N 2.96Å; L311-I316 HydrophobicContact CG-CD1 4.49Å; L311-I316 PolarHBondContact O-N 3.17Å; L311-I316 VanDerWaalsContact O-N 3.14Å |
| 312 | H | 97.4 | Very high | 95.9 | Very high | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 21% | 0.209 | C | C | . | . | I | π-helix | trans | -66 | -51.2 | 178.3 | -172.6 | 67.5 | 0 | 0 | 0 | 112.2 | T101 G308 I316 L317 D384 L388 | T101-H312 PolarHBondContact O-CE1 3.47Å; G308-H312 WeakPolarHBondContact O-CB 3.13Å; G308-H312 PolarHBondContact O-N 3.36Å; H312-I316 PolarHBondContact O-N 3.48Å; H312-L317 PolarHBondContact O-N 2.84Å; H312-D384 IonicContact CD2-OD2 3.82Å; H312-D384 IonicContact CE1-OD2 3.49Å; H312-D384 WeakPolarHBondContact NE2-CB 3.46Å; H312-D384 IonicContact NE2-OD2 2.9Å; H312-D384 PolarHBondContact NE2-OD2 3.5Å; H312-L388 HydrophobicContact CB-CD1 4.13Å |
| 313 | G | 95.1 | Very high | 96.1 | Very high | 2 Ų | 2 | 45.4 Ų | 45.4 | 2% | 0.021 | 23% | 0.227 | C | C | . | . | I | π-helix | trans | -70.8 | -43.1 | -173.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | L309 P318 | L309-G313 WeakPolarHBondContact O-CA 3.45Å; L309-G313 PolarHBondContact O-N 2.98Å; G313-P318 WeakPolarHBondContact O-CD 3.48Å; G313-P318 WeakPolarHBondContact O-CG 2.88Å |
| 314 | L | 94.5 | Very high | 96.2 | Very high | 96 Ų | 96 | 43.7 Ų | 43.7 | 50% | 0.503 | 22% | 0.219 | S | C | . | . | I | π-helix | trans | -96.7 | -16.2 | -174.7 | -60.3 | -173 | 0 | 0 | 0 | 114.1 | V310 P318 M469 | V310-L314 HydrophobicContact CG1-CD1 4.19Å; V310-L314 WeakPolarHBondContact O-CB 3Å; V310-L314 PolarHBondContact O-N 2.82Å; L314-P318 WeakPolarHBondContact O-CG 3.18Å; L314-M469 HydrophobicContact CD2-CE 4.14Å; L314-M469 HydrophobicContact CD2-SD 4.47Å |
| 315 | F | 96.2 | Very high | 96.1 | Very high | 129 Ų | 129 | 43.9 Ų | 43.9 | 57% | 0.566 | 22% | 0.22 | S | C | * | . | I | π-helix | trans | -117.6 | -56.3 | -179 | -57.1 | -95.2 | 0 | 0 | 0 | 112.3 | V310 L311 A319 | V310-F315 HydrophobicContact CG1-CE2 4.2Å; L311-F315 HydrophobicContact CD1-CB 4.4Å; L311-F315 HydrophobicContact CD1-CD2 4.25Å; L311-F315 HydrophobicContact CD1-CG 4.45Å; L311-F315 VanDerWaalsContact O-CB 3.3Å; L311-F315 WeakPolarHBondContact O-CB 3.29Å; L311-F315 PolarHBondContact O-N 2.96Å; F315-A319 WeakPolarHBondContact O-CB 3.06Å; F315-A319 PolarHBondContact O-N 3.34Å |
| 316 | I | 97.1 | Very high | 96 | Very high | 39 Ų | 39 | 50.8 Ų | 50.8 | 20% | 0.2 | 25% | 0.25 | C | S | . | . | I | π-helix | trans | -70 | -52 | -172.3 | -61.2 | 175.5 | 0 | 0 | 0 | 111.9 | V104 V108 L311 H312 A319 M320 | V104-I316 HydrophobicContact CG1-CD1 4.44Å; V104-I316 HydrophobicContact CG1-CG2 3.88Å; V108-I316 HydrophobicContact CG2-CD1 3.32Å; L311-I316 HydrophobicContact CG-CD1 4.49Å; L311-I316 PolarHBondContact O-N 3.17Å; L311-I316 VanDerWaalsContact O-N 3.14Å; H312-I316 PolarHBondContact O-N 3.48Å; I316-A319 PolarHBondContact O-N 2.98Å; I316-M320 HydrophobicContact CG2-CE 4.19Å; I316-M320 PolarHBondContact O-N 3.45Å |
| 317 | L | 96.3 | Very high | 95.8 | Very high | 0 Ų | 0 | 54.5 Ų | 54.5 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -61.1 | -46.4 | 179 | -65.1 | 176.5 | 0 | 0 | 0 | 112.2 | T101 H312 A319 M320 Y321 V466 L473 | T101-L317 HydrophobicContact CG2-CD2 4.21Å; H312-L317 PolarHBondContact O-N 2.84Å; L317-A319 PolarHBondContact O-N 2.86Å; L317-M320 HydrophobicContact CD2-CE 3.66Å; L317-M320 PolarHBondContact O-N 3.33Å; L317-Y321 PolarHBondContact O-N 2.63Å; L317-V466 HydrophobicContact CD1-CG1 4.35Å; L317-L473 HydrophobicContact CB-CD1 3.7Å |
| 318 | P | 96.6 | Very high | 95.7 | Very high | 10 Ų | 10 | 52.2 Ų | 52.2 | 7% | 0.065 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -64.1 | -36.4 | 174.9 | -28.7 | 41.7 | 0 | 0 | 0 | 113.4 | G313 L314 Y321 F322 P329 I333 L473 | G313-P318 WeakPolarHBondContact O-CD 3.48Å; G313-P318 WeakPolarHBondContact O-CG 2.88Å; L314-P318 WeakPolarHBondContact O-CG 3.18Å; P318-Y321 WeakPolarHBondContact O-CB 3.48Å; P318-Y321 PolarHBondContact O-N 2.87Å; P318-F322 WeakPolarHBondContact O-CB 3.48Å; P318-F322 PolarHBondContact O-N 3.08Å; P318-P329 HydrophobicContact CB-CB 3.78Å; P318-P329 HydrophobicContact CB-CG 3.88Å; P318-I333 HydrophobicContact CB-CD1 4.35Å; P318-I333 HydrophobicContact CG-CD1 3.86Å; P318-L473 HydrophobicContact CG-CD1 4.46Å |
| 319 | A | 96.5 | Very high | 95.6 | Very high | 39 Ų | 39 | 53 Ų | 53 | 32% | 0.322 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -63.6 | -46.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | F315 I316 L317 Y321 F322 F323 | F315-A319 WeakPolarHBondContact O-CB 3.06Å; F315-A319 PolarHBondContact O-N 3.34Å; I316-A319 PolarHBondContact O-N 2.98Å; L317-A319 PolarHBondContact O-N 2.86Å; A319-Y321 VanDerWaalsContact C-N 3.32Å; A319-Y321 PolarHBondContact O-N 3.28Å; A319-F322 PolarHBondContact O-N 3.33Å; A319-F323 HydrophobicContact CB-CD2 4.35Å; A319-F323 HydrophobicContact CB-CE2 4.24Å; A319-F323 WeakPolarHBondContact O-CD2 3.36Å; A319-F323 PolarHBondContact O-N 3.45Å |
| 320 | M | 95.3 | Very high | 95.4 | Very high | 32 Ų | 32 | 59.5 Ų | 59.5 | 16% | 0.158 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -59 | -44.3 | 175 | -73.6 | -164.8 | -65.4 | 0 | 0 | 111.7 | T101 I316 L317 F322 F323 I324 | T101-M320 HydrophobicContact CG2-CE 3.36Å; T101-M320 HydrophobicContact CG2-SD 4.24Å; I316-M320 HydrophobicContact CG2-CE 4.19Å; I316-M320 PolarHBondContact O-N 3.45Å; L317-M320 HydrophobicContact CD2-CE 3.66Å; L317-M320 PolarHBondContact O-N 3.33Å; M320-F322 PolarHBondContact O-N 3.32Å; M320-F323 PolarHBondContact O-N 3.14Å; M320-I324 VanDerWaalsContact O-CG1 3.32Å; M320-I324 WeakPolarHBondContact O-CG1 3.48Å; M320-I324 PolarHBondContact O-N 2.99Å; M320-I324 VanDerWaalsContact O-N 3.09Å |
| 321 | Y | 96.4 | Very high | 95.2 | Very high | 13 Ų | 13 | 61.6 Ų | 61.6 | 5% | 0.051 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -56.8 | -48.1 | 173.9 | -179.5 | -84.1 | 0 | 0 | 0 | 111.9 | L317 P318 A319 T325 K327 P329 Y332 L473 I477 | L317-Y321 PolarHBondContact O-N 2.63Å; P318-Y321 WeakPolarHBondContact O-CB 3.48Å; P318-Y321 PolarHBondContact O-N 2.87Å; A319-Y321 VanDerWaalsContact C-N 3.32Å; A319-Y321 PolarHBondContact O-N 3.28Å; Y321-T325 WeakPolarHBondContact CD1-OG1 3.15Å; Y321-T325 HydrophobicContact CD2-CG2 4.13Å; Y321-T325 HydrophobicContact CE1-CG2 4.38Å; Y321-T325 VanDerWaalsContact CE1-OG1 3.25Å; Y321-T325 WeakPolarHBondContact CE1-OG1 3.27Å; Y321-T325 HydrophobicContact CE2-CG2 3.95Å; Y321-T325 HydrophobicContact CG-CG2 4.41Å; Y321-T325 WeakPolarHBondContact O-CB 3.3Å; Y321-T325 WeakPolarHBondContact O-CG2 3.49Å; Y321-T325 PolarHBondContact O-N 3.45Å; Y321-T325 PolarHBondContact O-OG1 3.26Å; Y321-K327 HydrophobicContact CE1-CB 4.1Å; Y321-P329 HydrophobicContact CD1-CB 3.77Å; Y321-P329 HydrophobicContact CE1-CB 4.48Å; Y321-P329 HydrophobicContact CG-CB 4.39Å; Y321-Y332 HydrophobicContact CE2-CD1 4.26Å; Y321-Y332 HydrophobicContact CE2-CD2 4.13Å; Y321-Y332 HydrophobicContact CE2-CE1 4.39Å; Y321-Y332 HydrophobicContact CE2-CE2 4.26Å; Y321-Y332 HydrophobicContact CE2-CG 4.11Å; Y321-Y332 AromaticContact CZ-CD2 3.85Å; Y321-Y332 AromaticContact CZ-CG 3.89Å; Y321-Y332 WeakPolarHBondContact OH-CD2 3.26Å; Y321-L473 HydrophobicContact CD2-CB 4.45Å; Y321-L473 HydrophobicContact CD2-CD2 3.75Å; Y321-L473 HydrophobicContact CE2-CD2 4.4Å; Y321-L473 HydrophobicContact CG-CD2 3.95Å; Y321-I477 HydrophobicContact CD2-CD1 4.34Å; Y321-I477 HydrophobicContact CD2-CG1 3.81Å; Y321-I477 HydrophobicContact CG-CG1 4.48Å |
| 322 | F | 97.1 | Very high | 95 | Very high | 94 Ų | 94 | 59.8 Ų | 59.8 | 41% | 0.412 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -62.7 | -46.5 | 179.4 | 177 | -102.8 | 0 | 0 | 0 | 112.1 | P318 A319 M320 I324 K326 K327 P329 | P318-F322 WeakPolarHBondContact O-CB 3.48Å; P318-F322 PolarHBondContact O-N 3.08Å; A319-F322 PolarHBondContact O-N 3.33Å; M320-F322 PolarHBondContact O-N 3.32Å; F322-I324 VanDerWaalsContact C-N 3.33Å; F322-I324 PolarHBondContact O-N 3.33Å; F322-K326 WeakPolarHBondContact O-CA 3.27Å; F322-K326 PolarHBondContact O-N 3.07Å; F322-K327 WeakPolarHBondContact CD2-O 3.39Å; F322-P329 HydrophobicContact CB-CG 4.38Å |
| 323 | F | 96.1 | Very high | 94.8 | Very high | 130 Ų | 130 | 61.2 Ų | 61.2 | 57% | 0.57 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -66.1 | -35.8 | -176.6 | -77.7 | -62.3 | 0 | 0 | 0 | 112.9 | A319 M320 K326 | A319-F323 HydrophobicContact CB-CD2 4.35Å; A319-F323 HydrophobicContact CB-CE2 4.24Å; A319-F323 WeakPolarHBondContact O-CD2 3.36Å; A319-F323 PolarHBondContact O-N 3.45Å; M320-F323 PolarHBondContact O-N 3.14Å; F323-K326 VanDerWaalsContact O-CE 3.31Å; F323-K326 WeakPolarHBondContact O-CE 3.48Å; F323-K326 PolarHBondContact O-NZ 2.85Å |
| 324 | I | 94.9 | Very high | 94.5 | Very high | 68 Ų | 68 | 71 Ų | 71 | 35% | 0.349 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -82.4 | -48.6 | -179.3 | -61.4 | 167.5 | 0 | 0 | 0 | 111.6 | Y97 M320 F322 I477 I481 | Y97-I324 HydrophobicContact CE2-CD1 4.34Å; M320-I324 VanDerWaalsContact O-CG1 3.32Å; M320-I324 WeakPolarHBondContact O-CG1 3.48Å; M320-I324 PolarHBondContact O-N 2.99Å; M320-I324 VanDerWaalsContact O-N 3.09Å; F322-I324 VanDerWaalsContact C-N 3.33Å; F322-I324 PolarHBondContact O-N 3.33Å; I324-I477 HydrophobicContact CD1-CD1 4.3Å; I324-I477 HydrophobicContact CD1-CG2 4.1Å; I324-I477 HydrophobicContact CG2-CG2 3.88Å; I324-I481 HydrophobicContact CG2-CD1 4.11Å; I324-I481 HydrophobicContact CG2-CG1 4.16Å |
| 325 | T | 94.1 | Very high | 94 | Very high | 4 Ų | 4 | 67 Ų | 67 | 3% | 0.025 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -87.5 | -16.8 | -173.7 | 69.6 | 0 | 0 | 0 | 0 | 113.8 | Y321 K327 I477 H480 | Y321-T325 WeakPolarHBondContact CD1-OG1 3.15Å; Y321-T325 HydrophobicContact CD2-CG2 4.13Å; Y321-T325 HydrophobicContact CE1-CG2 4.38Å; Y321-T325 VanDerWaalsContact CE1-OG1 3.25Å; Y321-T325 WeakPolarHBondContact CE1-OG1 3.27Å; Y321-T325 HydrophobicContact CE2-CG2 3.95Å; Y321-T325 HydrophobicContact CG-CG2 4.41Å; Y321-T325 WeakPolarHBondContact O-CB 3.3Å; Y321-T325 WeakPolarHBondContact O-CG2 3.49Å; Y321-T325 PolarHBondContact O-N 3.45Å; Y321-T325 PolarHBondContact O-OG1 3.26Å; T325-K327 PolarHBondContact O-N 3.33Å; T325-K327 VanDerWaalsContact O-N 3.16Å; T325-K327 PolarHBondContact OG1-N 3.25Å; T325-I477 HydrophobicContact CG2-CG1 4.03Å; T325-H480 HydrophobicContact CG2-CB 3.86Å |
| 326 | K | 93.7 | Very high | 93.7 | Very high | 146 Ų | 146 | 60.9 Ų | 60.9 | 64% | 0.635 | 30% | 0.3 | S | S | * | . | trans | 54.1 | 23.3 | -169.4 | -54.5 | -57.2 | -171.1 | -161.3 | 0 | 113.7 | F322 F323 | F322-K326 WeakPolarHBondContact O-CA 3.27Å; F322-K326 PolarHBondContact O-N 3.07Å; F323-K326 VanDerWaalsContact O-CE 3.31Å; F323-K326 WeakPolarHBondContact O-CE 3.48Å; F323-K326 PolarHBondContact O-NZ 2.85Å | ||
| 327 | K | 91.9 | Very high | 93 | Very high | 122 Ų | 122 | 63.2 Ų | 63.2 | 53% | 0.53 | 31% | 0.312 | S | S | . | . | S | Bend | trans | -111.7 | 153 | 177.4 | -67.4 | -177.6 | 179.1 | -174.8 | 0 | 110.8 | Y321 F322 T325 P329 | Y321-K327 HydrophobicContact CE1-CB 4.1Å; F322-K327 WeakPolarHBondContact CD2-O 3.39Å; T325-K327 PolarHBondContact O-N 3.33Å; T325-K327 VanDerWaalsContact O-N 3.16Å; T325-K327 PolarHBondContact OG1-N 3.25Å; K327-P329 WeakPolarHBondContact O-CD 3.49Å |
| 328 | S | 93.9 | Very high | 91.7 | Very high | 62 Ų | 62 | 68.8 Ų | 68.8 | 43% | 0.434 | 34% | 0.338 | S | S | . | . | trans | -65.8 | 118.7 | 178.7 | 59.6 | 0 | 0 | 0 | 0 | 111.4 | I330 V331 | S328-I330 VanDerWaalsContact C-N 3.31Å; S328-I330 PolarHBondContact O-N 2.98Å; S328-V331 WeakPolarHBondContact OG-CG2 3.34Å | ||
| 329 | P | 94.5 | Very high | 90.7 | Very high | 18 Ų | 18 | 68.3 Ų | 68.3 | 12% | 0.117 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -69.9 | -28.1 | 179.9 | 26.8 | -34.1 | 0 | 0 | 0 | 112.6 | P318 Y321 F322 K327 V331 Y332 I333 | P318-P329 HydrophobicContact CB-CB 3.78Å; P318-P329 HydrophobicContact CB-CG 3.88Å; Y321-P329 HydrophobicContact CD1-CB 3.77Å; Y321-P329 HydrophobicContact CE1-CB 4.48Å; Y321-P329 HydrophobicContact CG-CB 4.39Å; F322-P329 HydrophobicContact CB-CG 4.38Å; K327-P329 WeakPolarHBondContact O-CD 3.49Å; P329-V331 PolarHBondContact O-N 3.33Å; P329-Y332 WeakPolarHBondContact O-CB 3.16Å; P329-Y332 PolarHBondContact O-N 3.28Å; P329-Y332 VanDerWaalsContact O-N 3.14Å; P329-I333 VanDerWaalsContact O-CG1 3.31Å; P329-I333 WeakPolarHBondContact O-CG1 3.38Å; P329-I333 PolarHBondContact O-N 3.05Å |
| 330 | I | 93.3 | Very high | 90 | Very high | 138 Ų | 138 | 66.8 Ų | 66.8 | 71% | 0.708 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -60.8 | -43.7 | -177.7 | -62.3 | 164.3 | 0 | 0 | 0 | 111.5 | S328 Y332 I333 R334 | S328-I330 VanDerWaalsContact C-N 3.31Å; S328-I330 PolarHBondContact O-N 2.98Å; I330-Y332 VanDerWaalsContact C-N 3.3Å; I330-Y332 PolarHBondContact O-N 3.38Å; I330-I333 PolarHBondContact O-N 3.06Å; I330-R334 WeakPolarHBondContact O-CB 3.44Å; I330-R334 PolarHBondContact O-N 3.3Å |
| 331 | V | 91.3 | Very high | 88.9 | Confident | 100 Ų | 100 | 70.2 Ų | 70.2 | 61% | 0.606 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -64.2 | -40.4 | 177.8 | 178.9 | 0 | 0 | 0 | 0 | 110.4 | S328 P329 R334 G335 | S328-V331 WeakPolarHBondContact OG-CG2 3.34Å; P329-V331 PolarHBondContact O-N 3.33Å; V331-R334 WeakPolarHBondContact O-CB 3.28Å; V331-R334 PolarHBondContact O-N 3.4Å; V331-G335 PolarHBondContact O-N 2.94Å |
| 332 | Y | 93.8 | Very high | 87.4 | Confident | 14 Ų | 14 | 72.2 Ų | 72.2 | 6% | 0.055 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -66.2 | -44.1 | 178.4 | -169.3 | -88.7 | 0 | 0 | 0 | 112.3 | Y321 P329 I330 R334 G335 L360 N364 I366 A472 L473 G476 | Y321-Y332 HydrophobicContact CE2-CD1 4.26Å; Y321-Y332 HydrophobicContact CE2-CD2 4.13Å; Y321-Y332 HydrophobicContact CE2-CE1 4.39Å; Y321-Y332 HydrophobicContact CE2-CE2 4.26Å; Y321-Y332 HydrophobicContact CE2-CG 4.11Å; Y321-Y332 AromaticContact CZ-CD2 3.85Å; Y321-Y332 AromaticContact CZ-CG 3.89Å; Y321-Y332 WeakPolarHBondContact OH-CD2 3.26Å; P329-Y332 WeakPolarHBondContact O-CB 3.16Å; P329-Y332 PolarHBondContact O-N 3.28Å; P329-Y332 VanDerWaalsContact O-N 3.14Å; I330-Y332 VanDerWaalsContact C-N 3.3Å; I330-Y332 PolarHBondContact O-N 3.38Å; Y332-R334 VanDerWaalsContact C-N 3.32Å; Y332-R334 PolarHBondContact O-N 3.06Å; Y332-G335 PolarHBondContact O-N 2.9Å; Y332-L360 HydrophobicContact CE1-CD2 4.09Å; Y332-L360 HydrophobicContact CE2-CD2 4.48Å; Y332-L360 WeakPolarHBondContact OH-CD2 3.39Å; Y332-N364 HydrophobicContact CD2-CB 4.19Å; Y332-N364 VanDerWaalsContact CD2-ND2 3.3Å; Y332-N364 WeakPolarHBondContact CD2-ND2 3.34Å; Y332-N364 HydrophobicContact CE2-CB 3.86Å; Y332-N364 VanDerWaalsContact CE2-ND2 3.29Å; Y332-N364 WeakPolarHBondContact CE2-ND2 3.15Å; Y332-N364 PolarHBondContact O-ND2 2.95Å; Y332-I366 HydrophobicContact CE2-CD1 4.21Å; Y332-I366 HydrophobicContact CE2-CG1 4.46Å; Y332-A472 VanDerWaalsContact CE1-O 3.28Å; Y332-A472 WeakPolarHBondContact CE1-O 3.39Å; Y332-A472 PolarHBondContact OH-O 3.03Å; Y332-L473 HydrophobicContact CD1-CD2 3.72Å; Y332-L473 HydrophobicContact CE1-CD2 4.08Å; Y332-G476 WeakPolarHBondContact OH-CA 3.32Å; Y332-G476 PolarHBondContact OH-N 3.31Å; Y332-G476 VanDerWaalsContact OH-N 3.11Å |
| 333 | I | 92.8 | Very high | 86.3 | Confident | 30 Ų | 30 | 67.7 Ų | 67.7 | 15% | 0.154 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -64.3 | -38.1 | 177.2 | -68.1 | 167.3 | 0 | 0 | 0 | 110.7 | P318 P329 I330 G335 I336 L337 L340 L473 | P318-I333 HydrophobicContact CB-CD1 4.35Å; P318-I333 HydrophobicContact CG-CD1 3.86Å; P329-I333 VanDerWaalsContact O-CG1 3.31Å; P329-I333 WeakPolarHBondContact O-CG1 3.38Å; P329-I333 PolarHBondContact O-N 3.05Å; I330-I333 PolarHBondContact O-N 3.06Å; I333-G335 PolarHBondContact O-N 3.26Å; I333-I336 CarbonylContact O-C 3.43Å; I333-I336 VanDerWaalsContact O-CG1 3.25Å; I333-I336 WeakPolarHBondContact O-CG1 3.26Å; I333-I336 PolarHBondContact O-N 3.43Å; I333-I336 VanDerWaalsContact O-N 3.07Å; I333-L337 PolarHBondContact O-N 3.43Å; I333-L340 HydrophobicContact CG2-CD1 4.12Å; I333-L473 HydrophobicContact CG1-CD2 4.26Å |
| 334 | R | 89.4 | Confident | 85.3 | Confident | 208 Ų | 208 | 63.9 Ų | 63.9 | 79% | 0.785 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -58.2 | -36.3 | 174.9 | -173.4 | 178.3 | 176.1 | 177.1 | -0.9 | 112 | I330 V331 Y332 I336 L337 | I330-R334 WeakPolarHBondContact O-CB 3.44Å; I330-R334 PolarHBondContact O-N 3.3Å; V331-R334 WeakPolarHBondContact O-CB 3.28Å; V331-R334 PolarHBondContact O-N 3.4Å; Y332-R334 VanDerWaalsContact C-N 3.32Å; Y332-R334 PolarHBondContact O-N 3.06Å; R334-I336 VanDerWaalsContact C-N 3.31Å; R334-I336 PolarHBondContact O-N 3.37Å; R334-L337 WeakPolarHBondContact O-CB 3.09Å; R334-L337 PolarHBondContact O-N 2.87Å |
| 335 | G | 83.2 | Confident | 83.4 | Confident | 11 Ų | 11 | 62.6 Ų | 62.6 | 11% | 0.113 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -68.5 | -24.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | V331 Y332 I333 C359 N363 N364 | V331-G335 PolarHBondContact O-N 2.94Å; Y332-G335 PolarHBondContact O-N 2.9Å; I333-G335 PolarHBondContact O-N 3.26Å; G335-C359 WeakPolarHBondContact O-CB 3.34Å; G335-N363 WeakPolarHBondContact O-CB 3.42Å; G335-N363 PolarHBondContact O-ND2 3.37Å; G335-N364 WeakPolarHBondContact CA-OD1 3.13Å |
| 336 | I | 90.4 | Very high | 81.8 | Confident | 1 Ų | 1 | 65.2 Ų | 65.2 | 1% | 0.005 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -106.2 | 4 | 178.6 | 60.9 | 170.7 | 0 | 0 | 0 | 113.7 | I333 R334 Q338 A339 L340 C359 L360 A472 | I333-I336 CarbonylContact O-C 3.43Å; I333-I336 VanDerWaalsContact O-CG1 3.25Å; I333-I336 WeakPolarHBondContact O-CG1 3.26Å; I333-I336 PolarHBondContact O-N 3.43Å; I333-I336 VanDerWaalsContact O-N 3.07Å; R334-I336 VanDerWaalsContact C-N 3.31Å; R334-I336 PolarHBondContact O-N 3.37Å; I336-Q338 PolarHBondContact O-N 3.48Å; I336-Q338 VanDerWaalsContact O-N 3.13Å; I336-A339 WeakPolarHBondContact O-CB 3.09Å; I336-A339 PolarHBondContact O-N 3.44Å; I336-L340 HydrophobicContact CD1-CD1 4.42Å; I336-L340 HydrophobicContact CG1-CD1 4.29Å; I336-L340 PolarHBondContact O-N 2.89Å; I336-C359 HydrophobicContact CG2-CB 4.12Å; I336-L360 HydrophobicContact CG2-CD2 3.61Å; I336-L360 HydrophobicContact CG2-CG 4.05Å; I336-A472 HydrophobicContact CD1-CB 3.42Å; I336-A472 VanDerWaalsContact CD1-CB 3.42Å; I336-A472 HydrophobicContact CG2-CB 4.32Å |
| 337 | L | 82.3 | Confident | 80.7 | Confident | 88 Ų | 88 | 58.6 Ų | 58.6 | 46% | 0.461 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -54.7 | -37.1 | -175.1 | -177.8 | 62.7 | 0 | 0 | 0 | 112.9 | I333 R334 A339 L340 L341 | I333-L337 PolarHBondContact O-N 3.43Å; R334-L337 WeakPolarHBondContact O-CB 3.09Å; R334-L337 PolarHBondContact O-N 2.87Å; L337-A339 VanDerWaalsContact C-N 3.35Å; L337-A339 PolarHBondContact O-N 2.63Å; L337-L340 PolarHBondContact O-N 2.87Å; L337-L341 HydrophobicContact CD1-CG 4.5Å; L337-L341 HydrophobicContact CG-CD1 4.33Å; L337-L341 WeakPolarHBondContact O-CG 3.36Å; L337-L341 PolarHBondContact O-N 3.39Å |
| 338 | Q | 68.8 | Low | 79.7 | Confident | 116 Ų | 116 | 53.3 Ų | 53.3 | 54% | 0.542 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -59.8 | -43.8 | 176.1 | -178.9 | 178.9 | -9.5 | 0 | 0 | 112.1 | I336 L341 I342 I355 | I336-Q338 PolarHBondContact O-N 3.48Å; I336-Q338 VanDerWaalsContact O-N 3.13Å; Q338-L341 PolarHBondContact O-N 3.32Å; Q338-I342 HydrophobicContact CG-CD1 4.03Å; Q338-I342 WeakPolarHBondContact O-CD1 3.29Å; Q338-I342 VanDerWaalsContact O-CG1 3.31Å; Q338-I342 WeakPolarHBondContact O-CG1 3.48Å; Q338-I342 PolarHBondContact O-N 3.2Å; Q338-I342 VanDerWaalsContact O-N 3.15Å; Q338-I355 HydrophobicContact CG-CG2 4.34Å |
| 339 | A | 75.2 | Confident | 78.9 | Confident | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -65.9 | -39.1 | 178 | 0 | 0 | 0 | 0 | 0 | 111.6 | I336 L337 I342 A343 I355 T356 | I336-A339 WeakPolarHBondContact O-CB 3.09Å; I336-A339 PolarHBondContact O-N 3.44Å; L337-A339 VanDerWaalsContact C-N 3.35Å; L337-A339 PolarHBondContact O-N 2.63Å; A339-I342 PolarHBondContact O-N 3.12Å; A339-A343 WeakPolarHBondContact O-CB 3.5Å; A339-A343 PolarHBondContact O-N 3.38Å; A339-I355 HydrophobicContact CB-CG2 4.24Å; A339-T356 WeakPolarHBondContact CB-OG1 3.34Å |
| 340 | L | 82.8 | Confident | 77.8 | Confident | 7 Ų | 7 | 52.3 Ų | 52.3 | 4% | 0.037 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -64.2 | -42.5 | 177.3 | -61.9 | 175.8 | 0 | 0 | 0 | 112.5 | I333 I336 L337 I342 A343 L344 M465 V468 M469 | I333-L340 HydrophobicContact CG2-CD1 4.12Å; I336-L340 HydrophobicContact CD1-CD1 4.42Å; I336-L340 HydrophobicContact CG1-CD1 4.29Å; I336-L340 PolarHBondContact O-N 2.89Å; L337-L340 PolarHBondContact O-N 2.87Å; L340-I342 VanDerWaalsContact C-N 3.31Å; L340-I342 PolarHBondContact O-N 3.33Å; L340-A343 PolarHBondContact O-N 3.4Å; L340-L344 WeakPolarHBondContact O-CB 3.34Å; L340-L344 PolarHBondContact O-N 2.91Å; L340-M465 HydrophobicContact CB-CG 4.13Å; L340-M465 HydrophobicContact CD2-CG 4.13Å; L340-V468 HydrophobicContact CD2-CG1 4.26Å; L340-M469 HydrophobicContact CD1-CE 3.44Å; L340-M469 VanDerWaalsContact CD1-CE 3.44Å; L340-M469 HydrophobicContact CD2-CB 3.75Å; L340-M469 HydrophobicContact CD2-CE 4.1Å; L340-M469 HydrophobicContact CD2-CG 4.37Å; L340-M469 HydrophobicContact CG-CE 4.4Å |
| 341 | L | 71.6 | Confident | 76.1 | Confident | 104 Ų | 104 | 48.6 Ų | 48.6 | 55% | 0.545 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -64.1 | -38.2 | 176 | -70.8 | 173.7 | 0 | 0 | 0 | 111.9 | L337 Q338 A345 | L337-L341 HydrophobicContact CD1-CG 4.5Å; L337-L341 HydrophobicContact CG-CD1 4.33Å; L337-L341 WeakPolarHBondContact O-CG 3.36Å; L337-L341 PolarHBondContact O-N 3.39Å; Q338-L341 PolarHBondContact O-N 3.32Å; L341-A345 PolarHBondContact O-N 3.36Å; L341-A345 VanDerWaalsContact O-N 3.13Å |
| 342 | I | 64.7 | Low | 74.9 | Confident | 55 Ų | 55 | 43.9 Ų | 43.9 | 28% | 0.282 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -69 | -41.5 | 175.5 | -66.1 | 164.2 | 0 | 0 | 0 | 110.1 | Q338 A339 L340 L344 A345 T346 T352 I355 | Q338-I342 HydrophobicContact CG-CD1 4.03Å; Q338-I342 WeakPolarHBondContact O-CD1 3.29Å; Q338-I342 VanDerWaalsContact O-CG1 3.31Å; Q338-I342 WeakPolarHBondContact O-CG1 3.48Å; Q338-I342 PolarHBondContact O-N 3.2Å; Q338-I342 VanDerWaalsContact O-N 3.15Å; A339-I342 PolarHBondContact O-N 3.12Å; L340-I342 VanDerWaalsContact C-N 3.31Å; L340-I342 PolarHBondContact O-N 3.33Å; I342-L344 VanDerWaalsContact C-N 3.32Å; I342-L344 PolarHBondContact O-N 3.06Å; I342-A345 WeakPolarHBondContact O-CB 3.48Å; I342-A345 PolarHBondContact O-N 3.16Å; I342-T346 HydrophobicContact CG2-CG2 3.91Å; I342-T346 WeakPolarHBondContact O-CG2 3.43Å; I342-T346 PolarHBondContact O-N 3.23Å; I342-T346 PolarHBondContact O-OG1 3.24Å; I342-T352 HydrophobicContact CG2-CG2 3.98Å; I342-I355 HydrophobicContact CD1-CB 4.36Å; I342-I355 HydrophobicContact CD1-CG1 4.12Å; I342-I355 HydrophobicContact CD1-CG2 3.83Å |
| 343 | A | 73.1 | Confident | 73.8 | Confident | 0 Ų | 0 | 45.2 Ų | 45.2 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -61.9 | -39.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | A339 L340 A345 S347 T352 T464 V468 | A339-A343 WeakPolarHBondContact O-CB 3.5Å; A339-A343 PolarHBondContact O-N 3.38Å; L340-A343 PolarHBondContact O-N 3.4Å; A343-A345 VanDerWaalsContact C-N 3.3Å; A343-A345 PolarHBondContact O-N 2.98Å; A343-S347 WeakPolarHBondContact O-CA 3.09Å; A343-S347 PolarHBondContact O-N 3.08Å; A343-T352 HydrophobicContact CB-CG2 3.6Å; A343-T464 HydrophobicContact CB-CG2 4.08Å; A343-V468 HydrophobicContact CB-CB 4.2Å; A343-V468 HydrophobicContact CB-CG1 4.45Å; A343-V468 HydrophobicContact CB-CG2 3.84Å |
| 344 | L | 75.3 | Confident | 72.2 | Confident | 50 Ų | 50 | 47.7 Ų | 47.7 | 26% | 0.262 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -63.9 | -35.7 | 173 | -170.8 | 76.6 | 0 | 0 | 0 | 112.1 | L340 I342 R461 F462 M465 | L340-L344 WeakPolarHBondContact O-CB 3.34Å; L340-L344 PolarHBondContact O-N 2.91Å; I342-L344 VanDerWaalsContact C-N 3.32Å; I342-L344 PolarHBondContact O-N 3.06Å; L344-R461 HydrophobicContact CD1-CB 3.77Å; L344-R461 HydrophobicContact CG-CB 4.38Å; L344-R461 WeakPolarHBondContact O-CG 3.33Å; L344-R461 PolarHBondContact O-NH1 2.89Å; L344-F462 HydrophobicContact CD1-CD1 3.99Å; L344-F462 HydrophobicContact CD1-CE1 4.09Å; L344-M465 HydrophobicContact CB-SD 4.41Å; L344-M465 HydrophobicContact CD1-CB 4.46Å; L344-M465 HydrophobicContact CD1-SD 4.06Å |
| 345 | A | 55.3 | Low | 71.3 | Confident | 41 Ų | 41 | 40.4 Ų | 40.4 | 34% | 0.339 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -75.7 | -45.7 | 179 | 0 | 0 | 0 | 0 | 0 | 112.2 | L22 L341 I342 A343 R461 | L22-A345 VanDerWaalsContact CD1-O 3.23Å; L22-A345 WeakPolarHBondContact CD1-O 3.45Å; L341-A345 PolarHBondContact O-N 3.36Å; L341-A345 VanDerWaalsContact O-N 3.13Å; I342-A345 WeakPolarHBondContact O-CB 3.48Å; I342-A345 PolarHBondContact O-N 3.16Å; A343-A345 VanDerWaalsContact C-N 3.3Å; A343-A345 PolarHBondContact O-N 2.98Å; A345-R461 PolarHBondContact O-NH1 2.89Å |
| 346 | T | 60.5 | Low | 71.1 | Confident | 58 Ų | 58 | 40 Ų | 40 | 36% | 0.356 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -85.3 | -22.8 | -173.4 | 61.3 | 0 | 0 | 0 | 0 | 114 | I342 S348 | I342-T346 HydrophobicContact CG2-CG2 3.91Å; I342-T346 WeakPolarHBondContact O-CG2 3.43Å; I342-T346 PolarHBondContact O-N 3.23Å; I342-T346 PolarHBondContact O-OG1 3.24Å; T346-S348 PolarHBondContact O-N 3.2Å; T346-S348 PolarHBondContact OG1-N 3.01Å |
| 347 | S | 69.9 | Low | 70.6 | Confident | 7 Ų | 7 | 41.8 Ų | 41.8 | 5% | 0.049 | 24% | 0.242 | C | C | . | . | trans | 53.6 | 31.4 | -170.4 | -54 | 0 | 0 | 0 | 0 | 113.5 | A343 P428 D460 R461 T464 | A343-S347 WeakPolarHBondContact O-CA 3.09Å; A343-S347 PolarHBondContact O-N 3.08Å; S347-P428 VanDerWaalsContact O-CA 3.32Å; S347-P428 WeakPolarHBondContact O-CA 3.37Å; S347-P428 WeakPolarHBondContact O-CG 3.29Å; S347-D460 WeakPolarHBondContact CB-OD2 3.32Å; S347-R461 VanDerWaalsContact OG-CG 3.3Å; S347-R461 WeakPolarHBondContact OG-CG 3.03Å; S347-T464 VanDerWaalsContact C-OG1 3.3Å; S347-T464 PolarHBondContact O-OG1 3.39Å | ||
| 348 | S | 71 | Confident | 69.8 | Low | 11 Ų | 11 | 42.9 Ų | 42.9 | 8% | 0.077 | 24% | 0.243 | C | C | . | . | trans | -139.6 | 116.3 | 178.8 | 172.8 | 0 | 0 | 0 | 0 | 112.3 | T346 A351 T352 G426 T464 | T346-S348 PolarHBondContact O-N 3.2Å; T346-S348 PolarHBondContact OG1-N 3.01Å; S348-A351 PolarHBondContact O-N 3.24Å; S348-A351 WeakPolarHBondContact OG-CB 3.21Å; S348-A351 PolarHBondContact OG-N 2.99Å; S348-A351 VanDerWaalsContact OG-N 3.08Å; S348-T352 WeakPolarHBondContact O-CG2 3.48Å; S348-T352 PolarHBondContact O-N 3.19Å; S348-T352 PolarHBondContact O-OG1 2.94Å; S348-G426 CarbonylContact C-O 3.57Å; S348-G426 WeakPolarHBondContact CA-O 3.45Å; S348-G426 PolarHBondContact OG-O 3.07Å; S348-T464 VanDerWaalsContact N-CG2 3.33Å | ||
| 349 | S | 78.4 | Confident | 70.1 | Confident | 4 Ų | 4 | 37.5 Ų | 37.5 | 3% | 0.028 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -64 | -42.6 | 175.5 | -56.2 | 0 | 0 | 0 | 0 | 110.9 | A351 T352 L353 G426 | S349-A351 PolarHBondContact O-N 2.88Å; S349-T352 PolarHBondContact O-N 2.97Å; S349-T352 VanDerWaalsContact O-N 3.17Å; S349-T352 PolarHBondContact O-OG1 2.88Å; S349-L353 PolarHBondContact O-N 2.88Å; S349-G426 PolarHBondContact N-O 3.48Å; S349-G426 VanDerWaalsContact N-O 3.12Å |
| 350 | S | 69.9 | Low | 70.7 | Confident | 55 Ų | 55 | 37.5 Ų | 37.5 | 39% | 0.385 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -65 | -39.8 | 179.2 | -58.7 | 0 | 0 | 0 | 0 | 112.5 | T352 L353 G426 | S350-T352 PolarHBondContact O-N 3.04Å; S350-L353 WeakPolarHBondContact O-CB 3.42Å; S350-L353 PolarHBondContact O-N 3.46Å; S350-G426 WeakPolarHBondContact CB-O 3.28Å; S350-G426 PolarHBondContact N-O 3.44Å; S350-G426 WeakPolarHBondContact OG-CA 3.36Å; S350-G426 PolarHBondContact OG-O 3.21Å |
| 351 | A | 58.2 | Low | 70.4 | Confident | 60 Ų | 60 | 40.2 Ų | 40.2 | 50% | 0.496 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -67.2 | -26.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | S348 S349 | S348-A351 PolarHBondContact O-N 3.24Å; S348-A351 WeakPolarHBondContact OG-CB 3.21Å; S348-A351 PolarHBondContact OG-N 2.99Å; S348-A351 VanDerWaalsContact OG-N 3.08Å; S349-A351 PolarHBondContact O-N 2.88Å |
| 352 | T | 67 | Low | 70.9 | Confident | 1 Ų | 1 | 40.2 Ų | 40.2 | 1% | 0.006 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -86.7 | -15.3 | -179.6 | 65.7 | 0 | 0 | 0 | 0 | 114.1 | I342 A343 S348 S349 S350 P354 I355 T356 V468 | I342-T352 HydrophobicContact CG2-CG2 3.98Å; A343-T352 HydrophobicContact CB-CG2 3.6Å; S348-T352 WeakPolarHBondContact O-CG2 3.48Å; S348-T352 PolarHBondContact O-N 3.19Å; S348-T352 PolarHBondContact O-OG1 2.94Å; S349-T352 PolarHBondContact O-N 2.97Å; S349-T352 VanDerWaalsContact O-N 3.17Å; S349-T352 PolarHBondContact O-OG1 2.88Å; S350-T352 PolarHBondContact O-N 3.04Å; T352-P354 VanDerWaalsContact C-CD 3.49Å; T352-I355 PolarHBondContact O-N 2.9Å; T352-T356 PolarHBondContact O-N 3.42Å; T352-T356 PolarHBondContact O-OG1 3.42Å; T352-V468 VanDerWaalsContact OG1-CG2 3.31Å; T352-V468 WeakPolarHBondContact OG1-CG2 3.47Å |
| 353 | L | 69.4 | Low | 72 | Confident | 42 Ų | 42 | 41.5 Ų | 41.5 | 22% | 0.22 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -50.9 | -45 | -173.2 | -173.8 | 154.6 | 0 | 0 | 0 | 113.8 | S349 S350 I355 T356 F357 L375 P376 A379 | S349-L353 PolarHBondContact O-N 2.88Å; S350-L353 WeakPolarHBondContact O-CB 3.42Å; S350-L353 PolarHBondContact O-N 3.46Å; L353-I355 VanDerWaalsContact C-N 3.29Å; L353-I355 PolarHBondContact O-N 3.31Å; L353-T356 PolarHBondContact O-N 3.38Å; L353-F357 WeakPolarHBondContact O-CB 3.45Å; L353-F357 PolarHBondContact O-N 3.45Å; L353-L375 HydrophobicContact CG-CB 4.49Å; L353-P376 HydrophobicContact CD1-CB 4.29Å; L353-P376 HydrophobicContact CD1-CG 4.27Å; L353-A379 HydrophobicContact CD1-CB 4.06Å |
| 354 | P | 60.5 | Low | 72.8 | Confident | 83 Ų | 83 | 42.9 Ų | 42.9 | 54% | 0.539 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -63.1 | -33.8 | 178.4 | -23.2 | 34.9 | 0 | 0 | 0 | 113.6 | T352 F357 K358 | T352-P354 VanDerWaalsContact C-CD 3.49Å; P354-F357 WeakPolarHBondContact O-CB 3.37Å; P354-K358 PolarHBondContact O-N 3.2Å; P354-K358 VanDerWaalsContact O-N 3.12Å |
| 355 | I | 69.9 | Low | 73.5 | Confident | 54 Ų | 54 | 47.9 Ų | 47.9 | 28% | 0.277 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -77.1 | -42.7 | 178.7 | -54.1 | -60.2 | 0 | 0 | 0 | 110.4 | Q338 A339 I342 T352 L353 F357 K358 C359 | Q338-I355 HydrophobicContact CG-CG2 4.34Å; A339-I355 HydrophobicContact CB-CG2 4.24Å; I342-I355 HydrophobicContact CD1-CB 4.36Å; I342-I355 HydrophobicContact CD1-CG1 4.12Å; I342-I355 HydrophobicContact CD1-CG2 3.83Å; T352-I355 PolarHBondContact O-N 2.9Å; L353-I355 VanDerWaalsContact C-N 3.29Å; L353-I355 PolarHBondContact O-N 3.31Å; I355-F357 PolarHBondContact O-N 3.09Å; I355-K358 PolarHBondContact O-N 3.45Å; I355-K358 VanDerWaalsContact O-N 3.15Å; I355-C359 PolarHBondContact O-N 3.29Å; I355-C359 PolarHBondContact O-SG 2.89Å; I355-C359 VanDerWaalsContact O-SG 3.39Å |
| 356 | T | 78.1 | Confident | 75.1 | Confident | 4 Ų | 4 | 47 Ų | 47 | 3% | 0.025 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -56.4 | -43 | 172.7 | -52.5 | 0 | 0 | 0 | 0 | 110.7 | A339 T352 L353 K358 C359 L360 L375 V468 A472 | A339-T356 WeakPolarHBondContact CB-OG1 3.34Å; T352-T356 PolarHBondContact O-N 3.42Å; T352-T356 PolarHBondContact O-OG1 3.42Å; L353-T356 PolarHBondContact O-N 3.38Å; T356-K358 PolarHBondContact O-N 2.97Å; T356-C359 PolarHBondContact O-N 2.87Å; T356-L360 HydrophobicContact CG2-CD1 4.13Å; T356-L360 WeakPolarHBondContact O-CB 3.47Å; T356-L360 WeakPolarHBondContact O-CG 3.5Å; T356-L360 PolarHBondContact O-N 2.91Å; T356-L375 HydrophobicContact CG2-CD1 3.94Å; T356-L375 HydrophobicContact CG2-CD2 3.9Å; T356-V468 HydrophobicContact CG2-CG1 4.32Å; T356-A472 HydrophobicContact CG2-CB 4.2Å |
| 357 | F | 80.5 | Confident | 76.3 | Confident | 38 Ų | 38 | 47 Ų | 47 | 17% | 0.167 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -57 | -51.2 | 174.7 | -166.7 | -70.7 | 0 | 0 | 0 | 111.7 | L353 P354 I355 L360 L361 R368 I371 R372 L375 | L353-F357 WeakPolarHBondContact O-CB 3.45Å; L353-F357 PolarHBondContact O-N 3.45Å; P354-F357 WeakPolarHBondContact O-CB 3.37Å; I355-F357 PolarHBondContact O-N 3.09Å; F357-L360 PolarHBondContact O-N 3.28Å; F357-L361 HydrophobicContact CE1-CD2 4.27Å; F357-L361 WeakPolarHBondContact O-CB 3.39Å; F357-L361 PolarHBondContact O-N 3.48Å; F357-R368 HydrophobicContact CE1-CG 4.2Å; F357-R368 HydrophobicContact CZ-CG 3.74Å; F357-I371 HydrophobicContact CB-CG2 4.27Å; F357-I371 HydrophobicContact CD1-CG2 4.28Å; F357-I371 HydrophobicContact CD2-CB 4.24Å; F357-I371 HydrophobicContact CD2-CG2 3.33Å; F357-I371 HydrophobicContact CE1-CG2 4.44Å; F357-I371 HydrophobicContact CE2-CB 3.92Å; F357-I371 HydrophobicContact CE2-CG2 3.52Å; F357-I371 HydrophobicContact CG-CG2 3.72Å; F357-I371 HydrophobicContact CZ-CB 4.2Å; F357-I371 HydrophobicContact CZ-CG2 4.08Å; F357-R372 HydrophobicContact CE2-CB 4.37Å; F357-R372 HydrophobicContact CE2-CG 3.52Å; F357-R372 HydrophobicContact CZ-CG 3.72Å; F357-L375 HydrophobicContact CB-CD1 4.14Å; F357-L375 HydrophobicContact CD2-CD1 4.4Å |
| 358 | K | 65.2 | Low | 76.5 | Confident | 111 Ų | 111 | 53 Ų | 53 | 48% | 0.483 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -60.4 | -48.1 | 179.7 | -174.8 | 179.8 | 177.7 | 178.5 | 0 | 111.7 | P354 I355 T356 L360 L361 E362 | P354-K358 PolarHBondContact O-N 3.2Å; P354-K358 VanDerWaalsContact O-N 3.12Å; I355-K358 PolarHBondContact O-N 3.45Å; I355-K358 VanDerWaalsContact O-N 3.15Å; T356-K358 PolarHBondContact O-N 2.97Å; K358-L360 VanDerWaalsContact C-N 3.32Å; K358-L360 PolarHBondContact O-N 3.49Å; K358-L361 PolarHBondContact O-N 2.92Å; K358-E362 WeakPolarHBondContact CE-OE1 3.21Å; K358-E362 WeakPolarHBondContact CE-OE2 3.4Å; K358-E362 HydrophobicContact CG-CG 4.29Å; K358-E362 IonicContact NZ-OE2 3.81Å; K358-E362 WeakPolarHBondContact O-CB 3.46Å; K358-E362 PolarHBondContact O-N 3.35Å |
| 359 | C | 75.1 | Confident | 76.7 | Confident | 3 Ų | 3 | 57.2 Ų | 57.2 | 2% | 0.02 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -59.2 | -41.9 | 178.3 | -71 | 0 | 0 | 0 | 0 | 112.2 | G335 I336 I355 T356 N363 N364 | G335-C359 WeakPolarHBondContact O-CB 3.34Å; I336-C359 HydrophobicContact CG2-CB 4.12Å; I355-C359 PolarHBondContact O-N 3.29Å; I355-C359 PolarHBondContact O-SG 2.89Å; I355-C359 VanDerWaalsContact O-SG 3.39Å; T356-C359 PolarHBondContact O-N 2.87Å; C359-N363 WeakPolarHBondContact O-CA 3.46Å; C359-N363 WeakPolarHBondContact O-CB 3.24Å; C359-N363 PolarHBondContact O-N 3.1Å; C359-N364 PolarHBondContact O-N 2.83Å |
| 360 | L | 87.6 | Confident | 76.8 | Confident | 0 Ų | 0 | 57.3 Ų | 57.3 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -69.9 | -35.1 | 179.4 | -73.2 | 176.5 | 0 | 0 | 0 | 113.3 | Y332 I336 T356 F357 K358 N364 H365 I366 I371 L375 A472 T475 | Y332-L360 HydrophobicContact CE1-CD2 4.09Å; Y332-L360 HydrophobicContact CE2-CD2 4.48Å; Y332-L360 WeakPolarHBondContact OH-CD2 3.39Å; I336-L360 HydrophobicContact CG2-CD2 3.61Å; I336-L360 HydrophobicContact CG2-CG 4.05Å; T356-L360 HydrophobicContact CG2-CD1 4.13Å; T356-L360 WeakPolarHBondContact O-CB 3.47Å; T356-L360 WeakPolarHBondContact O-CG 3.5Å; T356-L360 PolarHBondContact O-N 2.91Å; F357-L360 PolarHBondContact O-N 3.28Å; K358-L360 VanDerWaalsContact C-N 3.32Å; K358-L360 PolarHBondContact O-N 3.49Å; L360-N364 HydrophobicContact CD2-CB 4.29Å; L360-N364 CarbonylContact O-C 3.48Å; L360-H365 PolarHBondContact O-N 3.36Å; L360-H365 VanDerWaalsContact O-N 3.12Å; L360-I366 PolarHBondContact O-N 2.7Å; L360-I371 HydrophobicContact CB-CD1 3.85Å; L360-I371 HydrophobicContact CB-CG1 4.3Å; L360-I371 HydrophobicContact CD1-CG2 4.43Å; L360-L375 HydrophobicContact CD1-CD1 4.02Å; L360-L375 HydrophobicContact CD1-CD2 3.87Å; L360-L375 HydrophobicContact CD1-CG 4.2Å; L360-A472 HydrophobicContact CD1-CB 4.3Å; L360-A472 HydrophobicContact CD2-CB 4.37Å; L360-T475 HydrophobicContact CD1-CG2 3.98Å |
| 361 | L | 78.3 | Confident | 77.2 | Confident | 64 Ų | 64 | 54.7 Ų | 54.7 | 34% | 0.335 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -74.5 | -49.6 | 178.3 | -175.8 | 68.2 | 0 | 0 | 0 | 111.9 | F357 K358 H365 R368 I371 | F357-L361 HydrophobicContact CE1-CD2 4.27Å; F357-L361 WeakPolarHBondContact O-CB 3.39Å; F357-L361 PolarHBondContact O-N 3.48Å; K358-L361 PolarHBondContact O-N 2.92Å; L361-H365 WeakPolarHBondContact O-CA 3.34Å; L361-H365 PolarHBondContact O-N 3.23Å; L361-R368 HydrophobicContact CD1-CB 4.27Å; L361-I371 HydrophobicContact CB-CD1 3.96Å; L361-I371 HydrophobicContact CD1-CD1 4.31Å |
| 362 | E | 82.1 | Confident | 77.7 | Confident | 104 Ų | 104 | 58.8 Ų | 58.8 | 49% | 0.486 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -86.7 | -41 | -171.3 | -66.6 | 179.1 | -174.1 | 0 | 0 | 112.9 | K358 H365 | K358-E362 WeakPolarHBondContact CE-OE1 3.21Å; K358-E362 WeakPolarHBondContact CE-OE2 3.4Å; K358-E362 HydrophobicContact CG-CG 4.29Å; K358-E362 IonicContact NZ-OE2 3.81Å; K358-E362 WeakPolarHBondContact O-CB 3.46Å; K358-E362 PolarHBondContact O-N 3.35Å; E362-H365 PolarHBondContact O-CE1 3.49Å; E362-H365 PolarHBondContact O-ND1 2.99Å |
| 363 | N | 85.9 | Confident | 78 | Confident | 82 Ų | 82 | 60.4 Ų | 60.4 | 44% | 0.439 | 28% | 0.281 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -93.7 | -38 | -174 | -56.1 | -19.5 | 0 | 0 | 0 | 112.4 | G335 C359 | G335-N363 WeakPolarHBondContact O-CB 3.42Å; G335-N363 PolarHBondContact O-ND2 3.37Å; C359-N363 WeakPolarHBondContact O-CA 3.46Å; C359-N363 WeakPolarHBondContact O-CB 3.24Å; C359-N363 PolarHBondContact O-N 3.1Å |
| 364 | N | 90.1 | Very high | 78.6 | Confident | 28 Ų | 28 | 58.4 Ų | 58.4 | 15% | 0.15 | 27% | 0.27 | C | S | . | . | S | Bend | trans | -103.2 | -2.3 | -177.7 | -69.2 | -4.5 | 0 | 0 | 0 | 113.6 | Y332 G335 C359 L360 I366 | Y332-N364 HydrophobicContact CD2-CB 4.19Å; Y332-N364 VanDerWaalsContact CD2-ND2 3.3Å; Y332-N364 WeakPolarHBondContact CD2-ND2 3.34Å; Y332-N364 HydrophobicContact CE2-CB 3.86Å; Y332-N364 VanDerWaalsContact CE2-ND2 3.29Å; Y332-N364 WeakPolarHBondContact CE2-ND2 3.15Å; Y332-N364 PolarHBondContact O-ND2 2.95Å; G335-N364 WeakPolarHBondContact CA-OD1 3.13Å; C359-N364 PolarHBondContact O-N 2.83Å; L360-N364 HydrophobicContact CD2-CB 4.29Å; L360-N364 CarbonylContact O-C 3.48Å; N364-I366 VanDerWaalsContact C-N 3.3Å; N364-I366 HydrophobicContact CB-CG1 4.22Å; N364-I366 PolarHBondContact O-N 3.48Å |
| 365 | H | 91.2 | Very high | 79.5 | Confident | 156 Ų | 156 | 54.7 Ų | 54.7 | 72% | 0.722 | 25% | 0.246 | S | C | * | . | trans | 51.8 | 42.1 | 175.3 | -53.7 | -55 | 0 | 0 | 0 | 114.5 | L360 L361 E362 | L360-H365 PolarHBondContact O-N 3.36Å; L360-H365 VanDerWaalsContact O-N 3.12Å; L361-H365 WeakPolarHBondContact O-CA 3.34Å; L361-H365 PolarHBondContact O-N 3.23Å; E362-H365 PolarHBondContact O-CE1 3.49Å; E362-H365 PolarHBondContact O-ND1 2.99Å | ||
| 366 | I | 89.2 | Confident | 79.5 | Confident | 22 Ų | 22 | 54.8 Ų | 54.8 | 11% | 0.113 | 25% | 0.25 | C | C | . | . | trans | -82 | 145.1 | 176.1 | -54.8 | -60.2 | 0 | 0 | 0 | 110.8 | Y332 L360 N364 R368 I370 I371 T475 A479 | Y332-I366 HydrophobicContact CE2-CD1 4.21Å; Y332-I366 HydrophobicContact CE2-CG1 4.46Å; L360-I366 PolarHBondContact O-N 2.7Å; N364-I366 VanDerWaalsContact C-N 3.3Å; N364-I366 HydrophobicContact CB-CG1 4.22Å; N364-I366 PolarHBondContact O-N 3.48Å; I366-R368 PolarHBondContact O-N 3.45Å; I366-I370 HydrophobicContact CG2-CB 4.4Å; I366-I371 HydrophobicContact CB-CD1 3.96Å; I366-I371 HydrophobicContact CB-CG1 3.97Å; I366-I371 HydrophobicContact CG2-CD1 4.31Å; I366-I371 HydrophobicContact CG2-CG1 3.78Å; I366-T475 HydrophobicContact CG2-CG2 4.07Å; I366-A479 HydrophobicContact CD1-CB 3.92Å; I366-A479 HydrophobicContact CG2-CB 3.82Å | ||
| 367 | D | 84.3 | Confident | 79.4 | Confident | 59 Ų | 59 | 55.5 Ų | 55.5 | 32% | 0.316 | 26% | 0.255 | S | S | . | . | trans | -61.2 | 128.1 | 177.2 | -172.7 | -57.7 | 0 | 0 | 0 | 111 | R369 I370 I371 | D367-R369 PolarHBondContact O-N 2.96Å; D367-R369 VanDerWaalsContact O-N 3.11Å; D367-R369 WeakPolarHBondContact OD1-CB 3.48Å; D367-R369 WeakPolarHBondContact OD1-CG 3.32Å; D367-R369 PolarHBondContact OD1-N 3.17Å; D367-R369 IonicContact OD1-NE 3.31Å; D367-R369 PolarHBondContact OD1-NE 3.05Å; D367-R369 VanDerWaalsContact OD1-NE 3.1Å; D367-R369 IonicContact OD2-CZ 3.61Å; D367-R369 IonicContact OD2-NE 2.78Å; D367-R369 PolarHBondContact OD2-NE 2.87Å; D367-R369 IonicContact OD2-NH2 3.89Å; D367-R369 PolarHBondContact OD2-NH2 3.29Å; D367-I370 HydrophobicContact CB-CD1 4.3Å; D367-I370 HydrophobicContact CB-CG1 4.27Å; D367-I370 PolarHBondContact O-N 3.31Å; D367-I371 WeakPolarHBondContact O-CG1 3.45Å; D367-I371 PolarHBondContact O-N 3.41Å | ||
| 368 | R | 75 | Confident | 79.4 | Confident | 131 Ų | 131 | 53.7 Ų | 53.7 | 49% | 0.494 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -53.7 | -33.4 | -177.7 | -166.2 | -175.1 | -174.1 | -175.4 | 7.1 | 113.1 | F357 L361 I366 I370 I371 R372 | F357-R368 HydrophobicContact CE1-CG 4.2Å; F357-R368 HydrophobicContact CZ-CG 3.74Å; L361-R368 HydrophobicContact CD1-CB 4.27Å; I366-R368 PolarHBondContact O-N 3.45Å; R368-I370 VanDerWaalsContact C-N 3.34Å; R368-I371 PolarHBondContact O-N 3.16Å; R368-R372 HydrophobicContact CG-CG 4.43Å; R368-R372 VanDerWaalsContact CZ-CZ 3.47Å; R368-R372 WeakPolarHBondContact O-CB 3.35Å; R368-R372 WeakPolarHBondContact O-CG 3.44Å; R368-R372 PolarHBondContact O-N 3.37Å |
| 369 | R | 75.3 | Confident | 79.7 | Confident | 101 Ų | 101 | 48.7 Ų | 48.7 | 38% | 0.381 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -63.6 | -41.4 | 179.4 | -64.3 | 174.2 | -73.9 | -177.4 | -5.6 | 111.1 | D367 F373 E489 | D367-R369 PolarHBondContact O-N 2.96Å; D367-R369 VanDerWaalsContact O-N 3.11Å; D367-R369 WeakPolarHBondContact OD1-CB 3.48Å; D367-R369 WeakPolarHBondContact OD1-CG 3.32Å; D367-R369 PolarHBondContact OD1-N 3.17Å; D367-R369 IonicContact OD1-NE 3.31Å; D367-R369 PolarHBondContact OD1-NE 3.05Å; D367-R369 VanDerWaalsContact OD1-NE 3.1Å; D367-R369 IonicContact OD2-CZ 3.61Å; D367-R369 IonicContact OD2-NE 2.78Å; D367-R369 PolarHBondContact OD2-NE 2.87Å; D367-R369 IonicContact OD2-NH2 3.89Å; D367-R369 PolarHBondContact OD2-NH2 3.29Å; R369-F373 PolarHBondContact O-N 2.83Å; R369-E489 IonicContact NH1-OE2 3.1Å; R369-E489 PolarHBondContact NH1-OE2 3.24Å |
| 370 | I | 81.1 | Confident | 79.6 | Confident | 5 Ų | 5 | 50.6 Ų | 50.6 | 3% | 0.026 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -70.6 | -45.8 | 179.4 | -54.3 | -177.1 | 0 | 0 | 0 | 109.8 | I366 D367 R368 R372 F373 V374 T475 M478 A479 F486 | I366-I370 HydrophobicContact CG2-CB 4.4Å; D367-I370 HydrophobicContact CB-CD1 4.3Å; D367-I370 HydrophobicContact CB-CG1 4.27Å; D367-I370 PolarHBondContact O-N 3.31Å; R368-I370 VanDerWaalsContact C-N 3.34Å; I370-R372 VanDerWaalsContact C-N 3.35Å; I370-R372 PolarHBondContact O-N 2.68Å; I370-F373 PolarHBondContact O-N 2.9Å; I370-F373 VanDerWaalsContact O-N 3.15Å; I370-V374 HydrophobicContact CG2-CG2 3.79Å; I370-V374 WeakPolarHBondContact O-CB 3.27Å; I370-V374 WeakPolarHBondContact O-CG2 3.31Å; I370-V374 PolarHBondContact O-N 3.04Å; I370-T475 HydrophobicContact CG2-CG2 4.22Å; I370-M478 HydrophobicContact CG2-CB 4.12Å; I370-A479 HydrophobicContact CD1-CB 3.89Å; I370-F486 HydrophobicContact CD1-CD2 3.65Å; I370-F486 HydrophobicContact CD1-CE2 3.54Å; I370-F486 HydrophobicContact CD1-CZ 4.38Å; I370-F486 HydrophobicContact CG1-CD2 4.05Å; I370-F486 HydrophobicContact CG1-CE2 3.58Å; I370-F486 HydrophobicContact CG1-CZ 3.93Å |
| 371 | I | 77.1 | Confident | 79.2 | Confident | 0 Ų | 0 | 51 Ų | 51 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -60.8 | -44.3 | 179.6 | -51.9 | 172.6 | 0 | 0 | 0 | 111.2 | F357 L360 L361 I366 D367 R368 F373 L375 T475 | F357-I371 HydrophobicContact CB-CG2 4.27Å; F357-I371 HydrophobicContact CD1-CG2 4.28Å; F357-I371 HydrophobicContact CD2-CB 4.24Å; F357-I371 HydrophobicContact CD2-CG2 3.33Å; F357-I371 HydrophobicContact CE1-CG2 4.44Å; F357-I371 HydrophobicContact CE2-CB 3.92Å; F357-I371 HydrophobicContact CE2-CG2 3.52Å; F357-I371 HydrophobicContact CG-CG2 3.72Å; F357-I371 HydrophobicContact CZ-CB 4.2Å; F357-I371 HydrophobicContact CZ-CG2 4.08Å; L360-I371 HydrophobicContact CB-CD1 3.85Å; L360-I371 HydrophobicContact CB-CG1 4.3Å; L360-I371 HydrophobicContact CD1-CG2 4.43Å; L361-I371 HydrophobicContact CB-CD1 3.96Å; L361-I371 HydrophobicContact CD1-CD1 4.31Å; I366-I371 HydrophobicContact CB-CD1 3.96Å; I366-I371 HydrophobicContact CB-CG1 3.97Å; I366-I371 HydrophobicContact CG2-CD1 4.31Å; I366-I371 HydrophobicContact CG2-CG1 3.78Å; D367-I371 WeakPolarHBondContact O-CG1 3.45Å; D367-I371 PolarHBondContact O-N 3.41Å; R368-I371 PolarHBondContact O-N 3.16Å; I371-F373 PolarHBondContact O-N 3.16Å; I371-L375 HydrophobicContact CG2-CD1 3.44Å; I371-L375 VanDerWaalsContact CG2-CD1 3.44Å; I371-L375 HydrophobicContact CG2-CG 3.89Å; I371-L375 PolarHBondContact O-N 3.24Å; I371-T475 HydrophobicContact CG1-CG2 4.11Å |
| 372 | R | 68.9 | Low | 79.7 | Confident | 146 Ų | 146 | 48 Ų | 48 | 55% | 0.551 | 22% | 0.224 | S | C | * | . | H | α-helix | trans | -62.5 | -25.5 | 178.4 | -81.6 | -179.2 | 162.4 | 178.7 | -12.6 | 113.7 | F357 R368 I370 P376 | F357-R372 HydrophobicContact CE2-CB 4.37Å; F357-R372 HydrophobicContact CE2-CG 3.52Å; F357-R372 HydrophobicContact CZ-CG 3.72Å; R368-R372 HydrophobicContact CG-CG 4.43Å; R368-R372 VanDerWaalsContact CZ-CZ 3.47Å; R368-R372 WeakPolarHBondContact O-CB 3.35Å; R368-R372 WeakPolarHBondContact O-CG 3.44Å; R368-R372 PolarHBondContact O-N 3.37Å; I370-R372 VanDerWaalsContact C-N 3.35Å; I370-R372 PolarHBondContact O-N 2.68Å; R372-P376 WeakPolarHBondContact O-CD 3.16Å; R372-P376 WeakPolarHBondContact O-CG 3.45Å |
| 373 | F | 72.6 | Confident | 80.1 | Confident | 36 Ų | 36 | 43.3 Ų | 43.3 | 16% | 0.158 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -91.3 | -51.2 | 179 | -176.3 | -90.6 | 0 | 0 | 0 | 111.6 | L82 L90 G91 R369 I370 I371 V377 | L82-F373 HydrophobicContact CD2-CZ 4.12Å; L90-F373 HydrophobicContact CD2-CB 4.17Å; L90-F373 HydrophobicContact CD2-CD1 3.58Å; L90-F373 HydrophobicContact CD2-CE1 4.19Å; L90-F373 HydrophobicContact CD2-CG 3.91Å; L90-F373 HydrophobicContact CG-CD1 3.93Å; L90-F373 HydrophobicContact CG-CE1 4.12Å; G91-F373 VanDerWaalsContact CA-CZ 3.49Å; R369-F373 PolarHBondContact O-N 2.83Å; I370-F373 PolarHBondContact O-N 2.9Å; I370-F373 VanDerWaalsContact O-N 3.15Å; I371-F373 PolarHBondContact O-N 3.16Å; F373-V377 WeakPolarHBondContact O-CG2 3.48Å |
| 374 | V | 83.7 | Confident | 80.5 | Confident | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -75.2 | -42.6 | -167.9 | 179.2 | 0 | 0 | 0 | 0 | 112.6 | T94 Y98 I370 G378 A474 T475 M478 | T94-V374 HydrophobicContact CG2-CG1 4Å; T94-V374 HydrophobicContact CG2-CG2 4.29Å; Y98-V374 WeakPolarHBondContact OH-CG1 3.49Å; Y98-V374 PolarHBondContact OH-O 3.48Å; I370-V374 HydrophobicContact CG2-CG2 3.79Å; I370-V374 WeakPolarHBondContact O-CB 3.27Å; I370-V374 WeakPolarHBondContact O-CG2 3.31Å; I370-V374 PolarHBondContact O-N 3.04Å; V374-G378 PolarHBondContact O-N 3.01Å; V374-A474 HydrophobicContact CG1-CB 4.45Å; V374-T475 HydrophobicContact CB-CG2 4.41Å; V374-T475 VanDerWaalsContact CG1-OG1 3.28Å; V374-T475 WeakPolarHBondContact CG1-OG1 3.47Å; V374-M478 HydrophobicContact CG2-CB 4.19Å; V374-M478 HydrophobicContact CG2-CG 4.13Å |
| 375 | L | 78.8 | Confident | 80.7 | Confident | 4 Ų | 4 | 38 Ų | 38 | 2% | 0.021 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -67.9 | -47.8 | -175.4 | -68.4 | -174.8 | 0 | 0 | 0 | 114.1 | L353 T356 F357 L360 I371 V377 G378 A379 D471 T475 | L353-L375 HydrophobicContact CG-CB 4.49Å; T356-L375 HydrophobicContact CG2-CD1 3.94Å; T356-L375 HydrophobicContact CG2-CD2 3.9Å; F357-L375 HydrophobicContact CB-CD1 4.14Å; F357-L375 HydrophobicContact CD2-CD1 4.4Å; L360-L375 HydrophobicContact CD1-CD1 4.02Å; L360-L375 HydrophobicContact CD1-CD2 3.87Å; L360-L375 HydrophobicContact CD1-CG 4.2Å; I371-L375 HydrophobicContact CG2-CD1 3.44Å; I371-L375 VanDerWaalsContact CG2-CD1 3.44Å; I371-L375 HydrophobicContact CG2-CG 3.89Å; I371-L375 PolarHBondContact O-N 3.24Å; L375-V377 VanDerWaalsContact C-N 3.29Å; L375-V377 PolarHBondContact O-N 3.11Å; L375-G378 PolarHBondContact O-N 3.24Å; L375-A379 WeakPolarHBondContact O-CB 3.43Å; L375-A379 PolarHBondContact O-N 3.49Å; L375-D471 HydrophobicContact CD2-CB 3.96Å; L375-T475 WeakPolarHBondContact CD2-OG1 3.21Å |
| 376 | P | 69 | Low | 80.8 | Confident | 56 Ų | 56 | 30.9 Ų | 30.9 | 36% | 0.364 | 14% | 0.141 | S | C | . | . | H | α-helix | trans | -64.9 | -35.3 | -179.6 | -22.6 | 36.3 | 0 | 0 | 0 | 112.8 | L353 R372 T380 | L353-P376 HydrophobicContact CD1-CB 4.29Å; L353-P376 HydrophobicContact CD1-CG 4.27Å; R372-P376 WeakPolarHBondContact O-CD 3.16Å; R372-P376 WeakPolarHBondContact O-CG 3.45Å; P376-T380 PolarHBondContact O-OG1 3.01Å |
| 377 | V | 76.1 | Confident | 81.1 | Confident | 20 Ų | 20 | 29.9 Ų | 29.9 | 12% | 0.121 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -66.9 | -44.8 | 174.2 | 177 | 0 | 0 | 0 | 0 | 110.2 | L82 Y98 F373 L375 T380 I381 | L82-V377 HydrophobicContact CD2-CG1 4.27Å; L82-V377 HydrophobicContact CD2-CG2 4.25Å; Y98-V377 HydrophobicContact CE2-CG1 4.19Å; F373-V377 WeakPolarHBondContact O-CG2 3.48Å; L375-V377 VanDerWaalsContact C-N 3.29Å; L375-V377 PolarHBondContact O-N 3.11Å; V377-T380 PolarHBondContact O-N 3.13Å; V377-I381 HydrophobicContact CG1-CD1 3.66Å; V377-I381 HydrophobicContact CG1-CG1 4.31Å; V377-I381 WeakPolarHBondContact O-CB 3.28Å; V377-I381 WeakPolarHBondContact O-CG1 3.47Å; V377-I381 PolarHBondContact O-N 3.22Å |
| 378 | G | 80.1 | Confident | 81.8 | Confident | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -60.8 | -45.5 | 178 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y98 V374 L375 T380 I381 N382 D471 | Y98-G378 VanDerWaalsContact CE2-CA 3.48Å; Y98-G378 WeakPolarHBondContact OH-CA 3.42Å; V374-G378 PolarHBondContact O-N 3.01Å; L375-G378 PolarHBondContact O-N 3.24Å; G378-T380 PolarHBondContact O-N 3.28Å; G378-I381 PolarHBondContact O-N 2.79Å; G378-N382 WeakPolarHBondContact O-CB 3.39Å; G378-N382 PolarHBondContact O-N 3.01Å; G378-D471 VanDerWaalsContact C-OD2 3.23Å; G378-D471 VanDerWaalsContact CA-OD1 3.25Å; G378-D471 WeakPolarHBondContact CA-OD1 3.4Å |
| 379 | A | 73.2 | Confident | 82.7 | Confident | 6 Ų | 6 | 20.8 Ų | 20.8 | 5% | 0.05 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -59.8 | -16.8 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | L353 L375 M383 D471 | L353-A379 HydrophobicContact CD1-CB 4.06Å; L375-A379 WeakPolarHBondContact O-CB 3.43Å; L375-A379 PolarHBondContact O-N 3.49Å; A379-M383 WeakPolarHBondContact O-CE 3.28Å; A379-D471 PolarHBondContact N-OD2 3.35Å |
| 380 | T | 71.6 | Confident | 83.6 | Confident | 43 Ų | 43 | 16 Ų | 16 | 26% | 0.264 | 8% | 0.079 | S | C | . | . | H | α-helix | trans | -103 | -46.9 | 174.1 | -48.2 | 0 | 0 | 0 | 0 | 111.9 | P376 V377 G378 I422 | P376-T380 PolarHBondContact O-OG1 3.01Å; V377-T380 PolarHBondContact O-N 3.13Å; G378-T380 PolarHBondContact O-N 3.28Å; T380-I422 VanDerWaalsContact O-O 3.12Å |
| 381 | I | 80.5 | Confident | 84.3 | Confident | 8 Ų | 8 | 15.8 Ų | 15.8 | 4% | 0.041 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -90.4 | -40.5 | -168.8 | -60.7 | -175.6 | 0 | 0 | 0 | 112.4 | L79 Y98 V377 G378 M383 I422 | L79-I381 HydrophobicContact CD2-CD1 3.82Å; Y98-I381 HydrophobicContact CD2-CG2 4.41Å; V377-I381 HydrophobicContact CG1-CD1 3.66Å; V377-I381 HydrophobicContact CG1-CG1 4.31Å; V377-I381 WeakPolarHBondContact O-CB 3.28Å; V377-I381 WeakPolarHBondContact O-CG1 3.47Å; V377-I381 PolarHBondContact O-N 3.22Å; G378-I381 PolarHBondContact O-N 2.79Å; I381-M383 PolarHBondContact O-N 3.32Å; I381-I422 HydrophobicContact CB-CG2 4.34Å; I381-I422 HydrophobicContact CG1-CG2 4.17Å; I381-I422 HydrophobicContact CG2-CG1 4.29Å; I381-I422 HydrophobicContact CG2-CG2 4.1Å |
| 382 | N | 87.9 | Confident | 85.3 | Confident | 1 Ų | 1 | 15.8 Ų | 15.8 | 1% | 0.005 | 8% | 0.078 | C | C | . | . | trans | -94.4 | 74 | -165.8 | -175.5 | 47.8 | 0 | 0 | 0 | 111.7 | Y98 T101 G378 D384 D471 | Y98-N382 HydrophobicContact CD1-CB 3.45Å; Y98-N382 VanDerWaalsContact CD1-CB 3.45Å; Y98-N382 WeakPolarHBondContact CD1-OD1 3.29Å; Y98-N382 HydrophobicContact CD2-CB 3.88Å; Y98-N382 HydrophobicContact CE1-CB 3.68Å; Y98-N382 WeakPolarHBondContact CE1-ND2 3.28Å; Y98-N382 HydrophobicContact CE2-CB 4.1Å; Y98-N382 HydrophobicContact CG-CB 3.55Å; T101-N382 PolarHBondContact OG1-OD1 3.35Å; G378-N382 WeakPolarHBondContact O-CB 3.39Å; G378-N382 PolarHBondContact O-N 3.01Å; N382-D384 PolarHBondContact OD1-OD1 3.01Å; N382-D384 VanDerWaalsContact OD1-OD1 3.12Å; N382-D471 VanDerWaalsContact CB-OD1 3.29Å; N382-D471 WeakPolarHBondContact CB-OD1 3.34Å; N382-D471 PolarHBondContact ND2-N 3.08Å; N382-D471 PolarHBondContact ND2-OD1 2.83Å | ||
| 383 | M | 90.8 | Very high | 86.4 | Confident | 5 Ų | 5 | 8.8 Ų | 8.8 | 3% | 0.025 | 5% | 0.052 | C | C | . | . | trans | -106.1 | 55 | -176.2 | -66.4 | -140 | 169.2 | 0 | 0 | 113.2 | A379 I381 G385 T386 A387 S421 A424 A425 N467 | A379-M383 WeakPolarHBondContact O-CE 3.28Å; I381-M383 PolarHBondContact O-N 3.32Å; M383-G385 VanDerWaalsContact C-N 3.33Å; M383-G385 PolarHBondContact O-N 3.39Å; M383-T386 WeakPolarHBondContact O-CA 3.49Å; M383-T386 WeakPolarHBondContact O-CB 3.45Å; M383-T386 PolarHBondContact O-N 2.59Å; M383-A387 PolarHBondContact O-N 3.44Å; M383-S421 WeakPolarHBondContact CB-O 3.45Å; M383-S421 WeakPolarHBondContact CG-O 3.45Å; M383-A424 HydrophobicContact CE-CB 4.41Å; M383-A424 WeakPolarHBondContact CE-O 3.36Å; M383-A424 HydrophobicContact SD-CB 3.41Å; M383-A424 WeakPolarHBondContact SD-CB 3.4Å; M383-A424 VanDerWaalsContact SD-O 3.36Å; M383-A425 VanDerWaalsContact CE-C 3.44Å; M383-N467 VanDerWaalsContact C-OD1 3.3Å | ||
| 384 | D | 95 | Very high | 87.4 | Confident | 0 Ų | 0 | 7.1 Ų | 7.1 | 0% | 0 | 4% | 0.044 | C | C | . | . | H | α-helix | trans | -48.8 | -48.4 | -178.3 | -71.3 | -2.4 | 0 | 0 | 0 | 113.9 | T101 T102 A105 H312 N382 T386 A387 L388 V466 N467 | T101-D384 PolarHBondContact OG1-OD1 3.33Å; T102-D384 WeakPolarHBondContact CA-OD1 3.3Å; T102-D384 WeakPolarHBondContact CB-OD1 3.08Å; T102-D384 PolarHBondContact N-OD1 3.1Å; T102-D384 VanDerWaalsContact N-OD1 3.07Å; T102-D384 PolarHBondContact OG1-OD1 3.31Å; A105-D384 HydrophobicContact CB-CB 3.99Å; A105-D384 WeakPolarHBondContact CB-O 3.14Å; H312-D384 IonicContact CD2-OD2 3.82Å; H312-D384 IonicContact CE1-OD2 3.49Å; H312-D384 WeakPolarHBondContact NE2-CB 3.46Å; H312-D384 IonicContact NE2-OD2 2.9Å; H312-D384 PolarHBondContact NE2-OD2 3.5Å; N382-D384 PolarHBondContact OD1-OD1 3.01Å; N382-D384 VanDerWaalsContact OD1-OD1 3.12Å; D384-T386 VanDerWaalsContact C-N 3.31Å; D384-T386 PolarHBondContact O-N 3.43Å; D384-A387 PolarHBondContact O-N 3.47Å; D384-L388 WeakPolarHBondContact O-CB 3.35Å; D384-L388 PolarHBondContact O-N 3.31Å; D384-V466 HydrophobicContact CB-CG1 4.42Å; D384-N467 PolarHBondContact N-OD1 3.48Å |
| 385 | G | 94.4 | Very high | 87.9 | Confident | 0 Ų | 0 | 7.6 Ų | 7.6 | 0% | 0 | 5% | 0.047 | C | C | . | . | H | α-helix | trans | -68.1 | -31.3 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | L309 M383 Y389 R463 N467 | L309-G385 VanDerWaalsContact CD2-CA 3.41Å; M383-G385 VanDerWaalsContact C-N 3.33Å; M383-G385 PolarHBondContact O-N 3.39Å; G385-Y389 VanDerWaalsContact O-CB 3.26Å; G385-Y389 WeakPolarHBondContact O-CB 2.9Å; G385-Y389 PolarHBondContact O-N 2.84Å; G385-Y389 VanDerWaalsContact O-N 3.17Å; G385-R463 WeakPolarHBondContact O-CG 3.48Å; G385-N467 WeakPolarHBondContact CA-OD1 3.39Å; G385-N467 PolarHBondContact N-OD1 3.01Å |
| 386 | T | 93.1 | Very high | 88.6 | Confident | 6 Ų | 6 | 7.5 Ų | 7.5 | 4% | 0.037 | 5% | 0.046 | C | C | . | . | H | α-helix | trans | -70.2 | -46.8 | 174.2 | -51.3 | 0 | 0 | 0 | 0 | 110.6 | M383 D384 L388 Y389 E390 A424 N467 | M383-T386 WeakPolarHBondContact O-CA 3.49Å; M383-T386 WeakPolarHBondContact O-CB 3.45Å; M383-T386 PolarHBondContact O-N 2.59Å; D384-T386 VanDerWaalsContact C-N 3.31Å; D384-T386 PolarHBondContact O-N 3.43Å; T386-L388 PolarHBondContact O-N 3.42Å; T386-Y389 WeakPolarHBondContact O-CB 3.03Å; T386-Y389 PolarHBondContact O-N 3.1Å; T386-E390 WeakPolarHBondContact O-CB 3.49Å; T386-E390 WeakPolarHBondContact O-CG 3.45Å; T386-E390 PolarHBondContact O-N 2.83Å; T386-A424 HydrophobicContact CG2-CB 4.14Å; T386-N467 PolarHBondContact OG1-ND2 3.33Å |
| 387 | A | 95.5 | Very high | 89.6 | Confident | 0 Ų | 0 | 4.9 Ų | 4.9 | 0% | 0 | 3% | 0.029 | C | C | . | . | H | α-helix | trans | -63.7 | -43.3 | -180 | 0 | 0 | 0 | 0 | 0 | 112.4 | T102 V106 M383 D384 E390 A391 | T102-A387 HydrophobicContact CG2-CB 3.45Å; T102-A387 VanDerWaalsContact CG2-CB 3.45Å; V106-A387 HydrophobicContact CG2-CB 3.47Å; V106-A387 VanDerWaalsContact CG2-CB 3.47Å; M383-A387 PolarHBondContact O-N 3.44Å; D384-A387 PolarHBondContact O-N 3.47Å; A387-E390 PolarHBondContact O-N 3.26Å; A387-A391 PolarHBondContact O-N 2.86Å |
| 388 | L | 97.3 | Very high | 90.2 | Very high | 0 Ų | 0 | 4 Ų | 4 | 0% | 0 | 2% | 0.024 | C | C | . | . | H | α-helix | trans | -59 | -48.7 | 174.6 | -175.7 | 156.4 | 0 | 0 | 0 | 110.9 | A105 V108 G308 L309 H312 D384 T386 E390 A391 V392 | A105-L388 HydrophobicContact CB-CB 4.23Å; A105-L388 WeakPolarHBondContact O-CD1 3.36Å; A105-L388 WeakPolarHBondContact O-CG 3.25Å; V108-L388 HydrophobicContact CB-CD1 4.41Å; V108-L388 HydrophobicContact CG1-CD1 4.14Å; G308-L388 WeakPolarHBondContact O-CD1 3.45Å; L309-L388 HydrophobicContact CD2-CD2 4.29Å; L309-L388 HydrophobicContact CG-CD2 4.31Å; H312-L388 HydrophobicContact CB-CD1 4.13Å; D384-L388 WeakPolarHBondContact O-CB 3.35Å; D384-L388 PolarHBondContact O-N 3.31Å; T386-L388 PolarHBondContact O-N 3.42Å; L388-E390 VanDerWaalsContact C-N 3.34Å; L388-E390 PolarHBondContact O-N 3.5Å; L388-A391 PolarHBondContact O-N 2.82Å; L388-V392 HydrophobicContact CD2-CG2 4.04Å; L388-V392 VanDerWaalsContact O-CG2 3.28Å; L388-V392 WeakPolarHBondContact O-CG2 3.36Å; L388-V392 PolarHBondContact O-N 3.43Å |
| 389 | Y | 95.4 | Very high | 90.6 | Very high | 0 Ų | 0 | 4.9 Ų | 4.9 | 0% | 0 | 3% | 0.028 | C | C | . | . | H | α-helix | trans | -59.1 | -44.3 | 177.1 | 160.2 | -91.1 | 0 | 0 | 0 | 112.1 | Y301 V305 G385 T386 A391 V392 A393 L432 M435 I452 D456 L459 R463 | Y301-Y389 WeakPolarHBondContact OH-CD2 3.36Å; Y301-Y389 WeakPolarHBondContact OH-CE2 3.42Å; V305-Y389 HydrophobicContact CG1-CD2 4.21Å; V305-Y389 HydrophobicContact CG2-CD2 4.39Å; G385-Y389 VanDerWaalsContact O-CB 3.26Å; G385-Y389 WeakPolarHBondContact O-CB 2.9Å; G385-Y389 PolarHBondContact O-N 2.84Å; G385-Y389 VanDerWaalsContact O-N 3.17Å; T386-Y389 WeakPolarHBondContact O-CB 3.03Å; T386-Y389 PolarHBondContact O-N 3.1Å; Y389-A391 PolarHBondContact O-N 2.84Å; Y389-V392 PolarHBondContact O-N 2.85Å; Y389-A393 VanDerWaalsContact O-CB 3.31Å; Y389-A393 WeakPolarHBondContact O-CB 3.28Å; Y389-A393 PolarHBondContact O-N 3.34Å; Y389-L432 VanDerWaalsContact OH-CD2 3.29Å; Y389-L432 WeakPolarHBondContact OH-CD2 3.5Å; Y389-M435 HydrophobicContact CD1-CE 3.58Å; Y389-M435 HydrophobicContact CE1-CE 3.01Å; Y389-I452 VanDerWaalsContact OH-CD1 3.24Å; Y389-I452 WeakPolarHBondContact OH-CD1 3.45Å; Y389-D456 WeakPolarHBondContact CE2-OD1 3.4Å; Y389-D456 PolarHBondContact OH-OD1 3.42Å; Y389-D456 VanDerWaalsContact OH-OD1 3.07Å; Y389-L459 HydrophobicContact CE2-CD1 4.45Å; Y389-R463 VanDerWaalsContact CB-CD 3.49Å; Y389-R463 VanDerWaalsContact CE2-NH1 3.25Å |
| 390 | E | 94.4 | Very high | 91.1 | Very high | 0 Ų | 0 | 5.2 Ų | 5.2 | 0% | 0 | 3% | 0.029 | C | C | . | . | H | α-helix | trans | -58.8 | -46.9 | 179.1 | -81.1 | 174.9 | -175.5 | 0 | 0 | 112.5 | T386 A387 L388 A393 A394 A417 A420 T434 M435 V438 | T386-E390 WeakPolarHBondContact O-CB 3.49Å; T386-E390 WeakPolarHBondContact O-CG 3.45Å; T386-E390 PolarHBondContact O-N 2.83Å; A387-E390 PolarHBondContact O-N 3.26Å; L388-E390 VanDerWaalsContact C-N 3.34Å; L388-E390 PolarHBondContact O-N 3.5Å; E390-A393 PolarHBondContact O-N 2.82Å; E390-A394 WeakPolarHBondContact O-CB 3.27Å; E390-A394 PolarHBondContact O-N 2.97Å; E390-A417 HydrophobicContact CB-CB 3.91Å; E390-A420 WeakPolarHBondContact OE2-CB 3.25Å; E390-T434 WeakPolarHBondContact OE1-CB 3.16Å; E390-T434 PolarHBondContact OE1-OG1 3.36Å; E390-M435 HydrophobicContact CB-CE 4.25Å; E390-M435 HydrophobicContact CG-CE 3.88Å; E390-M435 HydrophobicContact CG-SD 4.39Å; E390-V438 HydrophobicContact CB-CG2 4.14Å; E390-V438 HydrophobicContact CG-CG2 4.36Å |
| 391 | A | 95.8 | Very high | 91.6 | Very high | 0 Ų | 0 | 5.9 Ų | 5.9 | 0% | 0 | 3% | 0.031 | C | C | . | . | H | α-helix | trans | -64.4 | -44.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | V106 I110 A387 L388 Y389 I395 I413 A417 | V106-A391 HydrophobicContact CG1-CB 3.99Å; I110-A391 HydrophobicContact CG1-CB 3.95Å; A387-A391 PolarHBondContact O-N 2.86Å; L388-A391 PolarHBondContact O-N 2.82Å; Y389-A391 PolarHBondContact O-N 2.84Å; A391-I395 WeakPolarHBondContact O-CG1 3.34Å; A391-I395 PolarHBondContact O-N 2.62Å; A391-I413 HydrophobicContact CB-CG2 4.18Å; A391-A417 HydrophobicContact CB-CB 4.41Å |
| 392 | V | 96.4 | Very high | 91.6 | Very high | 0 Ų | 0 | 9.5 Ų | 9.5 | 0% | 0 | 5% | 0.051 | C | C | . | . | H | α-helix | trans | -63.5 | -44.4 | 178.8 | 173.1 | 0 | 0 | 0 | 0 | 111.1 | G109 V113 Y301 T304 V305 L388 Y389 F396 | G109-V392 WeakPolarHBondContact O-CG2 3.31Å; V113-V392 HydrophobicContact CB-CB 4.45Å; V113-V392 HydrophobicContact CB-CG1 4.09Å; V113-V392 HydrophobicContact CB-CG2 4.33Å; V113-V392 HydrophobicContact CG2-CG1 4.14Å; Y301-V392 HydrophobicContact CD2-CG1 4.04Å; Y301-V392 HydrophobicContact CE2-CG1 3.91Å; T304-V392 HydrophobicContact CG2-CG1 3.85Å; V305-V392 HydrophobicContact CG2-CB 4.12Å; V305-V392 HydrophobicContact CG2-CG1 3.58Å; L388-V392 HydrophobicContact CD2-CG2 4.04Å; L388-V392 VanDerWaalsContact O-CG2 3.28Å; L388-V392 WeakPolarHBondContact O-CG2 3.36Å; L388-V392 PolarHBondContact O-N 3.43Å; Y389-V392 PolarHBondContact O-N 2.85Å; V392-F396 VanDerWaalsContact O-CB 3.23Å; V392-F396 WeakPolarHBondContact O-CB 3.37Å; V392-F396 PolarHBondContact O-N 2.87Å |
| 393 | A | 93.8 | Very high | 91.3 | Very high | 0 Ų | 0 | 11.5 Ų | 11.5 | 0% | 0 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -70 | -39.6 | -178.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y301 Y389 E390 I395 F396 I397 M435 I452 | Y301-A393 HydrophobicContact CE2-CB 3.89Å; Y301-A393 WeakPolarHBondContact OH-CB 3.35Å; Y389-A393 VanDerWaalsContact O-CB 3.31Å; Y389-A393 WeakPolarHBondContact O-CB 3.28Å; Y389-A393 PolarHBondContact O-N 3.34Å; E390-A393 PolarHBondContact O-N 2.82Å; A393-I395 VanDerWaalsContact C-N 3.34Å; A393-I395 PolarHBondContact O-N 2.95Å; A393-F396 PolarHBondContact O-N 3.41Å; A393-I397 WeakPolarHBondContact O-CB 3.43Å; A393-I397 VanDerWaalsContact O-CG1 3.31Å; A393-I397 WeakPolarHBondContact O-CG1 3.41Å; A393-I397 PolarHBondContact O-N 3.35Å; A393-M435 HydrophobicContact CB-CE 3.29Å; A393-M435 HydrophobicContact CB-SD 3.78Å; A393-I452 HydrophobicContact CB-CD1 3.86Å |
| 394 | A | 93.1 | Very high | 90.6 | Very high | 0 Ų | 0 | 19.6 Ų | 19.6 | 0% | 0 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -60.7 | -45.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | E390 I397 A398 I413 V438 L439 L444 | E390-A394 WeakPolarHBondContact O-CB 3.27Å; E390-A394 PolarHBondContact O-N 2.97Å; A394-I397 PolarHBondContact O-N 3.19Å; A394-A398 PolarHBondContact O-N 3.02Å; A394-I413 HydrophobicContact CB-CD1 4.17Å; A394-I413 HydrophobicContact CB-CG1 4.31Å; A394-I413 HydrophobicContact CB-CG2 4.06Å; A394-V438 HydrophobicContact CB-CG1 3.8Å; A394-L439 HydrophobicContact CB-CD2 3.96Å; A394-L444 WeakPolarHBondContact O-CD1 3.35Å |
| 395 | I | 93.8 | Very high | 89.9 | Confident | 10 Ų | 10 | 21.3 Ų | 21.3 | 5% | 0.051 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -68.7 | -39.5 | 176.8 | -63.2 | 171.2 | 0 | 0 | 0 | 110.9 | I110 V113 A391 A393 I397 A398 Q399 L405 I413 | I110-I395 HydrophobicContact CB-CD1 4.26Å; I110-I395 HydrophobicContact CG1-CD1 3.91Å; I110-I395 HydrophobicContact CG2-CD1 4.03Å; V113-I395 HydrophobicContact CB-CG2 4.47Å; V113-I395 HydrophobicContact CG1-CB 3.77Å; V113-I395 HydrophobicContact CG1-CD1 3.58Å; V113-I395 HydrophobicContact CG1-CG1 4.25Å; V113-I395 HydrophobicContact CG1-CG2 3.73Å; V113-I395 HydrophobicContact CG2-CB 4.1Å; V113-I395 HydrophobicContact CG2-CG2 3.89Å; A391-I395 WeakPolarHBondContact O-CG1 3.34Å; A391-I395 PolarHBondContact O-N 2.62Å; A393-I395 VanDerWaalsContact C-N 3.34Å; A393-I395 PolarHBondContact O-N 2.95Å; I395-I397 PolarHBondContact O-N 3.35Å; I395-A398 WeakPolarHBondContact O-CB 3.42Å; I395-A398 PolarHBondContact O-N 3.32Å; I395-Q399 HydrophobicContact CG2-CG 4.37Å; I395-Q399 VanDerWaalsContact O-CG 3.27Å; I395-Q399 WeakPolarHBondContact O-CG 3.36Å; I395-Q399 PolarHBondContact O-N 3.15Å; I395-L405 HydrophobicContact CB-CD1 4.31Å; I395-L405 HydrophobicContact CG1-CD1 3.91Å; I395-L405 HydrophobicContact CG2-CD1 4.32Å; I395-I413 HydrophobicContact CG1-CD1 4.05Å |
| 396 | F | 93.3 | Very high | 89.2 | Confident | 2 Ų | 2 | 24.7 Ų | 24.7 | 1% | 0.009 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -60.4 | -45 | 174.9 | 169 | -110.2 | 0 | 0 | 0 | 112.4 | P118 K297 L298 Y301 V392 A393 A398 Q399 V400 I452 | P118-F396 HydrophobicContact CB-CD2 4Å; P118-F396 HydrophobicContact CB-CE2 4.29Å; P118-F396 HydrophobicContact CG-CD2 3.87Å; K297-F396 HydrophobicContact CB-CE2 4.13Å; K297-F396 HydrophobicContact CB-CZ 4.3Å; L298-F396 HydrophobicContact CD1-CE1 4.35Å; Y301-F396 HydrophobicContact CD1-CE1 4.43Å; Y301-F396 HydrophobicContact CD2-CB 3.76Å; Y301-F396 AromaticContact CD2-CD1 3.64Å; Y301-F396 HydrophobicContact CD2-CD1 3.64Å; Y301-F396 HydrophobicContact CD2-CD2 4.23Å; Y301-F396 HydrophobicContact CD2-CE1 4.27Å; Y301-F396 AromaticContact CD2-CG 3.6Å; Y301-F396 HydrophobicContact CD2-CG 3.6Å; Y301-F396 HydrophobicContact CE2-CB 4.25Å; Y301-F396 HydrophobicContact CE2-CD1 4.15Å; Y301-F396 HydrophobicContact CE2-CG 4.35Å; Y301-F396 AromaticContact CG-CD1 3.83Å; Y301-F396 HydrophobicContact CG-CD1 3.83Å; Y301-F396 HydrophobicContact CG-CD2 4.34Å; Y301-F396 AromaticContact CG-CE1 3.98Å; Y301-F396 HydrophobicContact CG-CE1 3.98Å; Y301-F396 HydrophobicContact CG-CE2 4.46Å; Y301-F396 HydrophobicContact CG-CG 4.01Å; Y301-F396 HydrophobicContact CG-CZ 4.28Å; V392-F396 VanDerWaalsContact O-CB 3.23Å; V392-F396 WeakPolarHBondContact O-CB 3.37Å; V392-F396 PolarHBondContact O-N 2.87Å; A393-F396 PolarHBondContact O-N 3.41Å; F396-A398 VanDerWaalsContact C-N 3.3Å; F396-A398 PolarHBondContact O-N 3.16Å; F396-Q399 PolarHBondContact O-N 3.34Å; F396-V400 HydrophobicContact CD1-CG2 4.4Å; F396-V400 HydrophobicContact CD2-CG2 3.87Å; F396-V400 HydrophobicContact CE1-CG2 3.98Å; F396-V400 HydrophobicContact CE2-CG2 3.41Å; F396-V400 VanDerWaalsContact CE2-CG2 3.41Å; F396-V400 HydrophobicContact CG-CG2 4.37Å; F396-V400 HydrophobicContact CZ-CG2 3.47Å; F396-V400 VanDerWaalsContact CZ-CG2 3.47Å; F396-V400 VanDerWaalsContact O-CG2 3.32Å; F396-V400 WeakPolarHBondContact O-CG2 3.38Å; F396-V400 PolarHBondContact O-N 2.88Å; F396-I452 HydrophobicContact CD1-CG2 4.03Å; F396-I452 HydrophobicContact CE1-CG2 3.9Å |
| 397 | I | 89.6 | Confident | 88.5 | Confident | 1 Ų | 1 | 31.3 Ų | 31.3 | 1% | 0.005 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -62.7 | -40.1 | 177 | -73 | 168.7 | 0 | 0 | 0 | 110.4 | A393 A394 I395 V400 N401 L439 D448 I452 | A393-I397 WeakPolarHBondContact O-CB 3.43Å; A393-I397 VanDerWaalsContact O-CG1 3.31Å; A393-I397 WeakPolarHBondContact O-CG1 3.41Å; A393-I397 PolarHBondContact O-N 3.35Å; A394-I397 PolarHBondContact O-N 3.19Å; I395-I397 PolarHBondContact O-N 3.35Å; I397-V400 PolarHBondContact O-N 3.15Å; I397-N401 PolarHBondContact O-N 3.43Å; I397-N401 PolarHBondContact O-ND2 3.02Å; I397-L439 HydrophobicContact CB-CD2 4.39Å; I397-L439 HydrophobicContact CD1-CD1 3.77Å; I397-L439 HydrophobicContact CD1-CD2 4.04Å; I397-L439 HydrophobicContact CG2-CD2 4.35Å; I397-D448 HydrophobicContact CD1-CB 4.41Å; I397-D448 HydrophobicContact CG1-CB 4.32Å; I397-D448 HydrophobicContact CG2-CB 3.79Å; I397-I452 HydrophobicContact CD1-CD1 4.3Å |
| 398 | A | 88.7 | Confident | 87.5 | Confident | 1 Ų | 1 | 31.9 Ų | 31.9 | 1% | 0.008 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -59.6 | -49.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | A394 I395 F396 V400 N401 N402 Y403 L405 L444 | A394-A398 PolarHBondContact O-N 3.02Å; I395-A398 WeakPolarHBondContact O-CB 3.42Å; I395-A398 PolarHBondContact O-N 3.32Å; F396-A398 VanDerWaalsContact C-N 3.3Å; F396-A398 PolarHBondContact O-N 3.16Å; A398-V400 PolarHBondContact O-N 3.2Å; A398-N401 CarbonylContact O-C 3.59Å; A398-N401 PolarHBondContact O-N 3.12Å; A398-N402 PolarHBondContact O-N 3.49Å; A398-N402 VanDerWaalsContact O-N 3.16Å; A398-Y403 PolarHBondContact O-N 2.92Å; A398-L405 HydrophobicContact CB-CD1 3.56Å; A398-L405 HydrophobicContact CB-CD2 3.91Å; A398-L405 HydrophobicContact CB-CG 3.64Å; A398-L444 HydrophobicContact CB-CD1 4.02Å; A398-L444 HydrophobicContact CB-CD2 4.06Å |
| 399 | Q | 89.6 | Confident | 86.6 | Confident | 19 Ų | 19 | 32 Ų | 32 | 9% | 0.089 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -61.1 | -41.5 | 178.5 | -69.2 | 171.2 | -1.8 | 0 | 0 | 112.8 | V113 H117 I395 F396 N401 N402 | V113-Q399 PolarHBondContact O-NE2 3.42Å; H117-Q399 PolarHBondContact CE1-NE2 3.37Å; H117-Q399 PolarHBondContact ND1-NE2 3.33Å; I395-Q399 HydrophobicContact CG2-CG 4.37Å; I395-Q399 VanDerWaalsContact O-CG 3.27Å; I395-Q399 WeakPolarHBondContact O-CG 3.36Å; I395-Q399 PolarHBondContact O-N 3.15Å; F396-Q399 PolarHBondContact O-N 3.34Å; Q399-N401 VanDerWaalsContact C-N 3.26Å; Q399-N401 PolarHBondContact O-N 3.42Å; Q399-N402 PolarHBondContact O-N 3.44Å |
| 400 | V | 83.4 | Confident | 86.2 | Confident | 14 Ų | 14 | 34.3 Ų | 34.3 | 9% | 0.085 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -65.2 | -33 | -179.6 | 170 | 0 | 0 | 0 | 0 | 111.9 | M294 K297 F396 I397 A398 N402 L451 | M294-V400 HydrophobicContact CE-CG1 4.03Å; M294-V400 HydrophobicContact SD-CG1 4.06Å; K297-V400 HydrophobicContact CD-CG2 4.19Å; F396-V400 HydrophobicContact CD1-CG2 4.4Å; F396-V400 HydrophobicContact CD2-CG2 3.87Å; F396-V400 HydrophobicContact CE1-CG2 3.98Å; F396-V400 HydrophobicContact CE2-CG2 3.41Å; F396-V400 VanDerWaalsContact CE2-CG2 3.41Å; F396-V400 HydrophobicContact CG-CG2 4.37Å; F396-V400 HydrophobicContact CZ-CG2 3.47Å; F396-V400 VanDerWaalsContact CZ-CG2 3.47Å; F396-V400 VanDerWaalsContact O-CG2 3.32Å; F396-V400 WeakPolarHBondContact O-CG2 3.38Å; F396-V400 PolarHBondContact O-N 2.88Å; I397-V400 PolarHBondContact O-N 3.15Å; A398-V400 PolarHBondContact O-N 3.2Å; V400-N402 VanDerWaalsContact C-N 3.35Å; V400-L451 HydrophobicContact CG1-CD1 4.5Å |
| 401 | N | 81.6 | Confident | 85.8 | Confident | 56 Ų | 56 | 37.3 Ų | 37.3 | 30% | 0.299 | 19% | 0.185 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -91.6 | 6.7 | 178.6 | -74 | -66.6 | 0 | 0 | 0 | 113.9 | I397 A398 Q399 Y403 D448 | I397-N401 PolarHBondContact O-N 3.43Å; I397-N401 PolarHBondContact O-ND2 3.02Å; A398-N401 CarbonylContact O-C 3.59Å; A398-N401 PolarHBondContact O-N 3.12Å; Q399-N401 VanDerWaalsContact C-N 3.26Å; Q399-N401 PolarHBondContact O-N 3.42Å; N401-Y403 HydrophobicContact CB-CD2 3.33Å; N401-Y403 HydrophobicContact CB-CE2 3.35Å; N401-Y403 HydrophobicContact CB-CG 4.28Å; N401-Y403 PolarHBondContact O-N 3.18Å; N401-D448 PolarHBondContact ND2-OD2 3.25Å; N401-D448 PolarHBondContact OD1-OD2 3.42Å |
| 402 | N | 81.1 | Confident | 85 | Confident | 84 Ų | 84 | 37.4 Ų | 37.4 | 45% | 0.449 | 19% | 0.186 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 56.2 | 33.2 | -175.7 | -47.6 | -43.4 | 0 | 0 | 0 | 113.2 | Q123 A398 Q399 V400 | Q123-N402 PolarHBondContact NE2-ND2 2.76Å; Q123-N402 PolarHBondContact NE2-OD1 3.49Å; Q123-N402 PolarHBondContact OE1-OD1 3.17Å; A398-N402 PolarHBondContact O-N 3.49Å; A398-N402 VanDerWaalsContact O-N 3.16Å; Q399-N402 PolarHBondContact O-N 3.44Å; V400-N402 VanDerWaalsContact C-N 3.35Å |
| 403 | Y | 80.8 | Confident | 84.7 | Confident | 43 Ų | 43 | 37.4 Ų | 37.4 | 17% | 0.169 | 19% | 0.186 | C | C | . | . | P | Polyproline II helix | trans | -82.1 | 119.9 | 169.8 | -70.6 | -57.8 | 0 | 0 | 0 | 109.5 | K132 I134 A398 N401 L405 L444 P445 | K132-Y403 HydrophobicContact CB-CD1 4.42Å; K132-Y403 HydrophobicContact CB-CE1 3.98Å; K132-Y403 HydrophobicContact CD-CE1 3.82Å; I134-Y403 HydrophobicContact CD1-CD1 3.84Å; I134-Y403 HydrophobicContact CD1-CG 4.07Å; I134-Y403 HydrophobicContact CG1-CD1 4.17Å; A398-Y403 PolarHBondContact O-N 2.92Å; N401-Y403 HydrophobicContact CB-CD2 3.33Å; N401-Y403 HydrophobicContact CB-CE2 3.35Å; N401-Y403 HydrophobicContact CB-CG 4.28Å; N401-Y403 PolarHBondContact O-N 3.18Å; Y403-L405 PolarHBondContact O-N 3.13Å; Y403-L444 HydrophobicContact CD2-CD2 3.45Å; Y403-L444 VanDerWaalsContact CD2-CD2 3.45Å; Y403-L444 HydrophobicContact CE2-CD2 4.04Å; Y403-L444 HydrophobicContact CG-CD2 3.95Å; Y403-P445 HydrophobicContact CE2-CG 4.05Å |
| 404 | E | 77.6 | Confident | 84.6 | Confident | 175 Ų | 175 | 37.7 Ų | 37.7 | 82% | 0.818 | 19% | 0.188 | S | C | * | . | P | Polyproline II helix | trans | -76 | 118.9 | 168.2 | -63.9 | -164.8 | 153.8 | 0 | 0 | 109.4 | ||
| 405 | L | 80.3 | Confident | 84.2 | Confident | 36 Ų | 36 | 41.3 Ų | 41.3 | 19% | 0.188 | 21% | 0.207 | C | C | . | . | P | Polyproline II helix | trans | -90.7 | 122.5 | 175.1 | -66.3 | 175.9 | 0 | 0 | 0 | 109.6 | I395 A398 Y403 Q409 I410 I413 | I395-L405 HydrophobicContact CB-CD1 4.31Å; I395-L405 HydrophobicContact CG1-CD1 3.91Å; I395-L405 HydrophobicContact CG2-CD1 4.32Å; A398-L405 HydrophobicContact CB-CD1 3.56Å; A398-L405 HydrophobicContact CB-CD2 3.91Å; A398-L405 HydrophobicContact CB-CG 3.64Å; Y403-L405 PolarHBondContact O-N 3.13Å; L405-Q409 HydrophobicContact CD2-CB 4.21Å; L405-I410 HydrophobicContact CB-CG1 4.28Å; L405-I413 HydrophobicContact CD1-CD1 3.8Å; L405-I413 HydrophobicContact CD2-CD1 4.49Å |
| 406 | D | 78.4 | Confident | 83.7 | Confident | 71 Ų | 71 | 40.9 Ų | 40.9 | 38% | 0.38 | 20% | 0.204 | S | C | . | . | P | Polyproline II helix | trans | -74.3 | 159.1 | 170.1 | -175 | 64.9 | 0 | 0 | 0 | 111.7 | S137 G408 Q409 I410 | S137-D406 WeakPolarHBondContact CB-OD2 3.37Å; S137-D406 PolarHBondContact OG-OD2 3.03Å; D406-G408 PolarHBondContact O-N 3.43Å; D406-G408 PolarHBondContact OD2-N 3.29Å; D406-Q409 WeakPolarHBondContact O-CB 3.27Å; D406-Q409 PolarHBondContact O-N 3.43Å; D406-I410 PolarHBondContact O-N 2.96Å |
| 407 | F | 79.8 | Confident | 83.6 | Confident | 146 Ų | 146 | 40.8 Ų | 40.8 | 64% | 0.64 | 20% | 0.204 | S | C | * | . | H | α-helix | trans | -48.4 | -41.1 | 173.8 | -175.2 | -107.8 | 0 | 0 | 0 | 113.5 | Q409 I410 I411 | F407-Q409 VanDerWaalsContact C-N 3.33Å; F407-Q409 PolarHBondContact O-N 2.93Å; F407-I410 PolarHBondContact O-N 3.17Å; F407-I411 HydrophobicContact CD1-CD1 3.84Å; F407-I411 HydrophobicContact CE1-CD1 3.33Å; F407-I411 HydrophobicContact CE1-CG1 4.28Å; F407-I411 HydrophobicContact CZ-CD1 3.74Å; F407-I411 HydrophobicContact CZ-CG1 4.33Å; F407-I411 PolarHBondContact O-N 2.55Å; F407-I411 VanDerWaalsContact O-N 3.09Å |
| 408 | G | 73.4 | Confident | 83.6 | Confident | 11 Ų | 11 | 41.6 Ų | 41.6 | 11% | 0.113 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -61.8 | -39.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113 | D406 I411 T412 | D406-G408 PolarHBondContact O-N 3.43Å; D406-G408 PolarHBondContact OD2-N 3.29Å; G408-I411 PolarHBondContact O-N 3.48Å; G408-T412 PolarHBondContact O-N 2.84Å; G408-T412 PolarHBondContact O-OG1 3.06Å; G408-T412 VanDerWaalsContact O-OG1 3.13Å |
| 409 | Q | 78.6 | Confident | 83.2 | Confident | 4 Ų | 4 | 42.6 Ų | 42.6 | 2% | 0.019 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -71.2 | -34.4 | 178 | -62.5 | 175.4 | -77.4 | 0 | 0 | 111.9 | A140 L405 D406 F407 I411 T412 I413 V442 | A140-Q409 HydrophobicContact CB-CG 4.29Å; L405-Q409 HydrophobicContact CD2-CB 4.21Å; D406-Q409 WeakPolarHBondContact O-CB 3.27Å; D406-Q409 PolarHBondContact O-N 3.43Å; F407-Q409 VanDerWaalsContact C-N 3.33Å; F407-Q409 PolarHBondContact O-N 2.93Å; Q409-I411 VanDerWaalsContact C-N 3.34Å; Q409-T412 WeakPolarHBondContact O-CB 3.31Å; Q409-T412 PolarHBondContact O-N 3.22Å; Q409-I413 WeakPolarHBondContact O-CG1 3.17Å; Q409-I413 PolarHBondContact O-N 3.16Å; Q409-V442 HydrophobicContact CB-CG1 4.12Å |
| 410 | I | 87.9 | Confident | 82.8 | Confident | 47 Ų | 47 | 41.7 Ų | 41.7 | 24% | 0.241 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -63 | -42.6 | 173.8 | -63.7 | 172.7 | 0 | 0 | 0 | 110.6 | I110 L405 D406 F407 T412 I413 S414 | I110-I410 HydrophobicContact CD1-CG2 4.14Å; I110-I410 HydrophobicContact CG2-CG2 3.82Å; L405-I410 HydrophobicContact CB-CG1 4.28Å; D406-I410 PolarHBondContact O-N 2.96Å; F407-I410 PolarHBondContact O-N 3.17Å; I410-T412 VanDerWaalsContact C-N 3.34Å; I410-I413 PolarHBondContact O-N 3.39Å; I410-S414 WeakPolarHBondContact O-CB 3.27Å; I410-S414 PolarHBondContact O-N 3.26Å |
| 411 | I | 85.1 | Confident | 82.9 | Confident | 64 Ų | 64 | 41 Ų | 41 | 33% | 0.328 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -61.6 | -44.7 | 173.4 | -69.1 | 171.3 | 0 | 0 | 0 | 110.5 | F407 G408 Q409 I413 S414 I415 | F407-I411 HydrophobicContact CD1-CD1 3.84Å; F407-I411 HydrophobicContact CE1-CD1 3.33Å; F407-I411 HydrophobicContact CE1-CG1 4.28Å; F407-I411 HydrophobicContact CZ-CD1 3.74Å; F407-I411 HydrophobicContact CZ-CG1 4.33Å; F407-I411 PolarHBondContact O-N 2.55Å; F407-I411 VanDerWaalsContact O-N 3.09Å; G408-I411 PolarHBondContact O-N 3.48Å; Q409-I411 VanDerWaalsContact C-N 3.34Å; I411-I413 PolarHBondContact O-N 3.21Å; I411-S414 WeakPolarHBondContact O-CB 3.3Å; I411-S414 PolarHBondContact O-N 2.86Å; I411-S414 VanDerWaalsContact O-N 3.1Å; I411-I415 HydrophobicContact CG2-CD1 3.77Å; I411-I415 HydrophobicContact CG2-CG1 4.37Å; I411-I415 WeakPolarHBondContact O-CG1 3.42Å; I411-I415 PolarHBondContact O-N 3.13Å |
| 412 | T | 79.8 | Confident | 82.8 | Confident | 1 Ų | 1 | 39.7 Ų | 39.7 | 1% | 0.006 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -58.3 | -47.7 | 176.5 | -64.2 | 0 | 0 | 0 | 0 | 111.7 | L144 G408 Q409 I410 S414 I415 T416 V442 | L144-T412 HydrophobicContact CD1-CG2 3.76Å; L144-T412 HydrophobicContact CD2-CG2 4.11Å; L144-T412 HydrophobicContact CG-CG2 4.36Å; G408-T412 PolarHBondContact O-N 2.84Å; G408-T412 PolarHBondContact O-OG1 3.06Å; G408-T412 VanDerWaalsContact O-OG1 3.13Å; Q409-T412 WeakPolarHBondContact O-CB 3.31Å; Q409-T412 PolarHBondContact O-N 3.22Å; I410-T412 VanDerWaalsContact C-N 3.34Å; T412-S414 VanDerWaalsContact C-N 3.26Å; T412-S414 PolarHBondContact O-N 3.27Å; T412-I415 PolarHBondContact O-N 2.75Å; T412-T416 HydrophobicContact CG2-CG2 4.03Å; T412-T416 VanDerWaalsContact O-CB 3.28Å; T412-T416 WeakPolarHBondContact O-CB 3.39Å; T412-T416 WeakPolarHBondContact O-CG2 3.39Å; T412-T416 PolarHBondContact O-N 3.45Å; T412-T416 PolarHBondContact O-OG1 2.71Å; T412-V442 HydrophobicContact CG2-CG1 3.65Å |
| 413 | I | 89.4 | Confident | 82.1 | Confident | 0 Ų | 0 | 35.8 Ų | 35.8 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -56.8 | -43.3 | 174.1 | -70.6 | 165.7 | 0 | 0 | 0 | 110 | A391 A394 I395 L405 Q409 I410 I411 T416 A417 V438 V442 | A391-I413 HydrophobicContact CB-CG2 4.18Å; A394-I413 HydrophobicContact CB-CD1 4.17Å; A394-I413 HydrophobicContact CB-CG1 4.31Å; A394-I413 HydrophobicContact CB-CG2 4.06Å; I395-I413 HydrophobicContact CG1-CD1 4.05Å; L405-I413 HydrophobicContact CD1-CD1 3.8Å; L405-I413 HydrophobicContact CD2-CD1 4.49Å; Q409-I413 WeakPolarHBondContact O-CG1 3.17Å; Q409-I413 PolarHBondContact O-N 3.16Å; I410-I413 PolarHBondContact O-N 3.39Å; I411-I413 PolarHBondContact O-N 3.21Å; I413-T416 WeakPolarHBondContact CA-OG1 3.48Å; I413-T416 PolarHBondContact O-OG1 2.89Å; I413-A417 WeakPolarHBondContact O-CB 3.43Å; I413-A417 PolarHBondContact O-N 3.15Å; I413-V438 HydrophobicContact CG1-CG1 4.48Å; I413-V438 HydrophobicContact CG2-CG1 4.03Å; I413-V442 HydrophobicContact CD1-CG1 4.28Å; I413-V442 HydrophobicContact CD1-CG2 4.29Å; I413-V442 HydrophobicContact CG1-CB 4.48Å; I413-V442 HydrophobicContact CG1-CG1 3.67Å; I413-V442 HydrophobicContact CG1-CG2 4.07Å |
| 414 | S | 91.9 | Very high | 81.6 | Confident | 7 Ų | 7 | 33.9 Ų | 33.9 | 5% | 0.049 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -62.3 | -48 | -178.7 | -176.1 | 0 | 0 | 0 | 0 | 112.9 | V106 I410 I411 T412 T418 | V106-S414 WeakPolarHBondContact CG1-OG 3.05Å; I410-S414 WeakPolarHBondContact O-CB 3.27Å; I410-S414 PolarHBondContact O-N 3.26Å; I411-S414 WeakPolarHBondContact O-CB 3.3Å; I411-S414 PolarHBondContact O-N 2.86Å; I411-S414 VanDerWaalsContact O-N 3.1Å; T412-S414 VanDerWaalsContact C-N 3.26Å; T412-S414 PolarHBondContact O-N 3.27Å; S414-T418 PolarHBondContact O-N 3.34Å; S414-T418 PolarHBondContact O-OG1 3.35Å |
| 415 | I | 85.3 | Confident | 80.9 | Confident | 76 Ų | 76 | 26.1 Ų | 26.1 | 39% | 0.39 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -69.2 | -44.4 | -178.9 | -65.9 | 171.3 | 0 | 0 | 0 | 110.1 | L144 I411 T412 T418 A419 | L144-I415 HydrophobicContact CD2-CD1 4.47Å; I411-I415 HydrophobicContact CG2-CD1 3.77Å; I411-I415 HydrophobicContact CG2-CG1 4.37Å; I411-I415 WeakPolarHBondContact O-CG1 3.42Å; I411-I415 PolarHBondContact O-N 3.13Å; T412-I415 PolarHBondContact O-N 2.75Å; I415-T418 PolarHBondContact O-N 3.3Å; I415-A419 WeakPolarHBondContact O-CB 3.45Å; I415-A419 PolarHBondContact O-N 2.67Å |
| 416 | T | 82.8 | Confident | 80 | Confident | 1 Ų | 1 | 24.7 Ų | 24.7 | 1% | 0.006 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -70.6 | -38.5 | -176.2 | 57.2 | 0 | 0 | 0 | 0 | 112 | L144 L228 T412 I413 A419 A420 S441 | L144-T416 HydrophobicContact CD1-CG2 3.77Å; L228-T416 HydrophobicContact CD1-CG2 4.49Å; L228-T416 HydrophobicContact CD2-CG2 4.41Å; T412-T416 HydrophobicContact CG2-CG2 4.03Å; T412-T416 VanDerWaalsContact O-CB 3.28Å; T412-T416 WeakPolarHBondContact O-CB 3.39Å; T412-T416 WeakPolarHBondContact O-CG2 3.39Å; T412-T416 PolarHBondContact O-N 3.45Å; T412-T416 PolarHBondContact O-OG1 2.71Å; I413-T416 WeakPolarHBondContact CA-OG1 3.48Å; I413-T416 PolarHBondContact O-OG1 2.89Å; T416-A419 PolarHBondContact O-N 3.41Å; T416-A420 WeakPolarHBondContact O-CB 2.75Å; T416-A420 PolarHBondContact O-N 2.83Å; T416-S441 PolarHBondContact OG1-OG 2.91Å |
| 417 | A | 91.2 | Very high | 79.2 | Confident | 0 Ų | 0 | 22.9 Ų | 22.9 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -63.2 | -41.4 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | V106 E390 A391 I413 A419 A420 S421 V438 | V106-A417 HydrophobicContact CG2-CB 4.19Å; E390-A417 HydrophobicContact CB-CB 3.91Å; A391-A417 HydrophobicContact CB-CB 4.41Å; I413-A417 WeakPolarHBondContact O-CB 3.43Å; I413-A417 PolarHBondContact O-N 3.15Å; A417-A419 VanDerWaalsContact C-N 3.34Å; A417-A419 PolarHBondContact O-N 2.79Å; A417-A420 PolarHBondContact O-N 2.64Å; A417-S421 WeakPolarHBondContact O-CB 3.44Å; A417-S421 PolarHBondContact O-N 3.45Å; A417-S421 PolarHBondContact O-OG 3.42Å; A417-V438 HydrophobicContact CB-CG1 4.46Å; A417-V438 HydrophobicContact CB-CG2 4.14Å |
| 418 | T | 89.6 | Confident | 78.3 | Confident | 18 Ų | 18 | 17.4 Ų | 17.4 | 11% | 0.11 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -63.3 | -40 | 175.5 | -53.9 | 0 | 0 | 0 | 0 | 111.7 | T102 S414 I415 S421 I422 | T102-T418 HydrophobicContact CG2-CG2 4.03Å; S414-T418 PolarHBondContact O-N 3.34Å; S414-T418 PolarHBondContact O-OG1 3.35Å; I415-T418 PolarHBondContact O-N 3.3Å; T418-S421 PolarHBondContact O-OG 3.49Å; T418-I422 WeakPolarHBondContact O-CG1 3.45Å |
| 419 | A | 80.1 | Confident | 78 | Confident | 21 Ų | 21 | 17.9 Ų | 17.9 | 17% | 0.174 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -74.3 | -41.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | L228 I415 T416 A417 S421 I422 | L228-A419 HydrophobicContact CD1-CB 4.48Å; I415-A419 WeakPolarHBondContact O-CB 3.45Å; I415-A419 PolarHBondContact O-N 2.67Å; T416-A419 PolarHBondContact O-N 3.41Å; A417-A419 VanDerWaalsContact C-N 3.34Å; A417-A419 PolarHBondContact O-N 2.79Å; A419-S421 VanDerWaalsContact C-N 3.34Å; A419-I422 PolarHBondContact O-N 2.97Å |
| 420 | A | 80.4 | Confident | 77.3 | Confident | 0 Ų | 0 | 18.3 Ų | 18.3 | 0% | 0 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -65.5 | -37.6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | E390 T416 A417 I422 G423 A424 T434 I437 V438 | E390-A420 WeakPolarHBondContact OE2-CB 3.25Å; T416-A420 WeakPolarHBondContact O-CB 2.75Å; T416-A420 PolarHBondContact O-N 2.83Å; A417-A420 PolarHBondContact O-N 2.64Å; A420-I422 VanDerWaalsContact C-N 3.26Å; A420-I422 PolarHBondContact O-N 3.47Å; A420-G423 WeakPolarHBondContact O-CA 3.47Å; A420-G423 PolarHBondContact O-N 3.15Å; A420-A424 PolarHBondContact O-N 3.27Å; A420-T434 WeakPolarHBondContact O-CG2 3.49Å; A420-I437 HydrophobicContact CB-CB 4.16Å; A420-I437 HydrophobicContact CB-CD1 3.95Å; A420-I437 HydrophobicContact CB-CG2 4.2Å; A420-V438 HydrophobicContact CB-CG2 3.99Å |
| 421 | S | 85.9 | Confident | 76.5 | Confident | 0 Ų | 0 | 16.2 Ų | 16.2 | 0% | 0 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -63 | -28.6 | 177.9 | 72 | 0 | 0 | 0 | 0 | 113.6 | T102 M383 A417 T418 A419 G423 A424 | T102-S421 WeakPolarHBondContact CG2-OG 3.45Å; M383-S421 WeakPolarHBondContact CB-O 3.45Å; M383-S421 WeakPolarHBondContact CG-O 3.45Å; A417-S421 WeakPolarHBondContact O-CB 3.44Å; A417-S421 PolarHBondContact O-N 3.45Å; A417-S421 PolarHBondContact O-OG 3.42Å; T418-S421 PolarHBondContact O-OG 3.49Å; A419-S421 VanDerWaalsContact C-N 3.34Å; S421-G423 VanDerWaalsContact C-N 3.27Å; S421-G423 PolarHBondContact O-N 3.13Å; S421-A424 PolarHBondContact O-N 3.28Å |
| 422 | I | 80.4 | Confident | 75.9 | Confident | 29 Ų | 29 | 13.5 Ų | 13.5 | 15% | 0.149 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -68.6 | -30.3 | 174.8 | -57.1 | 169.5 | 0 | 0 | 0 | 111 | L75 L99 T380 I381 T418 A419 A420 | L75-I422 HydrophobicContact CD2-CB 4.4Å; L75-I422 HydrophobicContact CD2-CG2 3.62Å; L99-I422 HydrophobicContact CD2-CD1 3.64Å; T380-I422 VanDerWaalsContact O-O 3.12Å; I381-I422 HydrophobicContact CB-CG2 4.34Å; I381-I422 HydrophobicContact CG1-CG2 4.17Å; I381-I422 HydrophobicContact CG2-CG1 4.29Å; I381-I422 HydrophobicContact CG2-CG2 4.1Å; T418-I422 WeakPolarHBondContact O-CG1 3.45Å; A419-I422 PolarHBondContact O-N 2.97Å; A420-I422 VanDerWaalsContact C-N 3.26Å; A420-I422 PolarHBondContact O-N 3.47Å |
| 423 | G | 64.7 | Low | 75.2 | Confident | 2 Ų | 2 | 14.7 Ų | 14.7 | 2% | 0.021 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -86.1 | -6.8 | 178 | 0 | 0 | 0 | 0 | 0 | 113.9 | A420 S421 | A420-G423 WeakPolarHBondContact O-CA 3.47Å; A420-G423 PolarHBondContact O-N 3.15Å; S421-G423 VanDerWaalsContact C-N 3.27Å; S421-G423 PolarHBondContact O-N 3.13Å |
| 424 | A | 70.3 | Confident | 74.8 | Confident | 2 Ų | 2 | 14.9 Ų | 14.9 | 2% | 0.017 | 9% | 0.09 | C | C | . | . | S | Bend | trans | -74.8 | 127.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | M383 T386 A420 S421 A430 T434 | M383-A424 HydrophobicContact CE-CB 4.41Å; M383-A424 WeakPolarHBondContact CE-O 3.36Å; M383-A424 HydrophobicContact SD-CB 3.41Å; M383-A424 WeakPolarHBondContact SD-CB 3.4Å; M383-A424 VanDerWaalsContact SD-O 3.36Å; T386-A424 HydrophobicContact CG2-CB 4.14Å; A420-A424 PolarHBondContact O-N 3.27Å; S421-A424 PolarHBondContact O-N 3.28Å; A424-A430 HydrophobicContact CB-CB 4.31Å; A424-T434 HydrophobicContact CB-CG2 3.83Å |
| 425 | A | 63.2 | Low | 74.4 | Confident | 13 Ų | 13 | 14.5 Ų | 14.5 | 11% | 0.107 | 9% | 0.088 | C | C | . | . | trans | -75.8 | 148.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | L70 L263 M383 I427 A430 | L70-A425 HydrophobicContact CD1-CB 4.33Å; L70-A425 HydrophobicContact CD2-CB 3.99Å; L263-A425 HydrophobicContact CD2-CB 4.23Å; M383-A425 VanDerWaalsContact CE-C 3.44Å; A425-I427 HydrophobicContact CB-CD1 3.98Å; A425-I427 HydrophobicContact CB-CG1 3.86Å; A425-I427 PolarHBondContact O-N 3.05Å; A425-A430 WeakPolarHBondContact O-CB 3.1Å | ||
| 426 | G | 62.7 | Low | 73.8 | Confident | 6 Ų | 6 | 11.9 Ų | 11.9 | 6% | 0.062 | 8% | 0.075 | C | C | . | . | S | Bend | trans | -70.5 | 38.1 | -179.5 | 0 | 0 | 0 | 0 | 0 | 115 | S348 S349 S350 | S348-G426 CarbonylContact C-O 3.57Å; S348-G426 WeakPolarHBondContact CA-O 3.45Å; S348-G426 PolarHBondContact OG-O 3.07Å; S349-G426 PolarHBondContact N-O 3.48Å; S349-G426 VanDerWaalsContact N-O 3.12Å; S350-G426 WeakPolarHBondContact CB-O 3.28Å; S350-G426 PolarHBondContact N-O 3.44Å; S350-G426 WeakPolarHBondContact OG-CA 3.36Å; S350-G426 PolarHBondContact OG-O 3.21Å |
| 427 | I | 61.8 | Low | 73.3 | Confident | 32 Ų | 32 | 12 Ų | 12 | 16% | 0.164 | 8% | 0.076 | C | C | . | . | S | Bend | trans | -117.5 | 159.2 | -176 | 63.1 | 179.9 | 0 | 0 | 0 | 109.9 | L263 V266 A425 Q429 A430 | L263-I427 HydrophobicContact CD2-CD1 4.03Å; L263-I427 HydrophobicContact CD2-CG2 4.13Å; V266-I427 HydrophobicContact CB-CD1 4.14Å; V266-I427 HydrophobicContact CG1-CD1 3.47Å; V266-I427 VanDerWaalsContact CG1-CD1 3.47Å; V266-I427 HydrophobicContact CG2-CD1 4.26Å; A425-I427 HydrophobicContact CB-CD1 3.98Å; A425-I427 HydrophobicContact CB-CG1 3.86Å; A425-I427 PolarHBondContact O-N 3.05Å; I427-Q429 PolarHBondContact O-N 3.45Å; I427-A430 HydrophobicContact CG1-CB 3.99Å; I427-A430 PolarHBondContact O-N 3.5Å |
| 428 | P | 59.8 | Low | 73 | Confident | 31 Ų | 31 | 12 Ų | 12 | 20% | 0.201 | 8% | 0.076 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -57.9 | 141.5 | -178.8 | -22.2 | 34.5 | 0 | 0 | 0 | 111.2 | S347 A430 D460 | S347-P428 VanDerWaalsContact O-CA 3.32Å; S347-P428 WeakPolarHBondContact O-CA 3.37Å; S347-P428 WeakPolarHBondContact O-CG 3.29Å; P428-A430 PolarHBondContact O-N 3.45Å; P428-A430 VanDerWaalsContact O-N 3.1Å; P428-D460 WeakPolarHBondContact CA-OD2 3.36Å |
| 429 | Q | 66.5 | Low | 72.6 | Confident | 22 Ų | 22 | 11.2 Ų | 11.2 | 10% | 0.103 | 7% | 0.071 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 62.5 | 9.9 | 175.2 | -66.2 | 152.2 | -0.9 | 0 | 0 | 116.7 | F273 I427 G431 L432 D460 | F273-Q429 VanDerWaalsContact CE1-CD 3.48Å; F273-Q429 HydrophobicContact CE2-CG 4.41Å; F273-Q429 HydrophobicContact CZ-CG 4.2Å; I427-Q429 PolarHBondContact O-N 3.45Å; Q429-G431 PolarHBondContact O-N 3.29Å; Q429-G431 VanDerWaalsContact O-N 3.15Å; Q429-L432 HydrophobicContact CB-CD1 4.24Å; Q429-L432 HydrophobicContact CG-CD1 4.27Å; Q429-L432 PolarHBondContact O-N 3.21Å; Q429-L432 VanDerWaalsContact O-N 3.12Å; Q429-D460 PolarHBondContact N-OD2 2.85Å |
| 430 | A | 64.7 | Low | 72 | Confident | 13 Ų | 13 | 11.3 Ų | 11.3 | 11% | 0.107 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -55.8 | -32.6 | 174 | 0 | 0 | 0 | 0 | 0 | 112.5 | A424 A425 I427 P428 L432 V433 T434 | A424-A430 HydrophobicContact CB-CB 4.31Å; A425-A430 WeakPolarHBondContact O-CB 3.1Å; I427-A430 HydrophobicContact CG1-CB 3.99Å; I427-A430 PolarHBondContact O-N 3.5Å; P428-A430 PolarHBondContact O-N 3.45Å; P428-A430 VanDerWaalsContact O-N 3.1Å; A430-L432 VanDerWaalsContact C-N 3.28Å; A430-L432 PolarHBondContact O-N 3.25Å; A430-V433 VanDerWaalsContact O-CB 3.3Å; A430-V433 WeakPolarHBondContact O-CB 3.47Å; A430-V433 PolarHBondContact O-N 3.31Å; A430-V433 VanDerWaalsContact O-N 3.1Å; A430-T434 PolarHBondContact O-N 3.03Å; A430-T434 PolarHBondContact O-OG1 3.2Å |
| 431 | G | 71.1 | Confident | 71.4 | Confident | 2 Ų | 2 | 12.7 Ų | 12.7 | 2% | 0.021 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -62.7 | -25.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | Q429 V433 T434 M435 | Q429-G431 PolarHBondContact O-N 3.29Å; Q429-G431 VanDerWaalsContact O-N 3.15Å; G431-V433 VanDerWaalsContact C-N 3.3Å; G431-T434 WeakPolarHBondContact CA-OG1 3.4Å; G431-T434 PolarHBondContact O-OG1 3.35Å; G431-M435 WeakPolarHBondContact O-CB 3.47Å; G431-M435 PolarHBondContact O-N 3.17Å |
| 432 | L | 72.2 | Confident | 70.8 | Confident | 8 Ų | 8 | 13.1 Ų | 13.1 | 4% | 0.042 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -72.5 | -30.6 | 175.6 | -72.4 | 170.3 | 0 | 0 | 0 | 112 | Y389 Q429 A430 M435 I449 I452 I453 D456 | Y389-L432 VanDerWaalsContact OH-CD2 3.29Å; Y389-L432 WeakPolarHBondContact OH-CD2 3.5Å; Q429-L432 HydrophobicContact CB-CD1 4.24Å; Q429-L432 HydrophobicContact CG-CD1 4.27Å; Q429-L432 PolarHBondContact O-N 3.21Å; Q429-L432 VanDerWaalsContact O-N 3.12Å; A430-L432 VanDerWaalsContact C-N 3.28Å; A430-L432 PolarHBondContact O-N 3.25Å; L432-M435 WeakPolarHBondContact O-CB 3.38Å; L432-I449 HydrophobicContact CD2-CG2 3.89Å; L432-I452 HydrophobicContact CD2-CG1 4.46Å; L432-I453 HydrophobicContact CD1-CG1 3.87Å; L432-I453 HydrophobicContact CD2-CG1 3.9Å; L432-D456 HydrophobicContact CD1-CB 4.27Å; L432-D456 WeakPolarHBondContact CD1-OD2 3.26Å; L432-D456 HydrophobicContact CD2-CB 4.12Å; L432-D456 HydrophobicContact CG-CB 4.41Å; L432-D456 VanDerWaalsContact CG-OD2 3.32Å; L432-D456 WeakPolarHBondContact CG-OD2 3.36Å |
| 433 | V | 65.6 | Low | 70.1 | Confident | 25 Ų | 25 | 13.9 Ų | 13.9 | 15% | 0.152 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -72.2 | -45.7 | 179.9 | 179.2 | 0 | 0 | 0 | 0 | 109.9 | L63 I67 A430 G431 M435 V436 | L63-V433 HydrophobicContact CB-CG2 4.32Å; I67-V433 HydrophobicContact CB-CG1 3.99Å; I67-V433 HydrophobicContact CD1-CG1 3.36Å; I67-V433 HydrophobicContact CG1-CG1 3.22Å; I67-V433 HydrophobicContact CG2-CG1 4Å; A430-V433 VanDerWaalsContact O-CB 3.3Å; A430-V433 WeakPolarHBondContact O-CB 3.47Å; A430-V433 PolarHBondContact O-N 3.31Å; A430-V433 VanDerWaalsContact O-N 3.1Å; G431-V433 VanDerWaalsContact C-N 3.3Å; V433-M435 VanDerWaalsContact C-N 3.34Å; V433-V436 WeakPolarHBondContact O-CB 3.42Å; V433-V436 PolarHBondContact O-N 2.95Å |
| 434 | T | 80 | Confident | 70.7 | Confident | 4 Ų | 4 | 14.1 Ų | 14.1 | 3% | 0.025 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -74.4 | -22.8 | 178.7 | 48.2 | 0 | 0 | 0 | 0 | 112.9 | E390 A420 A424 A430 G431 V436 I437 | E390-T434 WeakPolarHBondContact OE1-CB 3.16Å; E390-T434 PolarHBondContact OE1-OG1 3.36Å; A420-T434 WeakPolarHBondContact O-CG2 3.49Å; A424-T434 HydrophobicContact CB-CG2 3.83Å; A430-T434 PolarHBondContact O-N 3.03Å; A430-T434 PolarHBondContact O-OG1 3.2Å; G431-T434 WeakPolarHBondContact CA-OG1 3.4Å; G431-T434 PolarHBondContact O-OG1 3.35Å; T434-V436 PolarHBondContact O-N 3.18Å; T434-I437 HydrophobicContact CG2-CD1 4.05Å; T434-I437 WeakPolarHBondContact O-CB 3.3Å; T434-I437 VanDerWaalsContact O-CG1 3.3Å; T434-I437 WeakPolarHBondContact O-CG1 3.24Å; T434-I437 PolarHBondContact O-N 3.34Å |
| 435 | M | 84.6 | Confident | 70.9 | Confident | 0 Ų | 0 | 15.9 Ų | 15.9 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -53.9 | -37.5 | 169.4 | -172.7 | 63.7 | 63.6 | 0 | 0 | 113.5 | Y389 E390 A393 G431 L432 V433 I437 V438 L439 I449 I452 | Y389-M435 HydrophobicContact CD1-CE 3.58Å; Y389-M435 HydrophobicContact CE1-CE 3.01Å; E390-M435 HydrophobicContact CB-CE 4.25Å; E390-M435 HydrophobicContact CG-CE 3.88Å; E390-M435 HydrophobicContact CG-SD 4.39Å; A393-M435 HydrophobicContact CB-CE 3.29Å; A393-M435 HydrophobicContact CB-SD 3.78Å; G431-M435 WeakPolarHBondContact O-CB 3.47Å; G431-M435 PolarHBondContact O-N 3.17Å; L432-M435 WeakPolarHBondContact O-CB 3.38Å; V433-M435 VanDerWaalsContact C-N 3.34Å; M435-I437 PolarHBondContact O-N 2.97Å; M435-V438 PolarHBondContact O-N 2.72Å; M435-V438 VanDerWaalsContact O-N 3.11Å; M435-L439 HydrophobicContact CG-CD1 4.13Å; M435-L439 HydrophobicContact CG-CG 4.21Å; M435-L439 PolarHBondContact O-N 3.2Å; M435-L439 HydrophobicContact SD-CG 4.46Å; M435-I449 HydrophobicContact CB-CD1 4.17Å; M435-I449 HydrophobicContact CG-CD1 3.98Å; M435-I449 HydrophobicContact CG-CG1 3.97Å; M435-I452 HydrophobicContact CE-CD1 4.26Å |
| 436 | V | 73.2 | Confident | 71.5 | Confident | 20 Ų | 20 | 16.6 Ų | 16.6 | 12% | 0.121 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -55.9 | -39.4 | 178.5 | 177.1 | 0 | 0 | 0 | 0 | 110.2 | V433 T434 V438 L439 T440 T446 I449 | V433-V436 WeakPolarHBondContact O-CB 3.42Å; V433-V436 PolarHBondContact O-N 2.95Å; T434-V436 PolarHBondContact O-N 3.18Å; V436-V438 PolarHBondContact O-N 2.99Å; V436-L439 PolarHBondContact O-N 3.31Å; V436-T440 HydrophobicContact CG1-CG2 4.18Å; V436-T440 VanDerWaalsContact O-CG2 3.29Å; V436-T440 WeakPolarHBondContact O-CG2 3.4Å; V436-T440 PolarHBondContact O-N 3.43Å; V436-T440 PolarHBondContact O-OG1 3.27Å; V436-T440 VanDerWaalsContact O-OG1 3.07Å; V436-T446 HydrophobicContact CG1-CG2 4.01Å; V436-I449 HydrophobicContact CB-CD1 4.37Å; V436-I449 HydrophobicContact CG2-CD1 3.49Å; V436-I449 VanDerWaalsContact CG2-CD1 3.49Å |
| 437 | I | 70.9 | Confident | 71.9 | Confident | 5 Ų | 5 | 21.2 Ų | 21.2 | 3% | 0.026 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -60.3 | -47.2 | 179.1 | -50.1 | 173.3 | 0 | 0 | 0 | 110.7 | V227 A420 T434 M435 T440 S441 | V227-I437 HydrophobicContact CB-CB 4.17Å; V227-I437 HydrophobicContact CB-CD1 4.01Å; V227-I437 HydrophobicContact CB-CG1 3.61Å; V227-I437 HydrophobicContact CB-CG2 3.83Å; V227-I437 HydrophobicContact CG1-CB 4.43Å; V227-I437 HydrophobicContact CG1-CD1 3.32Å; V227-I437 HydrophobicContact CG1-CG1 3.51Å; V227-I437 HydrophobicContact CG1-CG2 4.19Å; V227-I437 HydrophobicContact CG2-CG1 3.84Å; A420-I437 HydrophobicContact CB-CB 4.16Å; A420-I437 HydrophobicContact CB-CD1 3.95Å; A420-I437 HydrophobicContact CB-CG2 4.2Å; T434-I437 HydrophobicContact CG2-CD1 4.05Å; T434-I437 WeakPolarHBondContact O-CB 3.3Å; T434-I437 VanDerWaalsContact O-CG1 3.3Å; T434-I437 WeakPolarHBondContact O-CG1 3.24Å; T434-I437 PolarHBondContact O-N 3.34Å; M435-I437 PolarHBondContact O-N 2.97Å; I437-T440 PolarHBondContact O-OG1 3Å; I437-S441 WeakPolarHBondContact O-CB 3.31Å; I437-S441 PolarHBondContact O-N 3.32Å; I437-S441 VanDerWaalsContact O-N 3.15Å |
| 438 | V | 84.6 | Confident | 72.6 | Confident | 0 Ų | 0 | 20.9 Ų | 20.9 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -68.1 | -44.9 | -176.3 | -177 | 0 | 0 | 0 | 0 | 110 | E390 A394 I413 A417 A420 M435 V436 S441 | E390-V438 HydrophobicContact CB-CG2 4.14Å; E390-V438 HydrophobicContact CG-CG2 4.36Å; A394-V438 HydrophobicContact CB-CG1 3.8Å; I413-V438 HydrophobicContact CG1-CG1 4.48Å; I413-V438 HydrophobicContact CG2-CG1 4.03Å; A417-V438 HydrophobicContact CB-CG1 4.46Å; A417-V438 HydrophobicContact CB-CG2 4.14Å; A420-V438 HydrophobicContact CB-CG2 3.99Å; M435-V438 PolarHBondContact O-N 2.72Å; M435-V438 VanDerWaalsContact O-N 3.11Å; V436-V438 PolarHBondContact O-N 2.99Å; V438-S441 PolarHBondContact O-N 2.98Å; V438-S441 PolarHBondContact O-OG 2.88Å |
| 439 | L | 81.6 | Confident | 73.5 | Confident | 0 Ų | 0 | 19.5 Ų | 19.5 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -64.9 | -45.4 | 178.5 | -66 | -178.9 | 0 | 0 | 0 | 112.8 | A394 I397 M435 V436 S441 V442 G443 L444 T446 I449 | A394-L439 HydrophobicContact CB-CD2 3.96Å; I397-L439 HydrophobicContact CB-CD2 4.39Å; I397-L439 HydrophobicContact CD1-CD1 3.77Å; I397-L439 HydrophobicContact CD1-CD2 4.04Å; I397-L439 HydrophobicContact CG2-CD2 4.35Å; M435-L439 HydrophobicContact CG-CD1 4.13Å; M435-L439 HydrophobicContact CG-CG 4.21Å; M435-L439 PolarHBondContact O-N 3.2Å; M435-L439 HydrophobicContact SD-CG 4.46Å; V436-L439 PolarHBondContact O-N 3.31Å; L439-S441 PolarHBondContact O-N 2.93Å; L439-V442 WeakPolarHBondContact O-CG2 3.4Å; L439-V442 PolarHBondContact O-N 3.44Å; L439-G443 PolarHBondContact O-N 2.89Å; L439-G443 VanDerWaalsContact O-N 3.15Å; L439-L444 HydrophobicContact CB-CB 4.17Å; L439-L444 HydrophobicContact CD2-CB 3.9Å; L439-L444 HydrophobicContact CD2-CD1 3.8Å; L439-L444 PolarHBondContact O-N 3.48Å; L439-T446 HydrophobicContact CB-CG2 4.34Å; L439-I449 HydrophobicContact CD1-CD1 3.79Å; L439-I449 HydrophobicContact CD1-CG1 3.43Å; L439-I449 VanDerWaalsContact CD1-CG1 3.43Å |
| 440 | T | 67.9 | Low | 73.7 | Confident | 24 Ų | 24 | 19.1 Ų | 19.1 | 15% | 0.147 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -67.2 | -28.5 | -179 | 59.3 | 0 | 0 | 0 | 0 | 112.4 | Q160 V436 I437 V442 G443 T446 | Q160-T440 PolarHBondContact NE2-O 3.42Å; V436-T440 HydrophobicContact CG1-CG2 4.18Å; V436-T440 VanDerWaalsContact O-CG2 3.29Å; V436-T440 WeakPolarHBondContact O-CG2 3.4Å; V436-T440 PolarHBondContact O-N 3.43Å; V436-T440 PolarHBondContact O-OG1 3.27Å; V436-T440 VanDerWaalsContact O-OG1 3.07Å; I437-T440 PolarHBondContact O-OG1 3Å; T440-V442 VanDerWaalsContact C-N 3.26Å; T440-V442 PolarHBondContact O-N 3.2Å; T440-G443 PolarHBondContact O-N 3.22Å; T440-T446 HydrophobicContact CG2-CG2 3.61Å |
| 441 | S | 67.7 | Low | 74.1 | Confident | 28 Ų | 28 | 19.4 Ų | 19.4 | 20% | 0.196 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -64.4 | -27.9 | 178.1 | 78.9 | 0 | 0 | 0 | 0 | 114.2 | T416 I437 V438 L439 | T416-S441 PolarHBondContact OG1-OG 2.91Å; I437-S441 WeakPolarHBondContact O-CB 3.31Å; I437-S441 PolarHBondContact O-N 3.32Å; I437-S441 VanDerWaalsContact O-N 3.15Å; V438-S441 PolarHBondContact O-N 2.98Å; V438-S441 PolarHBondContact O-OG 2.88Å; L439-S441 PolarHBondContact O-N 2.93Å |
| 442 | V | 72.8 | Confident | 74.5 | Confident | 10 Ų | 10 | 19.3 Ų | 19.3 | 6% | 0.061 | 12% | 0.122 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -107.6 | 5.4 | 176.4 | -70.3 | 0 | 0 | 0 | 0 | 113.2 | Q409 T412 I413 L439 T440 L444 | Q409-V442 HydrophobicContact CB-CG1 4.12Å; T412-V442 HydrophobicContact CG2-CG1 3.65Å; I413-V442 HydrophobicContact CD1-CG1 4.28Å; I413-V442 HydrophobicContact CD1-CG2 4.29Å; I413-V442 HydrophobicContact CG1-CB 4.48Å; I413-V442 HydrophobicContact CG1-CG1 3.67Å; I413-V442 HydrophobicContact CG1-CG2 4.07Å; L439-V442 WeakPolarHBondContact O-CG2 3.4Å; L439-V442 PolarHBondContact O-N 3.44Å; T440-V442 VanDerWaalsContact C-N 3.26Å; T440-V442 PolarHBondContact O-N 3.2Å; V442-L444 HydrophobicContact CG2-CB 4.3Å; V442-L444 HydrophobicContact CG2-CD1 3.62Å; V442-L444 HydrophobicContact CG2-CG 3.73Å |
| 443 | G | 66.5 | Low | 74.6 | Confident | 44 Ų | 44 | 19.1 Ų | 19.1 | 45% | 0.454 | 12% | 0.121 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 73.9 | 22.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | L439 T440 | L439-G443 PolarHBondContact O-N 2.89Å; L439-G443 VanDerWaalsContact O-N 3.15Å; T440-G443 PolarHBondContact O-N 3.22Å |
| 444 | L | 77.1 | Confident | 74.8 | Confident | 7 Ų | 7 | 18.7 Ų | 18.7 | 4% | 0.037 | 12% | 0.121 | C | C | . | . | trans | -81.1 | 146.4 | 176 | -70.1 | 173.2 | 0 | 0 | 0 | 111.5 | A394 A398 Y403 L439 V442 T446 | A394-L444 WeakPolarHBondContact O-CD1 3.35Å; A398-L444 HydrophobicContact CB-CD1 4.02Å; A398-L444 HydrophobicContact CB-CD2 4.06Å; Y403-L444 HydrophobicContact CD2-CD2 3.45Å; Y403-L444 VanDerWaalsContact CD2-CD2 3.45Å; Y403-L444 HydrophobicContact CE2-CD2 4.04Å; Y403-L444 HydrophobicContact CG-CD2 3.95Å; L439-L444 HydrophobicContact CB-CB 4.17Å; L439-L444 HydrophobicContact CD2-CB 3.9Å; L439-L444 HydrophobicContact CD2-CD1 3.8Å; L439-L444 PolarHBondContact O-N 3.48Å; V442-L444 HydrophobicContact CG2-CB 4.3Å; V442-L444 HydrophobicContact CG2-CD1 3.62Å; V442-L444 HydrophobicContact CG2-CG 3.73Å; L444-T446 PolarHBondContact O-N 2.99Å | ||
| 445 | P | 75.2 | Confident | 74.7 | Confident | 40 Ų | 40 | 20.1 Ų | 20.1 | 26% | 0.26 | 13% | 0.129 | S | C | . | . | trans | -65 | 128 | 178.7 | 26.2 | -34.5 | 0 | 0 | 0 | 112 | Y403 D447 D448 | Y403-P445 HydrophobicContact CE2-CG 4.05Å; P445-D447 VanDerWaalsContact C-N 3.32Å; P445-D447 PolarHBondContact O-N 2.95Å; P445-D448 VanDerWaalsContact CG-OD2 3.28Å; P445-D448 WeakPolarHBondContact CG-OD2 3.49Å | ||
| 446 | T | 75.1 | Confident | 74.5 | Confident | 28 Ų | 28 | 20.1 Ų | 20.1 | 17% | 0.172 | 13% | 0.129 | C | C | . | . | G | 310 helix | trans | -79.8 | -14.2 | -178.7 | 68.1 | 0 | 0 | 0 | 0 | 113.8 | V436 L439 T440 L444 D448 I449 | V436-T446 HydrophobicContact CG1-CG2 4.01Å; L439-T446 HydrophobicContact CB-CG2 4.34Å; T440-T446 HydrophobicContact CG2-CG2 3.61Å; L444-T446 PolarHBondContact O-N 2.99Å; T446-D448 PolarHBondContact O-N 3.44Å; T446-I449 WeakPolarHBondContact O-CB 3.33Å; T446-I449 VanDerWaalsContact O-CG1 3.29Å; T446-I449 WeakPolarHBondContact O-CG1 3.42Å; T446-I449 PolarHBondContact O-N 3.35Å |
| 447 | D | 70.7 | Confident | 74.6 | Confident | 102 Ų | 102 | 22 Ų | 22 | 55% | 0.545 | 13% | 0.134 | S | C | . | . | G | 310 helix | trans | -67.6 | -22.7 | -179.1 | -63.5 | -31.3 | 0 | 0 | 0 | 111.8 | P445 I449 T450 | P445-D447 VanDerWaalsContact C-N 3.32Å; P445-D447 PolarHBondContact O-N 2.95Å; D447-I449 VanDerWaalsContact C-N 3.26Å; D447-I449 PolarHBondContact O-N 2.91Å; D447-T450 WeakPolarHBondContact O-CB 3.38Å; D447-T450 WeakPolarHBondContact O-CG2 3.28Å; D447-T450 PolarHBondContact O-N 3.36Å; D447-T450 PolarHBondContact O-OG1 3.21Å |
| 448 | D | 77.8 | Confident | 74.9 | Confident | 26 Ų | 26 | 23.2 Ų | 23.2 | 14% | 0.139 | 14% | 0.144 | C | C | . | . | G | 310 helix | trans | -76.9 | -9.4 | 178.7 | -65.7 | -33.4 | 0 | 0 | 0 | 113.9 | I397 N401 P445 T446 T450 L451 | I397-D448 HydrophobicContact CD1-CB 4.41Å; I397-D448 HydrophobicContact CG1-CB 4.32Å; I397-D448 HydrophobicContact CG2-CB 3.79Å; N401-D448 PolarHBondContact ND2-OD2 3.25Å; N401-D448 PolarHBondContact OD1-OD2 3.42Å; P445-D448 VanDerWaalsContact CG-OD2 3.28Å; P445-D448 WeakPolarHBondContact CG-OD2 3.49Å; T446-D448 PolarHBondContact O-N 3.44Å; D448-T450 PolarHBondContact O-N 2.75Å; D448-T450 VanDerWaalsContact O-N 3.16Å; D448-L451 HydrophobicContact CB-CD1 3.96Å; D448-L451 VanDerWaalsContact O-CB 3.28Å; D448-L451 WeakPolarHBondContact O-CB 3.47Å; D448-L451 WeakPolarHBondContact O-CG 3.3Å; D448-L451 PolarHBondContact O-N 2.97Å |
| 449 | I | 77.9 | Confident | 75.1 | Confident | 1 Ų | 1 | 23.4 Ų | 23.4 | 1% | 0.005 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -56.1 | -32.5 | 168.2 | -64.5 | 173.9 | 0 | 0 | 0 | 110.1 | M60 L432 M435 V436 L439 T446 D447 L451 I452 I453 | M60-I449 HydrophobicContact CE-CG2 4.48Å; L432-I449 HydrophobicContact CD2-CG2 3.89Å; M435-I449 HydrophobicContact CB-CD1 4.17Å; M435-I449 HydrophobicContact CG-CD1 3.98Å; M435-I449 HydrophobicContact CG-CG1 3.97Å; V436-I449 HydrophobicContact CB-CD1 4.37Å; V436-I449 HydrophobicContact CG2-CD1 3.49Å; V436-I449 VanDerWaalsContact CG2-CD1 3.49Å; L439-I449 HydrophobicContact CD1-CD1 3.79Å; L439-I449 HydrophobicContact CD1-CG1 3.43Å; L439-I449 VanDerWaalsContact CD1-CG1 3.43Å; T446-I449 WeakPolarHBondContact O-CB 3.33Å; T446-I449 VanDerWaalsContact O-CG1 3.29Å; T446-I449 WeakPolarHBondContact O-CG1 3.42Å; T446-I449 PolarHBondContact O-N 3.35Å; D447-I449 VanDerWaalsContact C-N 3.26Å; D447-I449 PolarHBondContact O-N 2.91Å; I449-L451 PolarHBondContact O-N 3.44Å; I449-L451 VanDerWaalsContact O-N 3.16Å; I449-I452 HydrophobicContact CG2-CD1 4.49Å; I449-I452 HydrophobicContact CG2-CG1 4.36Å; I449-I452 WeakPolarHBondContact O-CG1 3.42Å; I449-I452 PolarHBondContact O-N 2.82Å; I449-I452 VanDerWaalsContact O-N 3.07Å; I449-I453 HydrophobicContact CG2-CD1 4.29Å; I449-I453 HydrophobicContact CG2-CG1 4.23Å; I449-I453 WeakPolarHBondContact O-CG1 3.46Å; I449-I453 PolarHBondContact O-N 3.33Å; I449-I453 VanDerWaalsContact O-N 3.17Å |
| 450 | T | 69.9 | Low | 75.3 | Confident | 15 Ų | 15 | 23.8 Ų | 23.8 | 9% | 0.092 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -60.5 | -26.2 | 179.1 | 60 | 0 | 0 | 0 | 0 | 113.9 | L280 K284 D447 D448 I452 | L280-T450 HydrophobicContact CD1-CG2 4.34Å; L280-T450 HydrophobicContact CD2-CG2 3.95Å; L280-T450 HydrophobicContact CG-CG2 4.22Å; K284-T450 WeakPolarHBondContact CD-OG1 3.38Å; K284-T450 WeakPolarHBondContact CE-OG1 3.39Å; K284-T450 WeakPolarHBondContact CG-OG1 3.15Å; K284-T450 PolarHBondContact NZ-OG1 3.5Å; D447-T450 WeakPolarHBondContact O-CB 3.38Å; D447-T450 WeakPolarHBondContact O-CG2 3.28Å; D447-T450 PolarHBondContact O-N 3.36Å; D447-T450 PolarHBondContact O-OG1 3.21Å; D448-T450 PolarHBondContact O-N 2.75Å; D448-T450 VanDerWaalsContact O-N 3.16Å; T450-I452 VanDerWaalsContact C-N 3.34Å |
| 451 | L | 73.4 | Confident | 76 | Confident | 18 Ų | 18 | 24.5 Ų | 24.5 | 9% | 0.094 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -65.5 | -39.6 | 175.8 | -56.9 | 172.4 | 0 | 0 | 0 | 111.2 | M288 L298 V400 D448 I449 | M288-L451 HydrophobicContact CE-CD2 3.33Å; L298-L451 WeakPolarHBondContact CD1-O 3.47Å; V400-L451 HydrophobicContact CG1-CD1 4.5Å; D448-L451 HydrophobicContact CB-CD1 3.96Å; D448-L451 VanDerWaalsContact O-CB 3.28Å; D448-L451 WeakPolarHBondContact O-CB 3.47Å; D448-L451 WeakPolarHBondContact O-CG 3.3Å; D448-L451 PolarHBondContact O-N 2.97Å; I449-L451 PolarHBondContact O-N 3.44Å; I449-L451 VanDerWaalsContact O-N 3.16Å |
| 452 | I | 80.9 | Confident | 77.2 | Confident | 0 Ų | 0 | 26.7 Ų | 26.7 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -86 | -21.5 | -176.2 | 59.8 | 175.8 | 0 | 0 | 0 | 113 | L298 Y301 Y389 A393 F396 I397 L432 M435 I449 T450 A454 V455 D456 | L298-I452 HydrophobicContact CD1-CG2 4.17Å; Y301-I452 HydrophobicContact CD1-CG2 4.17Å; Y301-I452 HydrophobicContact CE1-CB 3.98Å; Y301-I452 HydrophobicContact CE1-CG2 3.65Å; Y389-I452 VanDerWaalsContact OH-CD1 3.24Å; Y389-I452 WeakPolarHBondContact OH-CD1 3.45Å; A393-I452 HydrophobicContact CB-CD1 3.86Å; F396-I452 HydrophobicContact CD1-CG2 4.03Å; F396-I452 HydrophobicContact CE1-CG2 3.9Å; I397-I452 HydrophobicContact CD1-CD1 4.3Å; L432-I452 HydrophobicContact CD2-CG1 4.46Å; M435-I452 HydrophobicContact CE-CD1 4.26Å; I449-I452 HydrophobicContact CG2-CD1 4.49Å; I449-I452 HydrophobicContact CG2-CG1 4.36Å; I449-I452 WeakPolarHBondContact O-CG1 3.42Å; I449-I452 PolarHBondContact O-N 2.82Å; I449-I452 VanDerWaalsContact O-N 3.07Å; T450-I452 VanDerWaalsContact C-N 3.34Å; I452-A454 PolarHBondContact O-N 3.4Å; I452-A454 VanDerWaalsContact O-N 3.13Å; I452-V455 VanDerWaalsContact O-CG2 3.24Å; I452-V455 WeakPolarHBondContact O-CG2 3.44Å; I452-V455 PolarHBondContact O-N 2.93Å; I452-D456 WeakPolarHBondContact O-CB 3.23Å; I452-D456 PolarHBondContact O-N 3.11Å |
| 453 | I | 74.2 | Confident | 78.2 | Confident | 4 Ų | 4 | 26.2 Ų | 26.2 | 2% | 0.021 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -53.5 | -36.2 | 177.8 | -72.4 | 177.1 | 0 | 0 | 0 | 112.2 | M60 I277 L280 L432 I449 V455 D456 | M60-I453 HydrophobicContact CE-CD1 4Å; M60-I453 HydrophobicContact SD-CD1 3.51Å; M60-I453 VanDerWaalsContact SD-CD1 3.51Å; I277-I453 HydrophobicContact CD1-CG2 4.02Å; I277-I453 HydrophobicContact CG1-CG2 4.1Å; L280-I453 HydrophobicContact CD1-CD1 3.78Å; L280-I453 HydrophobicContact CD2-CB 4.25Å; L280-I453 HydrophobicContact CD2-CD1 4.12Å; L280-I453 HydrophobicContact CD2-CG2 4.25Å; L432-I453 HydrophobicContact CD1-CG1 3.87Å; L432-I453 HydrophobicContact CD2-CG1 3.9Å; I449-I453 HydrophobicContact CG2-CD1 4.29Å; I449-I453 HydrophobicContact CG2-CG1 4.23Å; I449-I453 WeakPolarHBondContact O-CG1 3.46Å; I449-I453 PolarHBondContact O-N 3.33Å; I449-I453 VanDerWaalsContact O-N 3.17Å; I453-V455 VanDerWaalsContact C-N 3.26Å; I453-V455 PolarHBondContact O-N 3.21Å; I453-D456 PolarHBondContact O-N 3.39Å |
| 454 | A | 69.6 | Low | 79.3 | Confident | 17 Ų | 17 | 24.4 Ų | 24.4 | 14% | 0.14 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -62 | -30.6 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | V281 I452 W457 | V281-A454 HydrophobicContact CG1-CB 4.44Å; V281-A454 HydrophobicContact CG2-CB 3.96Å; I452-A454 PolarHBondContact O-N 3.4Å; I452-A454 VanDerWaalsContact O-N 3.13Å; A454-W457 PolarHBondContact O-NE1 3.46Å; A454-W457 VanDerWaalsContact O-NE1 3.16Å |
| 455 | V | 77.1 | Confident | 80.1 | Confident | 33 Ų | 33 | 26.1 Ų | 26.1 | 20% | 0.2 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -103.7 | -19.3 | 178 | -67.2 | 0 | 0 | 0 | 0 | 112.7 | L298 Y301 I452 I453 W457 A458 L459 | L298-V455 HydrophobicContact CD1-CG1 4.5Å; L298-V455 HydrophobicContact CD1-CG2 3.75Å; L298-V455 HydrophobicContact CD2-CG1 3.7Å; L298-V455 HydrophobicContact CD2-CG2 4.32Å; L298-V455 HydrophobicContact CG-CG1 3.8Å; L298-V455 HydrophobicContact CG-CG2 3.97Å; Y301-V455 HydrophobicContact CD1-CG2 4.07Å; Y301-V455 HydrophobicContact CE1-CG2 3.9Å; I452-V455 VanDerWaalsContact O-CG2 3.24Å; I452-V455 WeakPolarHBondContact O-CG2 3.44Å; I452-V455 PolarHBondContact O-N 2.93Å; I453-V455 VanDerWaalsContact C-N 3.26Å; I453-V455 PolarHBondContact O-N 3.21Å; V455-W457 VanDerWaalsContact C-N 3.26Å; V455-W457 PolarHBondContact O-N 2.93Å; V455-A458 PolarHBondContact O-N 2.83Å; V455-L459 HydrophobicContact CB-CD1 4.49Å; V455-L459 HydrophobicContact CG2-CD1 4.08Å; V455-L459 PolarHBondContact O-N 3.3Å |
| 456 | D | 81.6 | Confident | 81.1 | Confident | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -58.7 | -35.6 | -175.3 | -170.7 | 65.5 | 0 | 0 | 0 | 112.8 | Y389 L432 I452 I453 A458 L459 D460 R463 | Y389-D456 WeakPolarHBondContact CE2-OD1 3.4Å; Y389-D456 PolarHBondContact OH-OD1 3.42Å; Y389-D456 VanDerWaalsContact OH-OD1 3.07Å; L432-D456 HydrophobicContact CD1-CB 4.27Å; L432-D456 WeakPolarHBondContact CD1-OD2 3.26Å; L432-D456 HydrophobicContact CD2-CB 4.12Å; L432-D456 HydrophobicContact CG-CB 4.41Å; L432-D456 VanDerWaalsContact CG-OD2 3.32Å; L432-D456 WeakPolarHBondContact CG-OD2 3.36Å; I452-D456 WeakPolarHBondContact O-CB 3.23Å; I452-D456 PolarHBondContact O-N 3.11Å; I453-D456 PolarHBondContact O-N 3.39Å; D456-A458 PolarHBondContact O-N 2.88Å; D456-L459 PolarHBondContact O-N 2.92Å; D456-L459 VanDerWaalsContact O-N 3.11Å; D456-D460 VanDerWaalsContact O-CB 3.24Å; D456-D460 WeakPolarHBondContact O-CB 3.18Å; D456-D460 PolarHBondContact O-N 3.33Å; D456-R463 IonicContact OD1-CZ 2.72Å; D456-R463 IonicContact OD1-NH1 3.35Å; D456-R463 PolarHBondContact OD1-NH1 3.09Å; D456-R463 IonicContact OD1-NH2 3.16Å; D456-R463 PolarHBondContact OD1-NH2 3.42Å; D456-R463 IonicContact OD2-CZ 3.36Å; D456-R463 IonicContact OD2-NH1 2.99Å; D456-R463 IonicContact OD2-NH2 2.7Å; D456-R463 PolarHBondContact OD2-NH2 3.17Å |
| 457 | W | 73.5 | Confident | 82.1 | Confident | 61 Ų | 61 | 23.2 Ų | 23.2 | 23% | 0.231 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -56.6 | -29.7 | 178 | 75.9 | -90.6 | 0 | 0 | 0 | 113.6 | V26 A454 V455 | V26-W457 HydrophobicContact CB-CH2 4.44Å; V26-W457 HydrophobicContact CG1-CH2 4.22Å; V26-W457 HydrophobicContact CG1-CZ2 4.37Å; V26-W457 HydrophobicContact CG2-CD2 4.21Å; V26-W457 HydrophobicContact CG2-CE3 3.65Å; V26-W457 HydrophobicContact CG2-CH2 3.45Å; V26-W457 VanDerWaalsContact CG2-CH2 3.45Å; V26-W457 HydrophobicContact CG2-CZ2 4Å; V26-W457 HydrophobicContact CG2-CZ3 3.26Å; A454-W457 PolarHBondContact O-NE1 3.46Å; A454-W457 VanDerWaalsContact O-NE1 3.16Å; V455-W457 VanDerWaalsContact C-N 3.26Å; V455-W457 PolarHBondContact O-N 2.93Å |
| 458 | A | 78.1 | Confident | 83.2 | Confident | 29 Ų | 29 | 18.6 Ų | 18.6 | 24% | 0.24 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -86.4 | -43.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | V455 D456 D460 R461 F462 | V455-A458 PolarHBondContact O-N 2.83Å; D456-A458 PolarHBondContact O-N 2.88Å; A458-D460 VanDerWaalsContact C-N 3.29Å; A458-D460 PolarHBondContact O-N 3.17Å; A458-R461 WeakPolarHBondContact O-CB 3.23Å; A458-R461 PolarHBondContact O-N 3.46Å; A458-F462 WeakPolarHBondContact O-CD2 3.46Å |
| 459 | L | 88.6 | Confident | 84.1 | Confident | 5 Ų | 5 | 17.6 Ų | 17.6 | 3% | 0.026 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -62.5 | -36.7 | 179.1 | -61.5 | 178 | 0 | 0 | 0 | 112 | Y301 A302 V305 V306 Y389 V455 D456 R461 F462 R463 | Y301-L459 HydrophobicContact CD1-CD1 4.48Å; Y301-L459 HydrophobicContact CE1-CD1 3.78Å; A302-L459 HydrophobicContact CB-CD1 4.46Å; A302-L459 HydrophobicContact CB-CD2 4.18Å; V305-L459 HydrophobicContact CB-CD1 4.26Å; V305-L459 HydrophobicContact CB-CD2 4.24Å; V305-L459 HydrophobicContact CG1-CB 4.5Å; V305-L459 HydrophobicContact CG1-CD1 4.25Å; V305-L459 HydrophobicContact CG1-CD2 4.15Å; V305-L459 HydrophobicContact CG2-CD1 4.35Å; V306-L459 HydrophobicContact CG2-CD2 3.59Å; Y389-L459 HydrophobicContact CE2-CD1 4.45Å; V455-L459 HydrophobicContact CB-CD1 4.49Å; V455-L459 HydrophobicContact CG2-CD1 4.08Å; V455-L459 PolarHBondContact O-N 3.3Å; D456-L459 PolarHBondContact O-N 2.92Å; D456-L459 VanDerWaalsContact O-N 3.11Å; L459-R461 PolarHBondContact O-N 3.28Å; L459-R461 VanDerWaalsContact O-N 3.14Å; L459-F462 PolarHBondContact O-N 2.84Å; L459-R463 WeakPolarHBondContact O-CG 3.48Å; L459-R463 PolarHBondContact O-N 3.25Å |
| 460 | D | 85.3 | Confident | 84.9 | Confident | 8 Ų | 8 | 17.6 Ų | 17.6 | 4% | 0.043 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -56.1 | -32.7 | -179.3 | -166.5 | 37.9 | 0 | 0 | 0 | 113.6 | S347 P428 Q429 D456 A458 R463 T464 | S347-D460 WeakPolarHBondContact CB-OD2 3.32Å; P428-D460 WeakPolarHBondContact CA-OD2 3.36Å; Q429-D460 PolarHBondContact N-OD2 2.85Å; D456-D460 VanDerWaalsContact O-CB 3.24Å; D456-D460 WeakPolarHBondContact O-CB 3.18Å; D456-D460 PolarHBondContact O-N 3.33Å; A458-D460 VanDerWaalsContact C-N 3.29Å; A458-D460 PolarHBondContact O-N 3.17Å; D460-R463 VanDerWaalsContact CB-NH2 3.3Å; D460-R463 PolarHBondContact O-N 3.48Å; D460-R463 IonicContact OD1-CZ 2.86Å; D460-R463 IonicContact OD1-NE 3.89Å; D460-R463 PolarHBondContact OD1-NE 3.15Å; D460-R463 IonicContact OD1-NH2 3.87Å; D460-R463 PolarHBondContact OD1-NH2 3.36Å; D460-T464 WeakPolarHBondContact O-CB 3.4Å; D460-T464 PolarHBondContact O-N 2.79Å; D460-T464 PolarHBondContact O-OG1 2.92Å |
| 461 | R | 83.9 | Confident | 86.1 | Confident | 38 Ų | 38 | 17.2 Ų | 17.2 | 14% | 0.143 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -63.1 | -47.5 | 176.6 | -58.3 | 176.9 | 179.4 | -65.9 | -18.6 | 111.6 | L344 A345 S347 A458 L459 T464 M465 | L344-R461 HydrophobicContact CD1-CB 3.77Å; L344-R461 HydrophobicContact CG-CB 4.38Å; L344-R461 WeakPolarHBondContact O-CG 3.33Å; L344-R461 PolarHBondContact O-NH1 2.89Å; A345-R461 PolarHBondContact O-NH1 2.89Å; S347-R461 VanDerWaalsContact OG-CG 3.3Å; S347-R461 WeakPolarHBondContact OG-CG 3.03Å; A458-R461 WeakPolarHBondContact O-CB 3.23Å; A458-R461 PolarHBondContact O-N 3.46Å; L459-R461 PolarHBondContact O-N 3.28Å; L459-R461 VanDerWaalsContact O-N 3.14Å; R461-T464 PolarHBondContact O-N 3.38Å; R461-M465 WeakPolarHBondContact O-CB 3.46Å; R461-M465 PolarHBondContact O-N 3.4Å |
| 462 | F | 92.2 | Very high | 87.2 | Confident | 75 Ų | 75 | 16.4 Ų | 16.4 | 33% | 0.329 | 8% | 0.084 | S | C | . | . | H | α-helix | trans | -69.3 | -39.4 | 179.7 | -62.6 | -74 | 0 | 0 | 0 | 110.3 | V306 L309 L344 A458 L459 T464 M465 V466 | V306-F462 HydrophobicContact CG2-CD2 4.22Å; V306-F462 HydrophobicContact CG2-CE2 4.43Å; L309-F462 HydrophobicContact CD1-CB 3.66Å; L344-F462 HydrophobicContact CD1-CD1 3.99Å; L344-F462 HydrophobicContact CD1-CE1 4.09Å; A458-F462 WeakPolarHBondContact O-CD2 3.46Å; L459-F462 PolarHBondContact O-N 2.84Å; F462-T464 PolarHBondContact O-N 3.38Å; F462-M465 HydrophobicContact CD1-CE 4.37Å; F462-M465 PolarHBondContact O-N 3.32Å; F462-V466 WeakPolarHBondContact O-CG2 3.46Å; F462-V466 PolarHBondContact O-N 3.41Å |
| 463 | R | 94.1 | Very high | 88 | Confident | 0 Ų | 0 | 16.4 Ų | 16.4 | 0% | 0 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -57 | -51.6 | 173.6 | -63.2 | -171.1 | -56.7 | -144.1 | -10.7 | 111.1 | L309 G385 Y389 D456 L459 D460 M465 V466 N467 | L309-R463 HydrophobicContact CD1-CG 3.97Å; L309-R463 HydrophobicContact CD2-CG 4.45Å; G385-R463 WeakPolarHBondContact O-CG 3.48Å; Y389-R463 VanDerWaalsContact CB-CD 3.49Å; Y389-R463 VanDerWaalsContact CE2-NH1 3.25Å; D456-R463 IonicContact OD1-CZ 2.72Å; D456-R463 IonicContact OD1-NH1 3.35Å; D456-R463 PolarHBondContact OD1-NH1 3.09Å; D456-R463 IonicContact OD1-NH2 3.16Å; D456-R463 PolarHBondContact OD1-NH2 3.42Å; D456-R463 IonicContact OD2-CZ 3.36Å; D456-R463 IonicContact OD2-NH1 2.99Å; D456-R463 IonicContact OD2-NH2 2.7Å; D456-R463 PolarHBondContact OD2-NH2 3.17Å; L459-R463 WeakPolarHBondContact O-CG 3.48Å; L459-R463 PolarHBondContact O-N 3.25Å; D460-R463 VanDerWaalsContact CB-NH2 3.3Å; D460-R463 PolarHBondContact O-N 3.48Å; D460-R463 IonicContact OD1-CZ 2.86Å; D460-R463 IonicContact OD1-NE 3.89Å; D460-R463 PolarHBondContact OD1-NE 3.15Å; D460-R463 IonicContact OD1-NH2 3.87Å; D460-R463 PolarHBondContact OD1-NH2 3.36Å; R463-M465 VanDerWaalsContact C-N 3.34Å; R463-M465 PolarHBondContact O-N 3.18Å; R463-V466 PolarHBondContact O-N 3.46Å; R463-N467 PolarHBondContact O-N 2.83Å; R463-N467 PolarHBondContact O-OD1 2.78Å |
| 464 | T | 89.5 | Confident | 89 | Confident | 6 Ų | 6 | 16.2 Ų | 16.2 | 4% | 0.037 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -60.4 | -45.4 | -179.6 | -58.5 | 0 | 0 | 0 | 0 | 111.1 | A343 S347 S348 D460 R461 F462 V466 N467 V468 | A343-T464 HydrophobicContact CB-CG2 4.08Å; S347-T464 VanDerWaalsContact C-OG1 3.3Å; S347-T464 PolarHBondContact O-OG1 3.39Å; S348-T464 VanDerWaalsContact N-CG2 3.33Å; D460-T464 WeakPolarHBondContact O-CB 3.4Å; D460-T464 PolarHBondContact O-N 2.79Å; D460-T464 PolarHBondContact O-OG1 2.92Å; R461-T464 PolarHBondContact O-N 3.38Å; F462-T464 PolarHBondContact O-N 3.38Å; T464-V466 VanDerWaalsContact C-N 3.31Å; T464-V466 PolarHBondContact O-N 3.24Å; T464-N467 PolarHBondContact O-N 3.08Å; T464-V468 HydrophobicContact CG2-CG2 4.39Å; T464-V468 WeakPolarHBondContact O-CG2 3.42Å; T464-V468 PolarHBondContact O-N 3.2Å |
| 465 | M | 92.8 | Very high | 90.2 | Very high | 42 Ų | 42 | 15.4 Ų | 15.4 | 21% | 0.207 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -59.5 | -41.8 | 177.7 | -174.7 | -178.2 | 74.4 | 0 | 0 | 111.9 | L340 L344 R461 F462 R463 M469 | L340-M465 HydrophobicContact CB-CG 4.13Å; L340-M465 HydrophobicContact CD2-CG 4.13Å; L344-M465 HydrophobicContact CB-SD 4.41Å; L344-M465 HydrophobicContact CD1-CB 4.46Å; L344-M465 HydrophobicContact CD1-SD 4.06Å; R461-M465 WeakPolarHBondContact O-CB 3.46Å; R461-M465 PolarHBondContact O-N 3.4Å; F462-M465 HydrophobicContact CD1-CE 4.37Å; F462-M465 PolarHBondContact O-N 3.32Å; R463-M465 VanDerWaalsContact C-N 3.34Å; R463-M465 PolarHBondContact O-N 3.18Å; M465-M469 VanDerWaalsContact O-CB 3.3Å; M465-M469 WeakPolarHBondContact O-CB 3.41Å; M465-M469 PolarHBondContact O-N 3.02Å |
| 466 | V | 96.8 | Very high | 91 | Very high | 4 Ų | 4 | 14 Ų | 14 | 2% | 0.024 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -66.6 | -42.5 | 175.9 | 172.4 | 0 | 0 | 0 | 0 | 111.5 | L309 L317 D384 F462 R463 T464 M469 G470 | L309-V466 HydrophobicContact CB-CG2 4.14Å; L309-V466 HydrophobicContact CD2-CB 4.39Å; L309-V466 HydrophobicContact CD2-CG2 4.2Å; L317-V466 HydrophobicContact CD1-CG1 4.35Å; D384-V466 HydrophobicContact CB-CG1 4.42Å; F462-V466 WeakPolarHBondContact O-CG2 3.46Å; F462-V466 PolarHBondContact O-N 3.41Å; R463-V466 PolarHBondContact O-N 3.46Å; T464-V466 VanDerWaalsContact C-N 3.31Å; T464-V466 PolarHBondContact O-N 3.24Å; V466-M469 WeakPolarHBondContact O-CB 3.25Å; V466-M469 PolarHBondContact O-N 3.03Å; V466-G470 PolarHBondContact O-N 3.45Å |
| 467 | N | 95.5 | Very high | 91.7 | Very high | 4 Ų | 4 | 14 Ų | 14 | 2% | 0.021 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -58.9 | -50.5 | 176.5 | -64.8 | -9.6 | 0 | 0 | 0 | 111 | M383 D384 G385 T386 R463 T464 M469 G470 D471 | M383-N467 VanDerWaalsContact C-OD1 3.3Å; D384-N467 PolarHBondContact N-OD1 3.48Å; G385-N467 WeakPolarHBondContact CA-OD1 3.39Å; G385-N467 PolarHBondContact N-OD1 3.01Å; T386-N467 PolarHBondContact OG1-ND2 3.33Å; R463-N467 PolarHBondContact O-N 2.83Å; R463-N467 PolarHBondContact O-OD1 2.78Å; T464-N467 PolarHBondContact O-N 3.08Å; N467-M469 VanDerWaalsContact C-N 3.3Å; N467-M469 PolarHBondContact O-N 2.63Å; N467-G470 PolarHBondContact O-N 3.05Å; N467-G470 VanDerWaalsContact O-N 3.14Å; N467-D471 PolarHBondContact O-N 3.44Å |
| 468 | V | 94.1 | Very high | 92.6 | Very high | 4 Ų | 4 | 11.1 Ų | 11.1 | 2% | 0.024 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -62.6 | -37.3 | 178.1 | 174.6 | 0 | 0 | 0 | 0 | 111.7 | L340 A343 T352 T356 T464 A472 | L340-V468 HydrophobicContact CD2-CG1 4.26Å; A343-V468 HydrophobicContact CB-CB 4.2Å; A343-V468 HydrophobicContact CB-CG1 4.45Å; A343-V468 HydrophobicContact CB-CG2 3.84Å; T352-V468 VanDerWaalsContact OG1-CG2 3.31Å; T352-V468 WeakPolarHBondContact OG1-CG2 3.47Å; T356-V468 HydrophobicContact CG2-CG1 4.32Å; T464-V468 HydrophobicContact CG2-CG2 4.39Å; T464-V468 WeakPolarHBondContact O-CG2 3.42Å; T464-V468 PolarHBondContact O-N 3.2Å; V468-A472 WeakPolarHBondContact O-CB 3.4Å; V468-A472 PolarHBondContact O-N 3.07Å; V468-A472 VanDerWaalsContact O-N 3.09Å |
| 469 | M | 96.5 | Very high | 93.2 | Very high | 6 Ų | 6 | 10.7 Ų | 10.7 | 3% | 0.03 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -65.2 | -42.8 | 174.7 | -169.9 | 179.2 | -69.3 | 0 | 0 | 111.8 | L314 L340 M465 V466 N467 A472 L473 | L314-M469 HydrophobicContact CD2-CE 4.14Å; L314-M469 HydrophobicContact CD2-SD 4.47Å; L340-M469 HydrophobicContact CD1-CE 3.44Å; L340-M469 VanDerWaalsContact CD1-CE 3.44Å; L340-M469 HydrophobicContact CD2-CB 3.75Å; L340-M469 HydrophobicContact CD2-CE 4.1Å; L340-M469 HydrophobicContact CD2-CG 4.37Å; L340-M469 HydrophobicContact CG-CE 4.4Å; M465-M469 VanDerWaalsContact O-CB 3.3Å; M465-M469 WeakPolarHBondContact O-CB 3.41Å; M465-M469 PolarHBondContact O-N 3.02Å; V466-M469 WeakPolarHBondContact O-CB 3.25Å; V466-M469 PolarHBondContact O-N 3.03Å; N467-M469 VanDerWaalsContact C-N 3.3Å; N467-M469 PolarHBondContact O-N 2.63Å; M469-A472 PolarHBondContact O-N 2.67Å; M469-L473 HydrophobicContact CG-CD1 3.91Å; M469-L473 HydrophobicContact CG-CG 4.41Å; M469-L473 WeakPolarHBondContact O-CB 3.41Å; M469-L473 WeakPolarHBondContact O-CG 2.94Å; M469-L473 PolarHBondContact O-N 2.95Å |
| 470 | G | 96.3 | Very high | 93.4 | Very high | 0 Ų | 0 | 14 Ų | 14 | 0% | 0 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -56.9 | -49.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | V466 N467 A472 L473 A474 | V466-G470 PolarHBondContact O-N 3.45Å; N467-G470 PolarHBondContact O-N 3.05Å; N467-G470 VanDerWaalsContact O-N 3.14Å; G470-A472 PolarHBondContact O-N 2.87Å; G470-L473 PolarHBondContact O-N 2.72Å; G470-A474 VanDerWaalsContact O-CB 3.24Å; G470-A474 WeakPolarHBondContact O-CB 3.36Å; G470-A474 PolarHBondContact O-N 2.88Å |
| 471 | D | 94.8 | Very high | 93.6 | Very high | 7 Ų | 7 | 16.4 Ų | 16.4 | 4% | 0.037 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -60.8 | -43.3 | 178.2 | -67 | -15.6 | 0 | 0 | 0 | 112.5 | L375 G378 A379 N382 N467 T475 | L375-D471 HydrophobicContact CD2-CB 3.96Å; G378-D471 VanDerWaalsContact C-OD2 3.23Å; G378-D471 VanDerWaalsContact CA-OD1 3.25Å; G378-D471 WeakPolarHBondContact CA-OD1 3.4Å; A379-D471 PolarHBondContact N-OD2 3.35Å; N382-D471 VanDerWaalsContact CB-OD1 3.29Å; N382-D471 WeakPolarHBondContact CB-OD1 3.34Å; N382-D471 PolarHBondContact ND2-N 3.08Å; N382-D471 PolarHBondContact ND2-OD1 2.83Å; N467-D471 PolarHBondContact O-N 3.44Å; D471-T475 WeakPolarHBondContact O-CB 3.25Å; D471-T475 PolarHBondContact O-N 2.98Å; D471-T475 PolarHBondContact O-OG1 2.69Å |
| 472 | A | 96.1 | Very high | 93.6 | Very high | 1 Ų | 1 | 14.7 Ų | 14.7 | 1% | 0.008 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -68.6 | -41.1 | -179 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y332 I336 T356 L360 V468 M469 G470 T475 G476 | Y332-A472 VanDerWaalsContact CE1-O 3.28Å; Y332-A472 WeakPolarHBondContact CE1-O 3.39Å; Y332-A472 PolarHBondContact OH-O 3.03Å; I336-A472 HydrophobicContact CD1-CB 3.42Å; I336-A472 VanDerWaalsContact CD1-CB 3.42Å; I336-A472 HydrophobicContact CG2-CB 4.32Å; T356-A472 HydrophobicContact CG2-CB 4.2Å; L360-A472 HydrophobicContact CD1-CB 4.3Å; L360-A472 HydrophobicContact CD2-CB 4.37Å; V468-A472 WeakPolarHBondContact O-CB 3.4Å; V468-A472 PolarHBondContact O-N 3.07Å; V468-A472 VanDerWaalsContact O-N 3.09Å; M469-A472 PolarHBondContact O-N 2.67Å; G470-A472 PolarHBondContact O-N 2.87Å; A472-T475 PolarHBondContact O-N 3.13Å; A472-G476 PolarHBondContact O-N 3.22Å |
| 473 | L | 96.9 | Very high | 93 | Very high | 0 Ų | 0 | 18.4 Ų | 18.4 | 0% | 0 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -68.6 | -41.9 | 175.7 | -72.3 | 171.7 | 0 | 0 | 0 | 111.5 | L317 P318 Y321 Y332 I333 M469 G470 T475 G476 I477 | L317-L473 HydrophobicContact CB-CD1 3.7Å; P318-L473 HydrophobicContact CG-CD1 4.46Å; Y321-L473 HydrophobicContact CD2-CB 4.45Å; Y321-L473 HydrophobicContact CD2-CD2 3.75Å; Y321-L473 HydrophobicContact CE2-CD2 4.4Å; Y321-L473 HydrophobicContact CG-CD2 3.95Å; Y332-L473 HydrophobicContact CD1-CD2 3.72Å; Y332-L473 HydrophobicContact CE1-CD2 4.08Å; I333-L473 HydrophobicContact CG1-CD2 4.26Å; M469-L473 HydrophobicContact CG-CD1 3.91Å; M469-L473 HydrophobicContact CG-CG 4.41Å; M469-L473 WeakPolarHBondContact O-CB 3.41Å; M469-L473 WeakPolarHBondContact O-CG 2.94Å; M469-L473 PolarHBondContact O-N 2.95Å; G470-L473 PolarHBondContact O-N 2.72Å; L473-T475 VanDerWaalsContact C-N 3.29Å; L473-T475 PolarHBondContact O-N 2.96Å; L473-G476 PolarHBondContact O-N 2.98Å; L473-G476 VanDerWaalsContact O-N 3.12Å; L473-I477 WeakPolarHBondContact O-CG1 3.27Å; L473-I477 PolarHBondContact O-N 2.7Å |
| 474 | A | 95.5 | Very high | 91.9 | Very high | 0 Ų | 0 | 26.3 Ų | 26.3 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -56.4 | -45.4 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | Y97 Y98 V374 G470 G476 I477 M478 | Y97-A474 HydrophobicContact CD1-CB 3.79Å; Y97-A474 HydrophobicContact CE1-CB 3.52Å; Y98-A474 HydrophobicContact CD1-CB 4.22Å; Y98-A474 HydrophobicContact CE1-CB 3.37Å; V374-A474 HydrophobicContact CG1-CB 4.45Å; G470-A474 VanDerWaalsContact O-CB 3.24Å; G470-A474 WeakPolarHBondContact O-CB 3.36Å; G470-A474 PolarHBondContact O-N 2.88Å; A474-G476 VanDerWaalsContact C-N 3.27Å; A474-G476 PolarHBondContact O-N 2.77Å; A474-I477 WeakPolarHBondContact O-CB 3.34Å; A474-I477 PolarHBondContact O-N 2.94Å; A474-I477 VanDerWaalsContact O-N 3.09Å; A474-M478 VanDerWaalsContact O-CG 3.29Å; A474-M478 WeakPolarHBondContact O-CG 3.31Å; A474-M478 PolarHBondContact O-N 3.45Å |
| 475 | T | 94.4 | Very high | 90.9 | Very high | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -57.1 | -40.8 | 177 | -56.6 | 0 | 0 | 0 | 0 | 111.9 | L360 I366 I370 I371 V374 L375 D471 A472 L473 A479 | L360-T475 HydrophobicContact CD1-CG2 3.98Å; I366-T475 HydrophobicContact CG2-CG2 4.07Å; I370-T475 HydrophobicContact CG2-CG2 4.22Å; I371-T475 HydrophobicContact CG1-CG2 4.11Å; V374-T475 HydrophobicContact CB-CG2 4.41Å; V374-T475 VanDerWaalsContact CG1-OG1 3.28Å; V374-T475 WeakPolarHBondContact CG1-OG1 3.47Å; L375-T475 WeakPolarHBondContact CD2-OG1 3.21Å; D471-T475 WeakPolarHBondContact O-CB 3.25Å; D471-T475 PolarHBondContact O-N 2.98Å; D471-T475 PolarHBondContact O-OG1 2.69Å; A472-T475 PolarHBondContact O-N 3.13Å; L473-T475 VanDerWaalsContact C-N 3.29Å; L473-T475 PolarHBondContact O-N 2.96Å; T475-A479 WeakPolarHBondContact O-CB 3.4Å; T475-A479 PolarHBondContact O-N 2.98Å |
| 476 | G | 94.8 | Very high | 89.5 | Confident | 4 Ų | 4 | 28.6 Ų | 28.6 | 4% | 0.041 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -70.3 | -35.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y332 A472 L473 A474 H480 | Y332-G476 WeakPolarHBondContact OH-CA 3.32Å; Y332-G476 PolarHBondContact OH-N 3.31Å; Y332-G476 VanDerWaalsContact OH-N 3.11Å; A472-G476 PolarHBondContact O-N 3.22Å; L473-G476 PolarHBondContact O-N 2.98Å; L473-G476 VanDerWaalsContact O-N 3.12Å; A474-G476 VanDerWaalsContact C-N 3.27Å; A474-G476 PolarHBondContact O-N 2.77Å; G476-H480 PolarHBondContact O-N 2.94Å; G476-H480 VanDerWaalsContact O-N 3.14Å |
| 477 | I | 95.6 | Very high | 87.7 | Confident | 0 Ų | 0 | 33.4 Ų | 33.4 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -65.9 | -47.7 | 173.9 | -70.5 | 163.3 | 0 | 0 | 0 | 110.3 | Y97 Y321 I324 T325 L473 A474 A479 H480 I481 | Y97-I477 HydrophobicContact CE1-CD1 4.48Å; Y97-I477 HydrophobicContact CE2-CD1 3.62Å; Y97-I477 WeakPolarHBondContact OH-CD1 3.45Å; Y321-I477 HydrophobicContact CD2-CD1 4.34Å; Y321-I477 HydrophobicContact CD2-CG1 3.81Å; Y321-I477 HydrophobicContact CG-CG1 4.48Å; I324-I477 HydrophobicContact CD1-CD1 4.3Å; I324-I477 HydrophobicContact CD1-CG2 4.1Å; I324-I477 HydrophobicContact CG2-CG2 3.88Å; T325-I477 HydrophobicContact CG2-CG1 4.03Å; L473-I477 WeakPolarHBondContact O-CG1 3.27Å; L473-I477 PolarHBondContact O-N 2.7Å; A474-I477 WeakPolarHBondContact O-CB 3.34Å; A474-I477 PolarHBondContact O-N 2.94Å; A474-I477 VanDerWaalsContact O-N 3.09Å; I477-A479 VanDerWaalsContact C-N 3.29Å; I477-A479 PolarHBondContact O-N 2.9Å; I477-H480 WeakPolarHBondContact O-CA 3.26Å; I477-H480 WeakPolarHBondContact O-CB 3.43Å; I477-H480 PolarHBondContact O-N 3.33Å; I477-I481 HydrophobicContact CG2-CD1 3.6Å; I477-I481 HydrophobicContact CG2-CG1 4.27Å; I477-I481 WeakPolarHBondContact O-CG1 3.47Å; I477-I481 PolarHBondContact O-N 2.89Å |
| 478 | M | 92.7 | Very high | 85.4 | Confident | 0 Ų | 0 | 41.9 Ų | 41.9 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -61.8 | -39.4 | 177.5 | -64.7 | -53.2 | 144.7 | 0 | 0 | 111.4 | L90 I93 T94 Y97 I370 V374 A474 H480 I481 C482 | L90-M478 HydrophobicContact CD1-CB 3.91Å; L90-M478 HydrophobicContact CD1-CG 4.36Å; I93-M478 HydrophobicContact CB-SD 4.24Å; I93-M478 HydrophobicContact CG2-CE 3.94Å; I93-M478 HydrophobicContact CG2-SD 3.64Å; T94-M478 WeakPolarHBondContact OG1-CG 3.14Å; T94-M478 PolarHBondContact OG1-SD 2.85Å; Y97-M478 VanDerWaalsContact CB-CE 3.48Å; Y97-M478 HydrophobicContact CD1-CE 4.21Å; Y97-M478 HydrophobicContact CD2-CE 4.35Å; Y97-M478 HydrophobicContact CG-CE 3.76Å; I370-M478 HydrophobicContact CG2-CB 4.12Å; V374-M478 HydrophobicContact CG2-CB 4.19Å; V374-M478 HydrophobicContact CG2-CG 4.13Å; A474-M478 VanDerWaalsContact O-CG 3.29Å; A474-M478 WeakPolarHBondContact O-CG 3.31Å; A474-M478 PolarHBondContact O-N 3.45Å; M478-H480 VanDerWaalsContact C-N 3.25Å; M478-H480 PolarHBondContact O-N 2.99Å; M478-I481 PolarHBondContact O-N 2.94Å; M478-C482 WeakPolarHBondContact O-CB 3.36Å; M478-C482 PolarHBondContact O-N 3Å |
| 479 | A | 91.4 | Very high | 83.3 | Confident | 20 Ų | 20 | 48.6 Ų | 48.6 | 17% | 0.165 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -60.5 | -34.1 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | I366 I370 T475 I477 R483 | I366-A479 HydrophobicContact CD1-CB 3.92Å; I366-A479 HydrophobicContact CG2-CB 3.82Å; I370-A479 HydrophobicContact CD1-CB 3.89Å; T475-A479 WeakPolarHBondContact O-CB 3.4Å; T475-A479 PolarHBondContact O-N 2.98Å; I477-A479 VanDerWaalsContact C-N 3.29Å; I477-A479 PolarHBondContact O-N 2.9Å; A479-R483 PolarHBondContact O-N 3.46Å |
| 480 | H | 91.8 | Very high | 80.9 | Confident | 75 Ų | 75 | 50.4 Ų | 50.4 | 35% | 0.347 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -74.2 | -48.5 | 174.7 | -174.7 | 79.7 | 0 | 0 | 0 | 112.3 | T325 G476 I477 M478 R483 | T325-H480 HydrophobicContact CG2-CB 3.86Å; G476-H480 PolarHBondContact O-N 2.94Å; G476-H480 VanDerWaalsContact O-N 3.14Å; I477-H480 WeakPolarHBondContact O-CA 3.26Å; I477-H480 WeakPolarHBondContact O-CB 3.43Å; I477-H480 PolarHBondContact O-N 3.33Å; M478-H480 VanDerWaalsContact C-N 3.25Å; M478-H480 PolarHBondContact O-N 2.99Å; H480-R483 WeakPolarHBondContact O-CB 3.33Å; H480-R483 PolarHBondContact O-N 3.17Å |
| 481 | I | 90.3 | Very high | 78.2 | Confident | 59 Ų | 59 | 57.4 Ų | 57.4 | 30% | 0.303 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -65.6 | -46.1 | -176.1 | -66.5 | 173.1 | 0 | 0 | 0 | 111.1 | I93 I324 I477 M478 R483 | I93-I481 HydrophobicContact CD1-CG2 4.15Å; I93-I481 HydrophobicContact CG2-CD1 4.28Å; I324-I481 HydrophobicContact CG2-CD1 4.11Å; I324-I481 HydrophobicContact CG2-CG1 4.16Å; I477-I481 HydrophobicContact CG2-CD1 3.6Å; I477-I481 HydrophobicContact CG2-CG1 4.27Å; I477-I481 WeakPolarHBondContact O-CG1 3.47Å; I477-I481 PolarHBondContact O-N 2.89Å; M478-I481 PolarHBondContact O-N 2.94Å; I481-R483 VanDerWaalsContact C-N 3.3Å; I481-R483 PolarHBondContact O-N 3.35Å |
| 482 | C | 84.1 | Confident | 75.3 | Confident | 1 Ų | 1 | 60.5 Ų | 60.5 | 1% | 0.007 | 32% | 0.315 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -88.6 | 7.4 | -176 | -65.9 | 0 | 0 | 0 | 0 | 113.4 | L90 M478 K484 D485 F486 | L90-C482 HydrophobicContact CD1-CB 4.2Å; L90-C482 VanDerWaalsContact CD1-SG 3.57Å; M478-C482 WeakPolarHBondContact O-CB 3.36Å; M478-C482 PolarHBondContact O-N 3Å; C482-K484 PolarHBondContact O-N 2.87Å; C482-K484 VanDerWaalsContact O-N 3.11Å; C482-D485 PolarHBondContact O-N 3.38Å; C482-F486 HydrophobicContact CB-CD2 3.84Å; C482-F486 HydrophobicContact CB-CE2 3.5Å; C482-F486 VanDerWaalsContact CB-CE2 3.5Å; C482-F486 WeakPolarHBondContact O-CD2 3.49Å; C482-F486 PolarHBondContact O-N 3.02Å |
| 483 | R | 79.7 | Confident | 72.2 | Confident | 153 Ų | 153 | 66 Ų | 66 | 58% | 0.577 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -50.6 | -40.8 | -179.4 | -172.2 | 179.3 | 178.4 | -173.3 | 0.8 | 112.8 | A479 H480 I481 D485 F486 M487 | A479-R483 PolarHBondContact O-N 3.46Å; H480-R483 WeakPolarHBondContact O-CB 3.33Å; H480-R483 PolarHBondContact O-N 3.17Å; I481-R483 VanDerWaalsContact C-N 3.3Å; I481-R483 PolarHBondContact O-N 3.35Å; R483-D485 VanDerWaalsContact C-N 3.32Å; R483-D485 PolarHBondContact O-N 3.08Å; R483-F486 PolarHBondContact O-N 2.92Å; R483-M487 HydrophobicContact CG-CG 4.46Å; R483-M487 HydrophobicContact CG-SD 4Å; R483-M487 VanDerWaalsContact O-CG 3.26Å; R483-M487 WeakPolarHBondContact O-CG 3.42Å; R483-M487 PolarHBondContact O-N 3.33Å; R483-M487 VanDerWaalsContact O-N 3.09Å |
| 484 | K | 69.4 | Low | 69.1 | Low | 167 Ų | 167 | 71.1 Ų | 71.1 | 73% | 0.726 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -69.1 | -29 | -179.5 | -66 | -176.5 | -179.6 | 178.2 | 0 | 113.5 | C482 | C482-K484 PolarHBondContact O-N 2.87Å; C482-K484 VanDerWaalsContact O-N 3.11Å |
| 485 | D | 69.1 | Low | 66.4 | Low | 55 Ų | 55 | 78.9 Ų | 78.9 | 29% | 0.294 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -77.2 | -36.4 | -178.7 | -56.5 | -31.9 | 0 | 0 | 0 | 109.8 | R89 C482 R483 | R89-D485 IonicContact CZ-OD1 2.97Å; R89-D485 IonicContact CZ-OD2 2.71Å; R89-D485 IonicContact NE-OD2 3.26Å; R89-D485 VanDerWaalsContact NH1-CG 3.32Å; R89-D485 IonicContact NH1-OD1 3.88Å; R89-D485 PolarHBondContact NH1-OD1 2.95Å; R89-D485 IonicContact NH1-OD2 3.87Å; R89-D485 PolarHBondContact NH1-OD2 3Å; R89-D485 IonicContact NH2-OD2 3.99Å; C482-D485 PolarHBondContact O-N 3.38Å; R483-D485 VanDerWaalsContact C-N 3.32Å; R483-D485 PolarHBondContact O-N 3.08Å |
| 486 | F | 64.3 | Low | 63.4 | Low | 41 Ų | 41 | 85 Ų | 85 | 18% | 0.18 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -84.3 | -19.6 | 179 | -65.5 | -65.8 | 0 | 0 | 0 | 115.3 | L90 I370 C482 R483 | L90-F486 HydrophobicContact CD2-CZ 4.09Å; I370-F486 HydrophobicContact CD1-CD2 3.65Å; I370-F486 HydrophobicContact CD1-CE2 3.54Å; I370-F486 HydrophobicContact CD1-CZ 4.38Å; I370-F486 HydrophobicContact CG1-CD2 4.05Å; I370-F486 HydrophobicContact CG1-CE2 3.58Å; I370-F486 HydrophobicContact CG1-CZ 3.93Å; C482-F486 HydrophobicContact CB-CD2 3.84Å; C482-F486 HydrophobicContact CB-CE2 3.5Å; C482-F486 VanDerWaalsContact CB-CE2 3.5Å; C482-F486 WeakPolarHBondContact O-CD2 3.49Å; C482-F486 PolarHBondContact O-N 3.02Å; R483-F486 PolarHBondContact O-N 2.92Å |
| 487 | M | 57.4 | Low | 60.4 | Low | 105 Ų | 105 | 90.3 Ų | 90.3 | 52% | 0.517 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -71.8 | -31 | 171.9 | -75.4 | 179.1 | 75.7 | 0 | 0 | 112.2 | R483 E489 G490 | R483-M487 HydrophobicContact CG-CG 4.46Å; R483-M487 HydrophobicContact CG-SD 4Å; R483-M487 VanDerWaalsContact O-CG 3.26Å; R483-M487 WeakPolarHBondContact O-CG 3.42Å; R483-M487 PolarHBondContact O-N 3.33Å; R483-M487 VanDerWaalsContact O-N 3.09Å; M487-E489 VanDerWaalsContact C-N 3.32Å; M487-E489 PolarHBondContact O-N 3.25Å; M487-G490 PolarHBondContact O-N 3.01Å |
| 488 | K | 49.2 | Very low | 57.5 | Low | 182 Ų | 182 | 99.3 Ų | 99.3 | 79% | 0.791 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.9 | -25.2 | 179.4 | -75.5 | -177.7 | 176 | -176.5 | 0 | 114.2 | ||
| 489 | E | 49.9 | Very low | 54.5 | Low | 145 Ų | 145 | 103.8 Ų | 103.8 | 68% | 0.678 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.3 | -11.6 | 174.7 | -94.4 | 178.7 | 167.2 | 0 | 0 | 113.4 | R369 M487 | R369-E489 IonicContact NH1-OE2 3.1Å; R369-E489 PolarHBondContact NH1-OE2 3.24Å; M487-E489 VanDerWaalsContact C-N 3.32Å; M487-E489 PolarHBondContact O-N 3.25Å |
| 490 | G | 44.6 | Very low | 51.4 | Low | 44 Ų | 44 | 112.3 Ų | 112.3 | 45% | 0.454 | 61% | 0.607 | S | S | . | * | trans | -115.3 | 5.7 | -167.4 | 0 | 0 | 0 | 0 | 0 | 116.2 | M487 G492 | M487-G490 PolarHBondContact O-N 3.01Å; G490-G492 PolarHBondContact O-N 3.37Å | ||
| 491 | D | 40.2 | Very low | 48.5 | Very low | 146 Ų | 146 | 116 Ų | 116 | 78% | 0.781 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.3 | 80.1 | -178.9 | -102.8 | -7.2 | 0 | 0 | 0 | 112 | ||
| 492 | G | 33.5 | Very low | 45.5 | Very low | 72 Ų | 72 | 118.9 Ų | 118.9 | 74% | 0.742 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -134.2 | -2.5 | 153.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | G490 | G490-G492 PolarHBondContact O-N 3.37Š|
| 493 | V | 32.2 | Very low | 43.2 | Very low | 117 Ų | 117 | 125.9 Ų | 125.9 | 71% | 0.709 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -151.3 | 123 | 172.4 | -171.5 | 0 | 0 | 0 | 0 | 110.7 | ||
| 494 | P | 32 | Very low | 40.7 | Very low | 108 Ų | 108 | 125.7 Ų | 125.7 | 70% | 0.701 | 70% | 0.697 | S | S | * | * | trans | -69.9 | 130.8 | 172.4 | -11.3 | 26.3 | 0 | 0 | 0 | 111.1 | V496 | P494-V496 PolarHBondContact O-N 2.97Å; P494-V496 VanDerWaalsContact O-N 3.16Å | ||
| 495 | L | 37.7 | Very low | 39.2 | Very low | 163 Ų | 163 | 123.6 Ų | 123.6 | 85% | 0.853 | 70% | 0.7 | S | S | * | * | trans | -66.9 | 106.7 | 166 | -86.7 | 159.4 | 0 | 0 | 0 | 109.5 | C497 | L495-C497 PolarHBondContact O-N 3.46Å; L495-C497 VanDerWaalsContact O-N 3.12Å | ||
| 496 | V | 30.9 | Very low | 37.4 | Very low | 127 Ų | 127 | 126.6 Ų | 126.6 | 77% | 0.77 | 72% | 0.723 | S | S | * | * | trans | -68.8 | 102.6 | 170.4 | 177.6 | 0 | 0 | 0 | 0 | 108.8 | P494 | P494-V496 PolarHBondContact O-N 2.97Å; P494-V496 VanDerWaalsContact O-N 3.16Å | ||
| 497 | C | 31.5 | Very low | 35.9 | Very low | 116 Ų | 116 | 130.2 Ų | 130.2 | 78% | 0.784 | 75% | 0.751 | S | S | * | * | trans | -130.3 | 73.9 | 161.6 | -86.4 | 0 | 0 | 0 | 0 | 109 | L495 | L495-C497 PolarHBondContact O-N 3.46Å; L495-C497 VanDerWaalsContact O-N 3.12Å | ||
| 498 | E | 36.3 | Very low | 34.6 | Very low | 189 Ų | 189 | 131.6 Ų | 131.6 | 88% | 0.883 | 77% | 0.765 | S | S | * | * | trans | -165.3 | 99 | 148.6 | -116.5 | 161.2 | 164.3 | 0 | 0 | 108.8 | ||||
| 499 | A | 28.1 | Very low | 33.4 | Very low | 95 Ų | 95 | 131.8 Ų | 131.8 | 79% | 0.785 | 77% | 0.771 | S | S | * | * | trans | -118 | 87 | 168.1 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 500 | K | 28.1 | Very low | 32.3 | Very low | 199 Ų | 199 | 132.1 Ų | 132.1 | 87% | 0.865 | 78% | 0.777 | S | S | * | * | trans | -68.6 | 124.5 | 150.3 | -133.6 | 174.9 | -173.5 | 177.1 | 0 | 105.8 | P502 | K500-P502 VanDerWaalsContact O-CD 3.28Å; K500-P502 WeakPolarHBondContact O-CD 3.47Å | ||
| 501 | I | 30 | Very low | 31.4 | Very low | 153 Ų | 153 | 136 Ų | 136 | 79% | 0.785 | 80% | 0.796 | S | S | * | * | trans | -67.2 | 133.5 | 177.1 | -60.1 | 165.6 | 0 | 0 | 0 | 109.1 | ||||
| 502 | P | 27.9 | Very low | 30.8 | Very low | 118 Ų | 118 | 137.8 Ų | 137.8 | 77% | 0.766 | 80% | 0.799 | S | S | * | * | trans | -119.3 | 132 | 147.8 | 10.3 | 12.5 | 0 | 0 | 0 | 110.9 | K500 | K500-P502 VanDerWaalsContact O-CD 3.28Å; K500-P502 WeakPolarHBondContact O-CD 3.47Å | ||
| 503 | L | 34.9 | Very low | 30.6 | Very low | 148 Ų | 148 | 142.2 Ų | 142.2 | 78% | 0.775 | 81% | 0.806 | S | S | * | * | trans | -58.8 | 127.5 | 167.2 | -93.4 | 72.8 | 0 | 0 | 0 | 110.9 | ||||
| 504 | N | 27 | Very low | 30.4 | Very low | 149 Ų | 149 | 143.1 Ų | 143.1 | 80% | 0.797 | 81% | 0.807 | S | S | * | * | trans | 158.3 | 137.8 | 131.8 | -80.5 | -14.2 | 0 | 0 | 0 | 111.2 | ||||
| 505 | P | 37.8 | Very low | 30.3 | Very low | 123 Ų | 123 | 145.8 Ų | 145.8 | 80% | 0.799 | 82% | 0.816 | S | S | * | * | trans | -97.1 | 148.8 | 173.2 | 36.9 | -29.1 | 0 | 0 | 0 | 111.6 | ||||
| 506 | P | 31.3 | Very low | 29.9 | Very low | 118 Ų | 118 | 141.7 Ų | 141.7 | 77% | 0.766 | 81% | 0.813 | S | S | * | * | -152.5 | -177.9 | 127.8 | 39.9 | -22.6 | 0 | 0 | 0 | 113.3 | |||||
| 507 | P | 33.3 | Very low | 29.7 | Very low | 117 Ų | 117 | 143.1 Ų | 143.1 | 76% | 0.76 | 82% | 0.816 | S | S | * | * | -120 | 163.2 | -63.5 | 34.4 | -19.1 | 0 | 0 | 0 | 112.1 | |||||
| 508 | T | 29.4 | Very low | 29.5 | Very low | 135 Ų | 135 | 143.1 Ų | 143.1 | 83% | 0.828 | 81% | 0.812 | S | S | * | * | trans | -59.6 | 130.2 | 169.4 | 41.2 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 509 | M | 25.3 | Very low | 28.9 | Very low | 186 Ų | 186 | 145 Ų | 145 | 92% | 0.916 | 81% | 0.811 | S | S | * | * | trans | -109.8 | 103.2 | 166.8 | -141.5 | 175.7 | -173.7 | 0 | 0 | 109.3 | ||||
| 510 | N | 25.7 | Very low | 29 | Very low | 151 Ų | 151 | 146.3 Ų | 146.3 | 81% | 0.807 | 81% | 0.811 | S | S | * | * | trans | -77.7 | 128.4 | 167.3 | -87 | -20.2 | 0 | 0 | 0 | 109.2 | ||||
| 511 | C | 27.1 | Very low | 29 | Very low | 125 Ų | 125 | 142.4 Ų | 142.4 | 85% | 0.845 | 81% | 0.806 | S | S | * | * | trans | -131.3 | 97.9 | 155.6 | -83.2 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 512 | H | 26.4 | Very low | 28.6 | Very low | 184 Ų | 184 | 139.8 Ų | 139.8 | 85% | 0.852 | 80% | 0.802 | S | S | * | * | trans | -75.5 | 136.4 | 154 | -104.3 | 21.5 | 0 | 0 | 0 | 108.3 | ||||
| 513 | N | 29.5 | Very low | 28.6 | Very low | 166 Ų | 166 | 140 Ų | 140 | 89% | 0.888 | 81% | 0.806 | S | S | * | * | trans | -146.7 | 126.9 | 146.9 | -138.7 | 3.4 | 0 | 0 | 0 | 111.7 | ||||
| 514 | N | 28.9 | Very low | 28.2 | Very low | 136 Ų | 136 | 136.7 Ų | 136.7 | 73% | 0.727 | 81% | 0.807 | S | S | * | * | trans | -84.8 | 129.8 | 174.8 | -91.6 | -20.1 | 0 | 0 | 0 | 109.7 | ||||
| 515 | N | 30.1 | Very low | 28.2 | Very low | 164 Ų | 164 | 136.5 Ų | 136.5 | 88% | 0.877 | 81% | 0.812 | S | S | * | * | trans | 158 | 138 | 130.3 | -85.3 | -12.4 | 0 | 0 | 0 | 111.1 | ||||
| 516 | G | 29.3 | Very low | 27.6 | Very low | 77 Ų | 77 | 140.2 Ų | 140.2 | 79% | 0.794 | 82% | 0.815 | S | S | * | * | trans | -75.8 | 170.5 | -168.2 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 517 | N | 25.5 | Very low | 27.3 | Very low | 157 Ų | 157 | 143.5 Ų | 143.5 | 84% | 0.84 | 82% | 0.82 | S | S | * | * | trans | 97.5 | 102.7 | 167.4 | -80.6 | -4.6 | 0 | 0 | 0 | 120.4 | ||||
| 518 | V | 27.2 | Very low | 27.2 | Very low | 116 Ų | 116 | 147.3 Ų | 147.3 | 70% | 0.703 | 83% | 0.825 | S | S | * | * | 93.2 | 131.2 | 122 | 177.7 | 0 | 0 | 0 | 0 | 120.3 | |||||
| 519 | R | 24.4 | Very low | 27.4 | Very low | 229 Ų | 229 | 148.9 Ų | 148.9 | 86% | 0.864 | 83% | 0.827 | S | S | * | * | trans | 94.9 | 128.7 | 158.2 | -89.5 | 169.2 | -167.4 | -165.5 | 4.2 | 119.1 | ||||
| 520 | P | 29.8 | Very low | 28 | Very low | 121 Ų | 121 | 145.3 Ų | 145.3 | 79% | 0.786 | 81% | 0.811 | S | S | * | * | trans | -89.2 | 144.1 | 168.9 | 35.6 | -28.9 | 0 | 0 | 0 | 110.5 | ||||
| 521 | P | 27.5 | Very low | 28.9 | Very low | 117 Ų | 117 | 141.8 Ų | 141.8 | 76% | 0.76 | 80% | 0.796 | S | S | * | * | trans | -109.7 | 116.9 | 156.5 | 24.3 | -7.9 | 0 | 0 | 0 | 111.3 | ||||
| 522 | S | 22.8 | Very low | 29.6 | Very low | 99 Ų | 99 | 140.8 Ų | 140.8 | 69% | 0.692 | 79% | 0.788 | S | S | * | * | trans | 36 | 114.8 | 133.6 | 60.7 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 523 | S | 28.3 | Very low | 30.3 | Very low | 122 Ų | 122 | 137.5 Ų | 137.5 | 85% | 0.853 | 78% | 0.777 | S | S | * | * | 24.8 | 118.8 | 125.8 | 61.4 | 0 | 0 | 0 | 0 | 119.4 | |||||
| 524 | G | 26.6 | Very low | 31.1 | Very low | 78 Ų | 78 | 133 Ų | 133 | 80% | 0.804 | 75% | 0.754 | S | S | * | * | trans | 173.7 | 65 | 159.3 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 525 | V | 25.7 | Very low | 31.8 | Very low | 146 Ų | 146 | 128.9 Ų | 128.9 | 89% | 0.885 | 74% | 0.74 | S | S | * | * | trans | -139.1 | 125.6 | 153.5 | -174.4 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 526 | K | 25.4 | Very low | 32.3 | Very low | 201 Ų | 201 | 130.1 Ų | 130.1 | 87% | 0.874 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -66 | 129.4 | -171.9 | -66 | 171.3 | 176 | 176.4 | 0 | 112.3 | K528 | K526-K528 PolarHBondContact O-N 2.93Š|
| 527 | H | 25.7 | Very low | 32.9 | Very low | 186 Ų | 186 | 132 Ų | 132 | 86% | 0.861 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 126.1 | 160.8 | -89 | -86.1 | 0 | 0 | 0 | 110 | ||
| 528 | K | 30.6 | Very low | 33.8 | Very low | 198 Ų | 198 | 129.6 Ų | 129.6 | 86% | 0.861 | 71% | 0.709 | S | S | * | * | P | Polyproline II helix | trans | -95.8 | 131.4 | 156 | -93.7 | -177 | 175.4 | -179.2 | 0 | 108.5 | K526 | K526-K528 PolarHBondContact O-N 2.93Š|
| 529 | L | 34 | Very low | 34.4 | Very low | 168 Ų | 168 | 131.5 Ų | 131.5 | 88% | 0.88 | 71% | 0.71 | S | S | * | * | P | Polyproline II helix | trans | -47.8 | 128.6 | -175.6 | -101.4 | 65.6 | 0 | 0 | 0 | 113.7 | ||
| 530 | I | 37.6 | Very low | 35.2 | Very low | 111 Ų | 111 | 126.5 Ų | 126.5 | 57% | 0.569 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -86.3 | 129.1 | 161 | -63.7 | 172.6 | 0 | 0 | 0 | 107 | V534 | I530-V534 HydrophobicContact CG2-CB 3.61Å; I530-V534 HydrophobicContact CG2-CG1 3.75Å |
| 531 | P | 44.7 | Very low | 35.6 | Very low | 77 Ų | 77 | 128 Ų | 128 | 50% | 0.5 | 70% | 0.696 | S | S | . | * | P | Polyproline II helix | trans | -60.1 | 145.2 | 175.6 | -22.4 | 33 | 0 | 0 | 0 | 111.9 | D533 V534 | P531-D533 PolarHBondContact O-N 2.86Å; P531-V534 PolarHBondContact O-N 3.06Å |
| 532 | P | 41.7 | Very low | 36 | Very low | 104 Ų | 104 | 130.2 Ų | 130.2 | 68% | 0.675 | 70% | 0.696 | S | S | * | * | H | α-helix | trans | -59.1 | -24.3 | -171.8 | 21.2 | -31.8 | 0 | 0 | 0 | 114.2 | R536 | P532-R536 PolarHBondContact O-N 3.11Å |
| 533 | D | 41.9 | Very low | 36.5 | Very low | 115 Ų | 115 | 128.6 Ų | 128.6 | 62% | 0.615 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -74 | -26.7 | 178.7 | -59.9 | -32.9 | 0 | 0 | 0 | 113.1 | P531 L537 | P531-D533 PolarHBondContact O-N 2.86Å; D533-L537 PolarHBondContact O-N 3.31Å |
| 534 | V | 45.7 | Very low | 36.7 | Very low | 70 Ų | 70 | 128.6 Ų | 128.6 | 42% | 0.424 | 69% | 0.69 | S | S | . | * | H | α-helix | trans | -80 | -34 | 178.7 | -179.5 | 0 | 0 | 0 | 0 | 110.7 | I530 P531 R536 L537 M538 | I530-V534 HydrophobicContact CG2-CB 3.61Å; I530-V534 HydrophobicContact CG2-CG1 3.75Å; P531-V534 PolarHBondContact O-N 3.06Å; V534-R536 VanDerWaalsContact C-N 3.32Å; V534-R536 PolarHBondContact O-N 3.07Å; V534-L537 PolarHBondContact O-N 3.22Å; V534-M538 WeakPolarHBondContact O-CG 3.44Å; V534-M538 PolarHBondContact O-N 3.21Å; V534-M538 VanDerWaalsContact O-N 3.13Å |
| 535 | A | 43.4 | Very low | 36.7 | Very low | 51 Ų | 51 | 133.2 Ų | 133.2 | 42% | 0.421 | 69% | 0.691 | S | S | . | * | H | α-helix | trans | -65.6 | -34.6 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q539 | A535-Q539 PolarHBondContact O-N 3.28Å |
| 536 | R | 41.6 | Very low | 36.8 | Very low | 189 Ų | 189 | 135.6 Ų | 135.6 | 71% | 0.713 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -69.2 | -34.5 | 175.3 | -109.6 | -176.7 | 179.7 | -178.8 | 0.3 | 113.3 | P532 V534 L540 | P532-R536 PolarHBondContact O-N 3.11Å; V534-R536 VanDerWaalsContact C-N 3.32Å; V534-R536 PolarHBondContact O-N 3.07Å; R536-L540 PolarHBondContact O-N 3.35Å |
| 537 | L | 41.5 | Very low | 36.9 | Very low | 116 Ų | 116 | 133.2 Ų | 133.2 | 61% | 0.607 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -74.6 | -36.5 | 178.1 | -80.6 | 162 | 0 | 0 | 0 | 112.4 | D533 V534 Q539 L540 E541 | D533-L537 PolarHBondContact O-N 3.31Å; V534-L537 PolarHBondContact O-N 3.22Å; L537-Q539 VanDerWaalsContact C-N 3.33Å; L537-Q539 PolarHBondContact O-N 3.17Å; L537-L540 PolarHBondContact O-N 3.35Å; L537-E541 PolarHBondContact O-N 3.22Å; L537-E541 VanDerWaalsContact O-N 3.16Å |
| 538 | M | 43.3 | Very low | 36.9 | Very low | 108 Ų | 108 | 130 Ų | 130 | 53% | 0.532 | 69% | 0.686 | S | S | . | * | H | α-helix | trans | -64.7 | -35.7 | 175.3 | -70.7 | -175.1 | 74.6 | 0 | 0 | 112.5 | V534 L540 E541 E542 | V534-M538 WeakPolarHBondContact O-CG 3.44Å; V534-M538 PolarHBondContact O-N 3.21Å; V534-M538 VanDerWaalsContact O-N 3.13Å; M538-L540 VanDerWaalsContact C-N 3.3Å; M538-L540 PolarHBondContact O-N 3.16Å; M538-E541 PolarHBondContact O-N 3.42Å; M538-E542 PolarHBondContact O-N 3.36Å |
| 539 | Q | 40.6 | Very low | 36.9 | Very low | 155 Ų | 155 | 127.5 Ų | 127.5 | 72% | 0.724 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -70 | -22.6 | 175.3 | -75.7 | -175.4 | -17.9 | 0 | 0 | 114 | A535 L537 | A535-Q539 PolarHBondContact O-N 3.28Å; L537-Q539 VanDerWaalsContact C-N 3.33Å; L537-Q539 PolarHBondContact O-N 3.17Å |
| 540 | L | 40.4 | Very low | 36.6 | Very low | 125 Ų | 125 | 129.1 Ų | 129.1 | 65% | 0.654 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -84.6 | -26.8 | 175.4 | -79.5 | 162 | 0 | 0 | 0 | 112.4 | R536 L537 M538 | R536-L540 PolarHBondContact O-N 3.35Å; L537-L540 PolarHBondContact O-N 3.35Å; M538-L540 VanDerWaalsContact C-N 3.3Å; M538-L540 PolarHBondContact O-N 3.16Å |
| 541 | E | 39.4 | Very low | 36.3 | Very low | 153 Ų | 153 | 133.6 Ų | 133.6 | 72% | 0.715 | 70% | 0.697 | S | S | * | * | H | α-helix | trans | -80.8 | -30.3 | -179.5 | -150.7 | 165.4 | -166.9 | 0 | 0 | 112.3 | L537 M538 G543 | L537-E541 PolarHBondContact O-N 3.22Å; L537-E541 VanDerWaalsContact O-N 3.16Å; M538-E541 PolarHBondContact O-N 3.42Å; E541-G543 VanDerWaalsContact C-N 3.26Å; E541-G543 PolarHBondContact O-N 2.8Å |
| 542 | E | 35.2 | Very low | 35.4 | Very low | 163 Ų | 163 | 139.7 Ų | 139.7 | 76% | 0.762 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.2 | -13.7 | 172.6 | -74.8 | -177.1 | 163.6 | 0 | 0 | 113.9 | M538 | M538-E542 PolarHBondContact O-N 3.36Š|
| 543 | G | 33.8 | Very low | 34.8 | Very low | 65 Ų | 65 | 140.2 Ų | 140.2 | 67% | 0.67 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.6 | -4.5 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | E541 | E541-G543 VanDerWaalsContact C-N 3.26Å; E541-G543 PolarHBondContact O-N 2.8Å |
| 544 | V | 31.8 | Very low | 34.8 | Very low | 122 Ų | 122 | 140.4 Ų | 140.4 | 74% | 0.739 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -118.6 | -2 | -168.5 | -178 | 0 | 0 | 0 | 0 | 114.3 | Q546 | V544-Q546 PolarHBondContact O-N 3.4Š|
| 545 | Q | 27.6 | Very low | 34 | Very low | 175 Ų | 175 | 144.9 Ų | 144.9 | 82% | 0.818 | 75% | 0.747 | S | S | * | * | trans | -94.8 | 89.1 | 174.7 | -89.5 | 171 | -19 | 0 | 0 | 112.7 | I547 | Q545-I547 PolarHBondContact O-N 2.79Š| ||
| 546 | Q | 27.2 | Very low | 33.5 | Very low | 195 Ų | 195 | 147.8 Ų | 147.8 | 91% | 0.911 | 76% | 0.761 | S | S | * | * | trans | -70.5 | 117.6 | 163.1 | -89.2 | -176.1 | -21.4 | 0 | 0 | 110.8 | V544 | V544-Q546 PolarHBondContact O-N 3.4Š| ||
| 547 | I | 27.9 | Very low | 33.3 | Very low | 151 Ų | 151 | 144.6 Ų | 144.6 | 77% | 0.774 | 77% | 0.765 | S | S | * | * | trans | -71.6 | 122.9 | 168.5 | -66.2 | 167.9 | 0 | 0 | 0 | 108.7 | Q545 | Q545-I547 PolarHBondContact O-N 2.79Š| ||
| 548 | S | 25.5 | Very low | 32.7 | Very low | 120 Ų | 120 | 151.1 Ų | 151.1 | 84% | 0.839 | 78% | 0.781 | S | S | * | * | trans | -83.5 | 115.3 | 170.2 | -176.4 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 549 | D | 29.6 | Very low | 31.9 | Very low | 145 Ų | 145 | 156.2 Ų | 156.2 | 78% | 0.775 | 80% | 0.796 | S | S | * | * | trans | -126 | 144.6 | 171.5 | -109.5 | -31.1 | 0 | 0 | 0 | 113.9 | ||||
| 550 | K | 29.3 | Very low | 31.3 | Very low | 202 Ų | 202 | 155.9 Ų | 155.9 | 88% | 0.878 | 80% | 0.799 | S | S | * | * | trans | -74.6 | 151.3 | -162 | -74 | 167.2 | 173.1 | 168 | 0 | 114.7 | ||||
| 551 | K | 29.8 | Very low | 30.7 | Very low | 205 Ų | 205 | 159.2 Ų | 159.2 | 89% | 0.891 | 81% | 0.808 | S | S | * | * | trans | -46 | 143.3 | 172.6 | -74.7 | 174.2 | 169.6 | 176.2 | 0 | 116.8 | ||||
| 552 | K | 26.2 | Very low | 30.1 | Very low | 204 Ų | 204 | 161.8 Ų | 161.8 | 89% | 0.887 | 82% | 0.817 | S | S | * | * | trans | -168.9 | 165.2 | 134.8 | -111.2 | 176.5 | -172.1 | -175.5 | 0 | 112 | ||||
| 553 | P | 30.3 | Very low | 29.7 | Very low | 116 Ų | 116 | 160 Ų | 160 | 75% | 0.753 | 82% | 0.822 | S | S | * | * | -106.5 | -179.4 | -110 | 41.5 | -31 | 0 | 0 | 0 | 115.8 | |||||
| 554 | P | 40.4 | Very low | 29.5 | Very low | 119 Ų | 119 | 166.1 Ų | 166.1 | 77% | 0.773 | 83% | 0.83 | S | S | * | * | trans | -106.2 | 141.4 | -163.3 | 37.7 | -28.2 | 0 | 0 | 0 | 115.1 | ||||
| 555 | I | 30.2 | Very low | 29.3 | Very low | 164 Ų | 164 | 169.4 Ų | 169.4 | 84% | 0.841 | 84% | 0.837 | S | S | * | * | trans | -154.1 | 160.4 | 162.9 | -22.7 | 175.7 | 0 | 0 | 0 | 109.5 | ||||
| 556 | P | 32.5 | Very low | 29.3 | Very low | 111 Ų | 111 | 169.7 Ų | 169.7 | 72% | 0.721 | 84% | 0.838 | S | S | * | * | -117.9 | -176.7 | -101.4 | 42.2 | -23.3 | 0 | 0 | 0 | 113.4 | |||||
| 557 | P | 36.9 | Very low | 29.4 | Very low | 122 Ų | 122 | 166.8 Ų | 166.8 | 79% | 0.792 | 84% | 0.838 | S | S | * | * | trans | -87.9 | 146.7 | -163.3 | 34.9 | -30.9 | 0 | 0 | 0 | 113.4 | ||||
| 558 | R | 28.3 | Very low | 29.4 | Very low | 253 Ų | 253 | 165.9 Ų | 165.9 | 96% | 0.955 | 84% | 0.84 | S | S | * | * | trans | -131.7 | 133.6 | 163.4 | -91.9 | -174.9 | 175.5 | 174.3 | -0.6 | 112 | ||||
| 559 | Y | 28.1 | Very low | 29.6 | Very low | 216 Ų | 216 | 168.3 Ų | 168.3 | 85% | 0.847 | 84% | 0.842 | S | S | * | * | trans | -74 | 164.4 | -177.9 | -101 | -103.1 | 0 | 0 | 0 | 114.5 | ||||
| 560 | L | 27.6 | Very low | 29.5 | Very low | 148 Ų | 148 | 168.4 Ų | 168.4 | 78% | 0.775 | 84% | 0.842 | S | S | * | * | trans | 80.3 | 137.1 | 163.3 | -65.3 | 126.4 | 0 | 0 | 0 | 115.3 | ||||
| 561 | K | 26.5 | Very low | 29.6 | Very low | 195 Ų | 195 | 167 Ų | 167 | 85% | 0.848 | 84% | 0.841 | S | S | * | * | cis | -165.3 | 158.1 | 28.1 | -144.2 | 169.5 | -176.1 | 179.8 | 0 | 110.5 | ||||
| 562 | K | 26.7 | Very low | 29.7 | Very low | 207 Ų | 207 | 165.4 Ų | 165.4 | 90% | 0.9 | 84% | 0.842 | S | S | * | * | trans | -48.9 | 147.2 | 176.2 | -71.7 | 169 | 168.1 | 172.4 | 0 | 116.5 | ||||
| 563 | S | 27.1 | Very low | 29.9 | Very low | 125 Ų | 125 | 158.7 Ų | 158.7 | 87% | 0.874 | 83% | 0.83 | S | S | * | * | -150.2 | 141.6 | 127.8 | 65.1 | 0 | 0 | 0 | 0 | 111 | |||||
| 564 | K | 29.3 | Very low | 29.8 | Very low | 193 Ų | 193 | 161 Ų | 161 | 84% | 0.839 | 84% | 0.835 | S | S | * | * | trans | -91 | 150.8 | 177.1 | -76.6 | 175.5 | 168.5 | -177.6 | 0 | 109.5 | ||||
| 565 | E | 28.8 | Very low | 29.6 | Very low | 191 Ų | 191 | 163.5 Ų | 163.5 | 89% | 0.893 | 84% | 0.837 | S | S | * | * | trans | -178.5 | 98.7 | 141.1 | -99.8 | 166.9 | -149.7 | 0 | 0 | 107.7 | ||||
| 566 | H | 27.7 | Very low | 29.9 | Very low | 181 Ų | 181 | 161.4 Ų | 161.4 | 84% | 0.838 | 83% | 0.832 | S | S | * | * | 50.9 | 110.8 | 109.1 | -86.2 | 46.4 | 0 | 0 | 0 | 116.5 | |||||
| 567 | C | 27.8 | Very low | 30.1 | Very low | 134 Ų | 134 | 163.7 Ų | 163.7 | 91% | 0.905 | 84% | 0.838 | S | S | * | * | trans | -161.2 | 115.3 | 139.6 | -122.7 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 568 | T | 28.2 | Very low | 30.2 | Very low | 132 Ų | 132 | 168 Ų | 168 | 81% | 0.81 | 86% | 0.861 | S | S | * | * | trans | -84.2 | 139.1 | 168.7 | 41.5 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 569 | I | 31.3 | Very low | 30.3 | Very low | 171 Ų | 171 | 163.7 Ų | 163.7 | 88% | 0.877 | 86% | 0.857 | S | S | * | * | trans | -137.5 | 138.1 | 155.7 | -63.3 | -175.1 | 0 | 0 | 0 | 109.8 | ||||
| 570 | D | 26.7 | Very low | 30.4 | Very low | 147 Ų | 147 | 160.9 Ų | 160.9 | 79% | 0.786 | 86% | 0.857 | S | S | * | * | trans | -74.4 | 153.8 | -165.1 | -145 | -16.8 | 0 | 0 | 0 | 114.4 | ||||
| 571 | M | 31.6 | Very low | 30.6 | Very low | 173 Ų | 173 | 161.7 Ų | 161.7 | 85% | 0.852 | 86% | 0.862 | S | S | * | * | trans | -138.9 | 110.9 | 174.8 | -93.7 | -84.7 | -158.9 | 0 | 0 | 108.5 | ||||
| 572 | N | 30.7 | Very low | 30.8 | Very low | 172 Ų | 172 | 159.7 Ų | 159.7 | 92% | 0.92 | 86% | 0.863 | S | S | * | * | trans | -175.8 | 138 | 158.9 | -88.1 | -25.5 | 0 | 0 | 0 | 106.1 | ||||
| 573 | G | 30.3 | Very low | 31.1 | Very low | 62 Ų | 62 | 156.8 Ų | 156.8 | 64% | 0.639 | 86% | 0.86 | S | S | * | * | cis | 173.9 | -158.3 | 9.4 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 574 | L | 30 | Very low | 31.3 | Very low | 164 Ų | 164 | 158.9 Ų | 158.9 | 86% | 0.859 | 86% | 0.859 | S | S | * | * | trans | 90.8 | 97.1 | -178.3 | -73 | 98.7 | 0 | 0 | 0 | 115.3 | ||||
| 575 | E | 35 | Very low | 31.5 | Very low | 173 Ų | 173 | 156.4 Ų | 156.4 | 81% | 0.808 | 86% | 0.861 | S | S | * | * | 91.1 | 106.3 | 61.3 | -79.3 | -170.6 | 157.8 | 0 | 0 | 113.6 | |||||
| 576 | T | 37.1 | Very low | 31.7 | Very low | 120 Ų | 120 | 153.8 Ų | 153.8 | 74% | 0.736 | 86% | 0.858 | S | S | * | * | trans | 6.9 | 142.3 | 138.9 | 54.1 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 577 | N | 35.6 | Very low | 32 | Very low | 159 Ų | 159 | 151.5 Ų | 151.5 | 85% | 0.85 | 86% | 0.86 | S | S | * | * | trans | -149.1 | 124 | 130.8 | -92 | -43.3 | 0 | 0 | 0 | 111.6 | ||||
| 578 | V | 39.8 | Very low | 32.4 | Very low | 211 Ų | 211 | 153.1 Ų | 153.1 | 100% | 1.279 | 86% | 0.856 | S | S | * | * | trans | 46.7 | 0 | 152.4 | -163.5 | 0 | 0 | 0 | 0 | 119.9 |
Retrieved 578 of 578 residues in 268.6 ms
(Link to these results)