| 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 | 51.1 | Low | 62.4 | Low | 208 Ų | 208 | 91.1 Ų | 91.1 | 100% | 1.025 | 52% | 0.518 | S | S | * | . | 0 | -43.5 | 0 | -100.9 | 174.1 | -179.8 | 0 | 0 | 113.5 | A3 I4 | M1-A3 VanDerWaalsContact C-N 3.3Å; M1-A3 PolarHBondContact O-N 3.15Å; M1-I4 PolarHBondContact O-N 3.31Å | |||
| 2 | V | 56.9 | Low | 63.4 | Low | 102 Ų | 102 | 89.4 Ų | 89.4 | 62% | 0.618 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -58.7 | -32.7 | -176 | -176.6 | 0 | 0 | 0 | 0 | 115 | I4 T5 M6 | V2-I4 PolarHBondContact O-N 3.32Å; V2-T5 PolarHBondContact O-OG1 3.48Å; V2-M6 HydrophobicContact CG1-CE 3.92Å; V2-M6 HydrophobicContact CG1-SD 4.36Å; V2-M6 WeakPolarHBondContact O-CG 3.35Å; V2-M6 PolarHBondContact O-N 3.27Å |
| 3 | A | 54.5 | Low | 64 | Low | 68 Ų | 68 | 91 Ų | 91 | 56% | 0.562 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -69.8 | -31.7 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | M1 I7 | M1-A3 VanDerWaalsContact C-N 3.3Å; M1-A3 PolarHBondContact O-N 3.15Å; A3-I7 WeakPolarHBondContact O-CD1 3.27Å; A3-I7 WeakPolarHBondContact O-CG1 3.4Å; A3-I7 PolarHBondContact O-N 2.94Å |
| 4 | I | 54.9 | Low | 64.4 | Low | 111 Ų | 111 | 84.6 Ų | 84.6 | 57% | 0.569 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -73 | -44.5 | -178.2 | -59.5 | 173.8 | 0 | 0 | 0 | 109.4 | M1 V2 M6 I7 D8 | M1-I4 PolarHBondContact O-N 3.31Å; V2-I4 PolarHBondContact O-N 3.32Å; I4-M6 VanDerWaalsContact C-N 3.26Å; I4-M6 PolarHBondContact O-N 3Å; I4-I7 PolarHBondContact O-N 3.07Å; I4-I7 VanDerWaalsContact O-N 3.1Å; I4-D8 PolarHBondContact O-N 2.93Å; I4-D8 VanDerWaalsContact O-N 3.14Å |
| 5 | T | 60.7 | Low | 64.8 | Low | 92 Ų | 92 | 83.1 Ų | 83.1 | 56% | 0.564 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -62.4 | -30.6 | 176.8 | 47 | 0 | 0 | 0 | 0 | 113.5 | V2 G9 | V2-T5 PolarHBondContact O-OG1 3.48Å; T5-G9 PolarHBondContact O-N 3.27Å |
| 6 | M | 63.8 | Low | 65.2 | Low | 98 Ų | 98 | 86.6 Ų | 86.6 | 48% | 0.483 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -71.9 | -34.7 | 175.9 | -74.2 | -177.5 | 170.8 | 0 | 0 | 112.2 | V2 I4 V10 | V2-M6 HydrophobicContact CG1-CE 3.92Å; V2-M6 HydrophobicContact CG1-SD 4.36Å; V2-M6 WeakPolarHBondContact O-CG 3.35Å; V2-M6 PolarHBondContact O-N 3.27Å; I4-M6 VanDerWaalsContact C-N 3.26Å; I4-M6 PolarHBondContact O-N 3Å; M6-V10 WeakPolarHBondContact O-CG2 3.14Å; M6-V10 PolarHBondContact O-N 3.47Å |
| 7 | I | 65.4 | Low | 65.4 | Low | 95 Ų | 95 | 84.3 Ų | 84.3 | 49% | 0.487 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -71.3 | -39.9 | 178.9 | -66.6 | 165.6 | 0 | 0 | 0 | 110.5 | A3 I4 G9 V10 N11 | A3-I7 WeakPolarHBondContact O-CD1 3.27Å; A3-I7 WeakPolarHBondContact O-CG1 3.4Å; A3-I7 PolarHBondContact O-N 2.94Å; I4-I7 PolarHBondContact O-N 3.07Å; I4-I7 VanDerWaalsContact O-N 3.1Å; I7-G9 VanDerWaalsContact C-N 3.35Å; I7-G9 PolarHBondContact O-N 2.96Å; I7-V10 PolarHBondContact O-N 2.84Å; I7-N11 PolarHBondContact O-N 3.33Å; I7-N11 PolarHBondContact O-ND2 3.5Å |
| 8 | D | 66.6 | Low | 65.7 | Low | 97 Ų | 97 | 85.6 Ų | 85.6 | 52% | 0.519 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -63.8 | -39.9 | 177.1 | -69.5 | -25.4 | 0 | 0 | 0 | 112.1 | I4 V10 N11 S12 | I4-D8 PolarHBondContact O-N 2.93Å; I4-D8 VanDerWaalsContact O-N 3.14Å; D8-V10 PolarHBondContact O-N 2.77Å; D8-N11 PolarHBondContact O-N 2.98Å; D8-S12 PolarHBondContact O-N 3.41Å |
| 9 | G | 70.9 | Confident | 66.1 | Low | 32 Ų | 32 | 86.4 Ų | 86.4 | 33% | 0.33 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.1 | -39.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | T5 I7 S12 M13 | T5-G9 PolarHBondContact O-N 3.27Å; I7-G9 VanDerWaalsContact C-N 3.35Å; I7-G9 PolarHBondContact O-N 2.96Å; G9-S12 PolarHBondContact O-N 3.35Å; G9-M13 WeakPolarHBondContact O-CE 3.26Å; G9-M13 PolarHBondContact O-N 3.45Å |
| 10 | V | 69.9 | Low | 66.4 | Low | 18 Ų | 18 | 91.5 Ų | 91.5 | 11% | 0.109 | 50% | 0.501 | C | S | . | . | H | α-helix | trans | -65.7 | -41.2 | 174.9 | 172.5 | 0 | 0 | 0 | 0 | 111.1 | M6 I7 D8 S12 M13 V14 I33 L37 | M6-V10 WeakPolarHBondContact O-CG2 3.14Å; M6-V10 PolarHBondContact O-N 3.47Å; I7-V10 PolarHBondContact O-N 2.84Å; D8-V10 PolarHBondContact O-N 2.77Å; V10-S12 VanDerWaalsContact C-N 3.31Å; V10-S12 PolarHBondContact O-N 3.06Å; V10-M13 PolarHBondContact O-N 2.93Å; V10-V14 HydrophobicContact CG1-CG2 4.12Å; V10-V14 WeakPolarHBondContact O-CB 3.47Å; V10-V14 WeakPolarHBondContact O-CG2 3.5Å; V10-V14 PolarHBondContact O-N 3.1Å; V10-I33 HydrophobicContact CB-CG2 4.32Å; V10-I33 HydrophobicContact CG1-CB 4.34Å; V10-I33 HydrophobicContact CG1-CD1 4.22Å; V10-I33 HydrophobicContact CG1-CG2 3.66Å; V10-I33 HydrophobicContact CG2-CG2 3.59Å; V10-L37 HydrophobicContact CG2-CD1 3.95Å |
| 11 | N | 71.8 | Confident | 66.9 | Low | 81 Ų | 81 | 91.1 Ų | 91.1 | 43% | 0.433 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.8 | -37.6 | 177.5 | -72.3 | -29.4 | 0 | 0 | 0 | 112.2 | I7 D8 V14 A15 | I7-N11 PolarHBondContact O-N 3.33Å; I7-N11 PolarHBondContact O-ND2 3.5Å; D8-N11 PolarHBondContact O-N 2.98Å; N11-V14 PolarHBondContact O-N 2.92Å; N11-A15 WeakPolarHBondContact O-CB 3.33Å; N11-A15 PolarHBondContact O-N 3.25Å |
| 12 | S | 74.4 | Confident | 68.4 | Low | 71 Ų | 71 | 85.1 Ų | 85.1 | 50% | 0.497 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -65.5 | -46.1 | 174.4 | -166.2 | 0 | 0 | 0 | 0 | 112.1 | D8 G9 V10 V14 A15 E16 | D8-S12 PolarHBondContact O-N 3.41Å; G9-S12 PolarHBondContact O-N 3.35Å; V10-S12 VanDerWaalsContact C-N 3.31Å; V10-S12 PolarHBondContact O-N 3.06Å; S12-V14 VanDerWaalsContact C-N 3.27Å; S12-V14 PolarHBondContact O-N 2.97Å; S12-A15 WeakPolarHBondContact O-CB 3.42Å; S12-A15 PolarHBondContact O-N 2.76Å; S12-E16 PolarHBondContact O-N 3.1Å |
| 13 | M | 71.1 | Confident | 69.4 | Low | 110 Ų | 110 | 85.9 Ų | 85.9 | 54% | 0.542 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -62.6 | -36.7 | 176 | -77.3 | -175.9 | -89 | 0 | 0 | 111.9 | G9 V10 E16 L17 | G9-M13 WeakPolarHBondContact O-CE 3.26Å; G9-M13 PolarHBondContact O-N 3.45Å; V10-M13 PolarHBondContact O-N 2.93Å; M13-E16 PolarHBondContact O-N 3.28Å; M13-L17 WeakPolarHBondContact O-CD1 3.2Å; M13-L17 WeakPolarHBondContact O-CG 3.38Å; M13-L17 PolarHBondContact O-N 3.38Å |
| 14 | V | 69.5 | Low | 70.6 | Confident | 1 Ų | 1 | 88.1 Ų | 88.1 | 1% | 0.006 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -73.6 | -31.7 | 177.6 | 179 | 0 | 0 | 0 | 0 | 111.9 | V10 N11 S12 E16 L17 Y18 I26 K30 I33 | V10-V14 HydrophobicContact CG1-CG2 4.12Å; V10-V14 WeakPolarHBondContact O-CB 3.47Å; V10-V14 WeakPolarHBondContact O-CG2 3.5Å; V10-V14 PolarHBondContact O-N 3.1Å; N11-V14 PolarHBondContact O-N 2.92Å; S12-V14 VanDerWaalsContact C-N 3.27Å; S12-V14 PolarHBondContact O-N 2.97Å; V14-E16 VanDerWaalsContact C-N 3.29Å; V14-E16 PolarHBondContact O-N 2.8Å; V14-L17 WeakPolarHBondContact O-CB 3.32Å; V14-L17 PolarHBondContact O-N 2.9Å; V14-L17 VanDerWaalsContact O-N 3.1Å; V14-Y18 HydrophobicContact CG1-CD2 4.2Å; V14-Y18 HydrophobicContact CG1-CE2 3.82Å; V14-Y18 WeakPolarHBondContact O-CD2 3.42Å; V14-Y18 PolarHBondContact O-N 3.1Å; V14-Y18 VanDerWaalsContact O-N 3.14Å; V14-I26 HydrophobicContact CG1-CG2 3.5Å; V14-I26 VanDerWaalsContact CG1-CG2 3.5Å; V14-K30 HydrophobicContact CG1-CD 4.23Å; V14-K30 HydrophobicContact CG1-CG 3.91Å; V14-K30 HydrophobicContact CG2-CG 4.09Å; V14-I33 HydrophobicContact CG2-CD1 4.3Å |
| 15 | A | 70 | Confident | 71.8 | Confident | 62 Ų | 62 | 87 Ų | 87 | 51% | 0.512 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -57.5 | -41 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | N11 S12 L17 Y18 | N11-A15 WeakPolarHBondContact O-CB 3.33Å; N11-A15 PolarHBondContact O-N 3.25Å; S12-A15 WeakPolarHBondContact O-CB 3.42Å; S12-A15 PolarHBondContact O-N 2.76Å; A15-L17 VanDerWaalsContact C-N 3.32Å; A15-L17 PolarHBondContact O-N 2.69Å; A15-Y18 PolarHBondContact O-N 3.32Å |
| 16 | E | 71.4 | Confident | 72.6 | Confident | 139 Ų | 139 | 82.7 Ų | 82.7 | 65% | 0.65 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -68.8 | -31.9 | 175.7 | -68 | 176.7 | -172.9 | 0 | 0 | 112.4 | S12 M13 V14 Y18 | S12-E16 PolarHBondContact O-N 3.1Å; M13-E16 PolarHBondContact O-N 3.28Å; V14-E16 VanDerWaalsContact C-N 3.29Å; V14-E16 PolarHBondContact O-N 2.8Å; E16-Y18 VanDerWaalsContact C-N 3.32Å; E16-Y18 PolarHBondContact O-N 3.35Å |
| 17 | L | 68.3 | Low | 73.3 | Confident | 48 Ų | 48 | 81.6 Ų | 81.6 | 25% | 0.251 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -73.6 | -19.6 | 177.7 | -71.3 | 158.8 | 0 | 0 | 0 | 113.3 | M13 V14 A15 S19 Y20 F21 I29 | M13-L17 WeakPolarHBondContact O-CD1 3.2Å; M13-L17 WeakPolarHBondContact O-CG 3.38Å; M13-L17 PolarHBondContact O-N 3.38Å; V14-L17 WeakPolarHBondContact O-CB 3.32Å; V14-L17 PolarHBondContact O-N 2.9Å; V14-L17 VanDerWaalsContact O-N 3.1Å; A15-L17 VanDerWaalsContact C-N 3.32Å; A15-L17 PolarHBondContact O-N 2.69Å; L17-S19 PolarHBondContact O-N 3.01Å; L17-Y20 PolarHBondContact O-N 2.86Å; L17-Y20 VanDerWaalsContact O-N 3.11Å; L17-F21 HydrophobicContact CB-CD2 4.17Å; L17-F21 HydrophobicContact CD2-CD2 3.61Å; L17-F21 HydrophobicContact CD2-CE2 3.35Å; L17-F21 HydrophobicContact CD2-CZ 4.47Å; L17-F21 PolarHBondContact O-N 3.29Å; L17-I29 HydrophobicContact CD1-CG2 4.21Å |
| 18 | Y | 72 | Confident | 74.3 | Confident | 108 Ų | 108 | 84.1 Ų | 84.1 | 42% | 0.424 | 45% | 0.452 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.6 | -24.4 | 177.8 | -89.2 | -84 | 0 | 0 | 0 | 113.7 | V14 A15 E16 I26 K30 | V14-Y18 HydrophobicContact CG1-CD2 4.2Å; V14-Y18 HydrophobicContact CG1-CE2 3.82Å; V14-Y18 WeakPolarHBondContact O-CD2 3.42Å; V14-Y18 PolarHBondContact O-N 3.1Å; V14-Y18 VanDerWaalsContact O-N 3.14Å; A15-Y18 PolarHBondContact O-N 3.32Å; E16-Y18 VanDerWaalsContact C-N 3.32Å; E16-Y18 PolarHBondContact O-N 3.35Å; Y18-I26 HydrophobicContact CD1-CD1 3.3Å; Y18-I26 HydrophobicContact CD1-CG2 4.49Å; Y18-I26 HydrophobicContact CD2-CD1 4.38Å; Y18-I26 HydrophobicContact CD2-CG2 4.33Å; Y18-I26 HydrophobicContact CE1-CD1 3.67Å; Y18-I26 HydrophobicContact CE1-CG2 3.99Å; Y18-I26 HydrophobicContact CE2-CG2 3.85Å; Y18-I26 HydrophobicContact CG-CD1 3.69Å; Y18-K30 PolarHBondContact OH-NZ 3.13Å |
| 19 | S | 72.6 | Confident | 75 | Confident | 101 Ų | 101 | 81.4 Ų | 81.4 | 71% | 0.706 | 44% | 0.437 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.2 | -19.1 | 178.5 | -171.1 | 0 | 0 | 0 | 0 | 113.9 | L17 | L17-S19 PolarHBondContact O-N 3.01Š|
| 20 | Y | 71.2 | Confident | 75.5 | Confident | 188 Ų | 188 | 83.2 Ų | 83.2 | 74% | 0.737 | 44% | 0.436 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -112.7 | -20.5 | -169.7 | -67.2 | -80.1 | 0 | 0 | 0 | 113.4 | L17 | L17-Y20 PolarHBondContact O-N 2.86Å; L17-Y20 VanDerWaalsContact O-N 3.11Å |
| 21 | F | 78.1 | Confident | 76.3 | Confident | 84 Ų | 84 | 90.6 Ų | 90.6 | 37% | 0.368 | 46% | 0.463 | S | S | . | . | S | Bend | trans | -123.6 | 151.7 | -169.9 | -69.3 | -78.4 | 0 | 0 | 0 | 111.5 | L17 Q25 I26 I29 | L17-F21 HydrophobicContact CB-CD2 4.17Å; L17-F21 HydrophobicContact CD2-CD2 3.61Å; L17-F21 HydrophobicContact CD2-CE2 3.35Å; L17-F21 HydrophobicContact CD2-CZ 4.47Å; L17-F21 PolarHBondContact O-N 3.29Å; F21-Q25 HydrophobicContact CB-CB 3.93Å; F21-Q25 HydrophobicContact CD1-CB 4.05Å; F21-Q25 HydrophobicContact CD1-CG 4.44Å; F21-Q25 HydrophobicContact CG-CB 4.38Å; F21-I26 HydrophobicContact CB-CD1 4.31Å; F21-I26 HydrophobicContact CB-CG1 3.76Å; F21-I26 WeakPolarHBondContact O-CD1 3.16Å; F21-I29 HydrophobicContact CD2-CD1 4.42Å; F21-I29 HydrophobicContact CG-CD1 4.38Å |
| 22 | T | 81.5 | Confident | 77 | Confident | 81 Ų | 81 | 88.9 Ų | 88.9 | 50% | 0.497 | 46% | 0.46 | S | S | . | . | trans | -68.4 | 154.4 | 170.7 | 58.2 | 0 | 0 | 0 | 0 | 110.6 | V24 Q25 I26 | T22-V24 PolarHBondContact O-N 3.09Å; T22-Q25 WeakPolarHBondContact O-CB 3.26Å; T22-Q25 PolarHBondContact O-N 2.8Å; T22-Q25 WeakPolarHBondContact OG1-CG 3.37Å; T22-Q25 PolarHBondContact OG1-OE1 2.67Å; T22-I26 WeakPolarHBondContact O-CG1 3.34Å; T22-I26 PolarHBondContact O-N 2.65Å | ||
| 23 | D | 78.8 | Confident | 77.4 | Confident | 118 Ų | 118 | 87.8 Ų | 87.8 | 63% | 0.631 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -53 | -32.2 | 178.4 | -73 | -37 | 0 | 0 | 0 | 113.5 | S27 | D23-S27 WeakPolarHBondContact O-CB 3.29Å; D23-S27 PolarHBondContact O-N 3.22Å; D23-S27 PolarHBondContact O-OG 3.22Å |
| 24 | V | 79.1 | Confident | 77.9 | Confident | 116 Ų | 116 | 86.3 Ų | 86.3 | 70% | 0.703 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -66.9 | -46.6 | 176.1 | -178.9 | 0 | 0 | 0 | 0 | 111 | T22 I26 S27 F28 | T22-V24 PolarHBondContact O-N 3.09Å; V24-I26 VanDerWaalsContact C-N 3.33Å; V24-I26 PolarHBondContact O-N 2.87Å; V24-S27 PolarHBondContact O-N 3.46Å; V24-F28 PolarHBondContact O-N 3.36Å |
| 25 | Q | 81 | Confident | 78.6 | Confident | 88 Ų | 88 | 88 Ų | 88 | 41% | 0.411 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -64.6 | -39.4 | 177.6 | -73.7 | 166.5 | -36.9 | 0 | 0 | 111.2 | F21 T22 S27 F28 I29 | F21-Q25 HydrophobicContact CB-CB 3.93Å; F21-Q25 HydrophobicContact CD1-CB 4.05Å; F21-Q25 HydrophobicContact CD1-CG 4.44Å; F21-Q25 HydrophobicContact CG-CB 4.38Å; T22-Q25 WeakPolarHBondContact O-CB 3.26Å; T22-Q25 PolarHBondContact O-N 2.8Å; T22-Q25 WeakPolarHBondContact OG1-CG 3.37Å; T22-Q25 PolarHBondContact OG1-OE1 2.67Å; Q25-S27 VanDerWaalsContact C-N 3.35Å; Q25-S27 PolarHBondContact O-N 3.41Å; Q25-F28 WeakPolarHBondContact O-CB 3.44Å; Q25-F28 PolarHBondContact O-N 2.61Å; Q25-I29 VanDerWaalsContact O-CG1 3.22Å; Q25-I29 WeakPolarHBondContact O-CG1 3.34Å; Q25-I29 PolarHBondContact O-N 3.43Å |
| 26 | I | 76.8 | Confident | 79.3 | Confident | 1 Ų | 1 | 90.8 Ų | 90.8 | 1% | 0.005 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -65.4 | -41.7 | 177.3 | -63.4 | 163.4 | 0 | 0 | 0 | 111 | V14 Y18 F21 T22 V24 F28 I29 K30 | V14-I26 HydrophobicContact CG1-CG2 3.5Å; V14-I26 VanDerWaalsContact CG1-CG2 3.5Å; Y18-I26 HydrophobicContact CD1-CD1 3.3Å; Y18-I26 HydrophobicContact CD1-CG2 4.49Å; Y18-I26 HydrophobicContact CD2-CD1 4.38Å; Y18-I26 HydrophobicContact CD2-CG2 4.33Å; Y18-I26 HydrophobicContact CE1-CD1 3.67Å; Y18-I26 HydrophobicContact CE1-CG2 3.99Å; Y18-I26 HydrophobicContact CE2-CG2 3.85Å; Y18-I26 HydrophobicContact CG-CD1 3.69Å; F21-I26 HydrophobicContact CB-CD1 4.31Å; F21-I26 HydrophobicContact CB-CG1 3.76Å; F21-I26 WeakPolarHBondContact O-CD1 3.16Å; T22-I26 WeakPolarHBondContact O-CG1 3.34Å; T22-I26 PolarHBondContact O-N 2.65Å; V24-I26 VanDerWaalsContact C-N 3.33Å; V24-I26 PolarHBondContact O-N 2.87Å; I26-F28 VanDerWaalsContact C-N 3.31Å; I26-F28 PolarHBondContact O-N 3.27Å; I26-I29 PolarHBondContact O-N 3.27Å; I26-K30 HydrophobicContact CG2-CD 4.49Å; I26-K30 WeakPolarHBondContact O-CG 3.19Å; I26-K30 PolarHBondContact O-N 3.13Å |
| 27 | S | 79.8 | Confident | 79.8 | Confident | 74 Ų | 74 | 86.7 Ų | 86.7 | 52% | 0.517 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -62.2 | -41.3 | 175.5 | -60.9 | 0 | 0 | 0 | 0 | 111.5 | D23 V24 Q25 K30 Y31 | D23-S27 WeakPolarHBondContact O-CB 3.29Å; D23-S27 PolarHBondContact O-N 3.22Å; D23-S27 PolarHBondContact O-OG 3.22Å; V24-S27 PolarHBondContact O-N 3.46Å; Q25-S27 VanDerWaalsContact C-N 3.35Å; Q25-S27 PolarHBondContact O-N 3.41Å; S27-K30 PolarHBondContact O-N 2.67Å; S27-Y31 WeakPolarHBondContact O-CB 3.05Å; S27-Y31 PolarHBondContact O-N 2.8Å |
| 28 | F | 84.9 | Confident | 80.4 | Confident | 149 Ų | 149 | 88.3 Ų | 88.3 | 65% | 0.654 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -63.2 | -45 | 173.8 | -178.1 | -98.2 | 0 | 0 | 0 | 112.1 | V24 Q25 I26 Y31 A32 | V24-F28 PolarHBondContact O-N 3.36Å; Q25-F28 WeakPolarHBondContact O-CB 3.44Å; Q25-F28 PolarHBondContact O-N 2.61Å; I26-F28 VanDerWaalsContact C-N 3.31Å; I26-F28 PolarHBondContact O-N 3.27Å; F28-Y31 PolarHBondContact O-N 2.85Å; F28-A32 WeakPolarHBondContact O-CB 3.23Å; F28-A32 PolarHBondContact O-N 2.96Å |
| 29 | I | 82.2 | Confident | 80.9 | Confident | 39 Ų | 39 | 87 Ų | 87 | 20% | 0.2 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -61.9 | -45.5 | 177.6 | -68.8 | 162.6 | 0 | 0 | 0 | 110.7 | L17 F21 Q25 I26 Y31 A32 I33 | L17-I29 HydrophobicContact CD1-CG2 4.21Å; F21-I29 HydrophobicContact CD2-CD1 4.42Å; F21-I29 HydrophobicContact CG-CD1 4.38Å; Q25-I29 VanDerWaalsContact O-CG1 3.22Å; Q25-I29 WeakPolarHBondContact O-CG1 3.34Å; Q25-I29 PolarHBondContact O-N 3.43Å; I26-I29 PolarHBondContact O-N 3.27Å; I29-Y31 VanDerWaalsContact C-N 3.31Å; I29-Y31 PolarHBondContact O-N 3.34Å; I29-A32 PolarHBondContact O-N 3.3Å; I29-I33 HydrophobicContact CG2-CD1 3.58Å; I29-I33 HydrophobicContact CG2-CG1 4.22Å; I29-I33 VanDerWaalsContact O-CG1 3.31Å; I29-I33 WeakPolarHBondContact O-CG1 3.28Å; I29-I33 PolarHBondContact O-N 2.8Å |
| 30 | K | 81.7 | Confident | 81.1 | Confident | 70 Ų | 70 | 84.9 Ų | 84.9 | 30% | 0.304 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -57.4 | -44.9 | 175.1 | -75.3 | -177.7 | -176.6 | -178.1 | 0 | 111.5 | V14 Y18 I26 S27 T34 | V14-K30 HydrophobicContact CG1-CD 4.23Å; V14-K30 HydrophobicContact CG1-CG 3.91Å; V14-K30 HydrophobicContact CG2-CG 4.09Å; Y18-K30 PolarHBondContact OH-NZ 3.13Å; I26-K30 HydrophobicContact CG2-CD 4.49Å; I26-K30 WeakPolarHBondContact O-CG 3.19Å; I26-K30 PolarHBondContact O-N 3.13Å; S27-K30 PolarHBondContact O-N 2.67Å; K30-T34 VanDerWaalsContact O-CB 3.27Å; K30-T34 WeakPolarHBondContact O-CB 3.34Å; K30-T34 PolarHBondContact O-N 3.23Å; K30-T34 PolarHBondContact O-OG1 3.44Å |
| 31 | Y | 85.4 | Confident | 81.4 | Confident | 174 Ų | 174 | 79.2 Ų | 79.2 | 68% | 0.682 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -63 | -46.2 | 177.2 | -179.1 | -98.8 | 0 | 0 | 0 | 111.8 | S27 F28 I29 T34 A35 | S27-Y31 WeakPolarHBondContact O-CB 3.05Å; S27-Y31 PolarHBondContact O-N 2.8Å; F28-Y31 PolarHBondContact O-N 2.85Å; I29-Y31 VanDerWaalsContact C-N 3.31Å; I29-Y31 PolarHBondContact O-N 3.34Å; Y31-T34 PolarHBondContact O-N 3.34Å; Y31-A35 VanDerWaalsContact O-CB 3.28Å; Y31-A35 WeakPolarHBondContact O-CB 3.16Å; Y31-A35 PolarHBondContact O-N 3Å |
| 32 | A | 86.2 | Confident | 81.1 | Confident | 44 Ų | 44 | 78.3 Ų | 78.3 | 36% | 0.364 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -62.3 | -46.4 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | F28 I29 A35 L36 | F28-A32 WeakPolarHBondContact O-CB 3.23Å; F28-A32 PolarHBondContact O-N 2.96Å; I29-A32 PolarHBondContact O-N 3.3Å; A32-A35 PolarHBondContact O-N 3.15Å; A32-L36 WeakPolarHBondContact O-CB 3.38Å; A32-L36 PolarHBondContact O-N 3.33Å |
| 33 | I | 83.2 | Confident | 80.7 | Confident | 49 Ų | 49 | 79.7 Ų | 79.7 | 25% | 0.251 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -63.3 | -44.5 | 177.1 | -65.3 | 169.3 | 0 | 0 | 0 | 110.4 | V10 V14 I29 L36 L37 | V10-I33 HydrophobicContact CB-CG2 4.32Å; V10-I33 HydrophobicContact CG1-CB 4.34Å; V10-I33 HydrophobicContact CG1-CD1 4.22Å; V10-I33 HydrophobicContact CG1-CG2 3.66Å; V10-I33 HydrophobicContact CG2-CG2 3.59Å; V14-I33 HydrophobicContact CG2-CD1 4.3Å; I29-I33 HydrophobicContact CG2-CD1 3.58Å; I29-I33 HydrophobicContact CG2-CG1 4.22Å; I29-I33 VanDerWaalsContact O-CG1 3.31Å; I29-I33 WeakPolarHBondContact O-CG1 3.28Å; I29-I33 PolarHBondContact O-N 2.8Å; I33-L36 PolarHBondContact O-N 3.19Å; I33-L37 HydrophobicContact CG2-CD1 4.08Å; I33-L37 HydrophobicContact CG2-CG 4.45Å; I33-L37 WeakPolarHBondContact O-CG 3.5Å; I33-L37 PolarHBondContact O-N 3.06Å |
| 34 | T | 81.2 | Confident | 80.4 | Confident | 78 Ų | 78 | 80.4 Ų | 80.4 | 48% | 0.479 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -63.3 | -44.6 | 178.8 | -55.3 | 0 | 0 | 0 | 0 | 111.1 | K30 Y31 L36 L37 V38 | K30-T34 VanDerWaalsContact O-CB 3.27Å; K30-T34 WeakPolarHBondContact O-CB 3.34Å; K30-T34 PolarHBondContact O-N 3.23Å; K30-T34 PolarHBondContact O-OG1 3.44Å; Y31-T34 PolarHBondContact O-N 3.34Å; T34-L36 VanDerWaalsContact C-N 3.33Å; T34-L36 PolarHBondContact O-N 3.19Å; T34-L37 PolarHBondContact O-N 3.14Å; T34-V38 HydrophobicContact CG2-CG2 4.47Å; T34-V38 VanDerWaalsContact O-CG2 3.29Å; T34-V38 WeakPolarHBondContact O-CG2 3.46Å; T34-V38 PolarHBondContact O-N 2.98Å |
| 35 | A | 84.8 | Confident | 80.1 | Confident | 36 Ų | 36 | 80.2 Ų | 80.2 | 30% | 0.298 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -61.7 | -40.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y31 A32 V38 T39 | Y31-A35 VanDerWaalsContact O-CB 3.28Å; Y31-A35 WeakPolarHBondContact O-CB 3.16Å; Y31-A35 PolarHBondContact O-N 3Å; A32-A35 PolarHBondContact O-N 3.15Å; A35-V38 PolarHBondContact O-N 3.28Å; A35-T39 WeakPolarHBondContact O-CB 3.47Å; A35-T39 VanDerWaalsContact O-CG2 3.26Å; A35-T39 WeakPolarHBondContact O-CG2 3.44Å; A35-T39 PolarHBondContact O-N 3.42Å; A35-T39 PolarHBondContact O-OG1 2.66Å |
| 36 | L | 85.8 | Confident | 79.6 | Confident | 121 Ų | 121 | 80 Ų | 80 | 63% | 0.634 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -65.4 | -40.2 | 175.8 | -171.2 | 68.5 | 0 | 0 | 0 | 111.9 | A32 I33 T34 T39 S40 | A32-L36 WeakPolarHBondContact O-CB 3.38Å; A32-L36 PolarHBondContact O-N 3.33Å; I33-L36 PolarHBondContact O-N 3.19Å; T34-L36 VanDerWaalsContact C-N 3.33Å; T34-L36 PolarHBondContact O-N 3.19Å; L36-T39 WeakPolarHBondContact CA-OG1 3.37Å; L36-T39 PolarHBondContact O-OG1 3.43Å; L36-T39 VanDerWaalsContact O-OG1 3.08Å; L36-S40 WeakPolarHBondContact O-CB 3.42Å; L36-S40 PolarHBondContact O-N 2.82Å; L36-S40 PolarHBondContact O-OG 3.05Å |
| 37 | L | 81.7 | Confident | 79 | Confident | 54 Ų | 54 | 88.1 Ų | 88.1 | 28% | 0.283 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -65.8 | -43 | 175.3 | -74.9 | 173.2 | 0 | 0 | 0 | 111.8 | V10 I33 T34 S40 T41 | V10-L37 HydrophobicContact CG2-CD1 3.95Å; I33-L37 HydrophobicContact CG2-CD1 4.08Å; I33-L37 HydrophobicContact CG2-CG 4.45Å; I33-L37 WeakPolarHBondContact O-CG 3.5Å; I33-L37 PolarHBondContact O-N 3.06Å; T34-L37 PolarHBondContact O-N 3.14Å; L37-S40 WeakPolarHBondContact CA-OG 3.35Å; L37-S40 PolarHBondContact O-OG 2.92Å; L37-S40 VanDerWaalsContact O-OG 3.04Å; L37-T41 WeakPolarHBondContact O-CB 3.31Å; L37-T41 WeakPolarHBondContact O-CG2 3.34Å; L37-T41 PolarHBondContact O-N 3.07Å; L37-T41 PolarHBondContact O-OG1 3.38Å |
| 38 | V | 81 | Confident | 78.4 | Confident | 81 Ų | 81 | 89.9 Ų | 89.9 | 49% | 0.491 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -66.3 | -43.7 | 177.5 | 172.2 | 0 | 0 | 0 | 0 | 111.2 | T34 A35 T41 S42 | T34-V38 HydrophobicContact CG2-CG2 4.47Å; T34-V38 VanDerWaalsContact O-CG2 3.29Å; T34-V38 WeakPolarHBondContact O-CG2 3.46Å; T34-V38 PolarHBondContact O-N 2.98Å; A35-V38 PolarHBondContact O-N 3.28Å; V38-T41 WeakPolarHBondContact CA-OG1 3.27Å; V38-T41 PolarHBondContact O-OG1 2.94Å; V38-T41 VanDerWaalsContact O-OG1 3.05Å; V38-S42 WeakPolarHBondContact O-CB 3.36Å; V38-S42 PolarHBondContact O-N 2.86Å; V38-S42 PolarHBondContact O-OG 3.31Å |
| 39 | T | 81.3 | Confident | 77.2 | Confident | 81 Ų | 81 | 86.3 Ų | 86.3 | 50% | 0.497 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -69.7 | -41.4 | 179 | 51.2 | 0 | 0 | 0 | 0 | 111.8 | A35 L36 S42 F43 | A35-T39 WeakPolarHBondContact O-CB 3.47Å; A35-T39 VanDerWaalsContact O-CG2 3.26Å; A35-T39 WeakPolarHBondContact O-CG2 3.44Å; A35-T39 PolarHBondContact O-N 3.42Å; A35-T39 PolarHBondContact O-OG1 2.66Å; L36-T39 WeakPolarHBondContact CA-OG1 3.37Å; L36-T39 PolarHBondContact O-OG1 3.43Å; L36-T39 VanDerWaalsContact O-OG1 3.08Å; T39-S42 PolarHBondContact O-N 2.83Å; T39-F43 WeakPolarHBondContact O-CB 3.34Å; T39-F43 PolarHBondContact O-N 2.86Å |
| 40 | S | 78.3 | Confident | 76.1 | Confident | 57 Ų | 57 | 90.8 Ų | 90.8 | 40% | 0.399 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -67.2 | -40.9 | 176.8 | 61.4 | 0 | 0 | 0 | 0 | 112.5 | L36 L37 F43 Y44 | L36-S40 WeakPolarHBondContact O-CB 3.42Å; L36-S40 PolarHBondContact O-N 2.82Å; L36-S40 PolarHBondContact O-OG 3.05Å; L37-S40 WeakPolarHBondContact CA-OG 3.35Å; L37-S40 PolarHBondContact O-OG 2.92Å; L37-S40 VanDerWaalsContact O-OG 3.04Å; S40-F43 PolarHBondContact O-N 3.44Å; S40-Y44 WeakPolarHBondContact O-CB 3.41Å; S40-Y44 PolarHBondContact O-N 3.2Å |
| 41 | T | 75.9 | Confident | 75.1 | Confident | 69 Ų | 69 | 90.7 Ų | 90.7 | 42% | 0.423 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -66.7 | -41.3 | 173.8 | 47.5 | 0 | 0 | 0 | 0 | 111.7 | L37 V38 Y44 L45 | L37-T41 WeakPolarHBondContact O-CB 3.31Å; L37-T41 WeakPolarHBondContact O-CG2 3.34Å; L37-T41 PolarHBondContact O-N 3.07Å; L37-T41 PolarHBondContact O-OG1 3.38Å; V38-T41 WeakPolarHBondContact CA-OG1 3.27Å; V38-T41 PolarHBondContact O-OG1 2.94Å; V38-T41 VanDerWaalsContact O-OG1 3.05Å; T41-Y44 PolarHBondContact O-N 3.32Å; T41-L45 WeakPolarHBondContact O-CB 3.44Å; T41-L45 VanDerWaalsContact O-CG 3.23Å; T41-L45 WeakPolarHBondContact O-CG 3.39Å; T41-L45 PolarHBondContact O-N 3.05Å |
| 42 | S | 73.3 | Confident | 73.6 | Confident | 65 Ų | 65 | 90.1 Ų | 90.1 | 46% | 0.455 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62 | -44.3 | 174.3 | -61.3 | 0 | 0 | 0 | 0 | 111.5 | V38 T39 L45 L46 | V38-S42 WeakPolarHBondContact O-CB 3.36Å; V38-S42 PolarHBondContact O-N 2.86Å; V38-S42 PolarHBondContact O-OG 3.31Å; T39-S42 PolarHBondContact O-N 2.83Å; S42-L45 PolarHBondContact O-N 3.33Å; S42-L46 WeakPolarHBondContact O-CB 3.22Å; S42-L46 PolarHBondContact O-N 3.05Å |
| 43 | F | 72.8 | Confident | 71.7 | Confident | 109 Ų | 109 | 95.6 Ų | 95.6 | 48% | 0.478 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -69.4 | -36 | 178 | -169.3 | -103.9 | 0 | 0 | 0 | 112.3 | T39 S40 L46 R47 | T39-F43 WeakPolarHBondContact O-CB 3.34Å; T39-F43 PolarHBondContact O-N 2.86Å; S40-F43 PolarHBondContact O-N 3.44Å; F43-L46 PolarHBondContact O-N 2.69Å; F43-R47 HydrophobicContact CD1-CG 4.4Å; F43-R47 HydrophobicContact CE1-CG 4.12Å; F43-R47 VanDerWaalsContact CE1-CZ 3.45Å; F43-R47 HydrophobicContact CZ-CG 4.43Å; F43-R47 WeakPolarHBondContact O-CB 3.41Å; F43-R47 PolarHBondContact O-N 3.37Å |
| 44 | Y | 72.5 | Confident | 70 | Confident | 133 Ų | 133 | 98.4 Ų | 98.4 | 52% | 0.522 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65 | -42.9 | 172.9 | 178.4 | -101.1 | 0 | 0 | 0 | 111.6 | S40 T41 R47 K48 | S40-Y44 WeakPolarHBondContact O-CB 3.41Å; S40-Y44 PolarHBondContact O-N 3.2Å; T41-Y44 PolarHBondContact O-N 3.32Å; Y44-R47 PolarHBondContact O-N 3.42Å; Y44-K48 HydrophobicContact CD1-CD 4.17Å; Y44-K48 HydrophobicContact CE1-CD 3.51Å; Y44-K48 HydrophobicContact CE1-CG 4.28Å; Y44-K48 VanDerWaalsContact CZ-CE 3.44Å; Y44-K48 WeakPolarHBondContact O-CB 3.37Å; Y44-K48 PolarHBondContact O-N 3.25Å; Y44-K48 WeakPolarHBondContact OH-CE 3.39Å; Y44-K48 PolarHBondContact OH-NZ 2.84Å |
| 45 | L | 72.2 | Confident | 68.3 | Low | 113 Ų | 113 | 100.7 Ų | 100.7 | 59% | 0.592 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -64.7 | -40.9 | 173.8 | -72.3 | 170.7 | 0 | 0 | 0 | 111.3 | T41 S42 K48 S49 | T41-L45 WeakPolarHBondContact O-CB 3.44Å; T41-L45 VanDerWaalsContact O-CG 3.23Å; T41-L45 WeakPolarHBondContact O-CG 3.39Å; T41-L45 PolarHBondContact O-N 3.05Å; S42-L45 PolarHBondContact O-N 3.33Å; L45-K48 PolarHBondContact O-N 3.35Å; L45-S49 WeakPolarHBondContact O-CB 3.17Å; L45-S49 PolarHBondContact O-N 2.87Å |
| 46 | L | 70.9 | Confident | 66.3 | Low | 84 Ų | 84 | 103.8 Ų | 103.8 | 44% | 0.44 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -63 | -48.9 | 175.9 | -163.7 | 74.2 | 0 | 0 | 0 | 110.9 | S42 F43 K48 S49 L50 | S42-L46 WeakPolarHBondContact O-CB 3.22Å; S42-L46 PolarHBondContact O-N 3.05Å; F43-L46 PolarHBondContact O-N 2.69Å; L46-K48 VanDerWaalsContact C-N 3.34Å; L46-K48 PolarHBondContact O-N 2.91Å; L46-S49 PolarHBondContact O-N 2.8Å; L46-S49 PolarHBondContact O-OG 2.79Å; L46-L50 HydrophobicContact CD2-CD1 4.49Å; L46-L50 HydrophobicContact CG-CD1 3.99Å; L46-L50 WeakPolarHBondContact O-CD1 3.38Å; L46-L50 WeakPolarHBondContact O-CG 3.43Å; L46-L50 PolarHBondContact O-N 3.43Å |
| 47 | R | 64.8 | Low | 64.4 | Low | 170 Ų | 170 | 103.4 Ų | 103.4 | 64% | 0.642 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -60.5 | -40.9 | 174 | -85.7 | -167.9 | 176.2 | 171.5 | 3 | 112.4 | F43 Y44 S49 L50 G51 | F43-R47 HydrophobicContact CD1-CG 4.4Å; F43-R47 HydrophobicContact CE1-CG 4.12Å; F43-R47 VanDerWaalsContact CE1-CZ 3.45Å; F43-R47 HydrophobicContact CZ-CG 4.43Å; F43-R47 WeakPolarHBondContact O-CB 3.41Å; F43-R47 PolarHBondContact O-N 3.37Å; Y44-R47 PolarHBondContact O-N 3.42Å; R47-S49 VanDerWaalsContact C-N 3.27Å; R47-S49 PolarHBondContact O-N 3.49Å; R47-L50 PolarHBondContact O-N 2.81Å; R47-G51 PolarHBondContact O-N 3.37Å |
| 48 | K | 65.4 | Low | 62.6 | Low | 111 Ų | 111 | 106.9 Ų | 106.9 | 48% | 0.483 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -63.7 | -32.7 | 173.8 | -92.1 | -171.5 | 159.5 | 170.6 | 0 | 112.6 | Y44 L45 L46 K52 | Y44-K48 HydrophobicContact CD1-CD 4.17Å; Y44-K48 HydrophobicContact CE1-CD 3.51Å; Y44-K48 HydrophobicContact CE1-CG 4.28Å; Y44-K48 VanDerWaalsContact CZ-CE 3.44Å; Y44-K48 WeakPolarHBondContact O-CB 3.37Å; Y44-K48 PolarHBondContact O-N 3.25Å; Y44-K48 WeakPolarHBondContact OH-CE 3.39Å; Y44-K48 PolarHBondContact OH-NZ 2.84Å; L45-K48 PolarHBondContact O-N 3.35Å; L46-K48 VanDerWaalsContact C-N 3.34Å; L46-K48 PolarHBondContact O-N 2.91Å; K48-K52 PolarHBondContact O-N 2.86Å |
| 49 | S | 60.8 | Low | 61 | Low | 74 Ų | 74 | 108.2 Ų | 108.2 | 52% | 0.517 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -75.6 | -31.8 | 176.5 | 75.7 | 0 | 0 | 0 | 0 | 112.9 | L45 L46 R47 | L45-S49 WeakPolarHBondContact O-CB 3.17Å; L45-S49 PolarHBondContact O-N 2.87Å; L46-S49 PolarHBondContact O-N 2.8Å; L46-S49 PolarHBondContact O-OG 2.79Å; R47-S49 VanDerWaalsContact C-N 3.27Å; R47-S49 PolarHBondContact O-N 3.49Å |
| 50 | L | 59.8 | Low | 59.4 | Low | 133 Ų | 133 | 113.1 Ų | 113.1 | 70% | 0.696 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -81.3 | -27.1 | 176.4 | -75.3 | 154 | 0 | 0 | 0 | 113 | L46 R47 | L46-L50 HydrophobicContact CD2-CD1 4.49Å; L46-L50 HydrophobicContact CG-CD1 3.99Å; L46-L50 WeakPolarHBondContact O-CD1 3.38Å; L46-L50 WeakPolarHBondContact O-CG 3.43Å; L46-L50 PolarHBondContact O-N 3.43Å; R47-L50 PolarHBondContact O-N 2.81Å |
| 51 | G | 60.2 | Low | 58.4 | Low | 68 Ų | 68 | 119.6 Ų | 119.6 | 70% | 0.701 | 63% | 0.626 | S | S | * | * | S | Bend | trans | -88.3 | -5.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | R47 | R47-G51 PolarHBondContact O-N 3.37Š|
| 52 | K | 52.9 | Low | 57.3 | Low | 162 Ų | 162 | 121 Ų | 121 | 70% | 0.704 | 64% | 0.639 | S | S | * | * | S | Bend | trans | -81.8 | 123.1 | 159.8 | -72.5 | -179.7 | -179.8 | -173.2 | 0 | 105.6 | K48 | K48-K52 PolarHBondContact O-N 2.86Š|
| 53 | E | 47.8 | Very low | 56.7 | Low | 160 Ų | 160 | 128 Ų | 128 | 75% | 0.748 | 66% | 0.661 | S | S | * | * | trans | -31.4 | 136.8 | 174.4 | -91.5 | -168.5 | 151.3 | 0 | 0 | 110.1 | V55 | E53-V55 PolarHBondContact O-N 2.82Š| ||
| 54 | P | 47 | Very low | 55.8 | Low | 108 Ų | 108 | 127.8 Ų | 127.8 | 70% | 0.701 | 67% | 0.669 | S | S | * | * | trans | -49.4 | 117.1 | 166.9 | 24 | -31.1 | 0 | 0 | 0 | 104.2 | T56 | P54-T56 PolarHBondContact O-N 2.64Š| ||
| 55 | V | 44.9 | Very low | 54.8 | Low | 125 Ų | 125 | 131.7 Ų | 131.7 | 76% | 0.758 | 68% | 0.683 | S | S | * | * | trans | -42.9 | 109.5 | 169 | 168.1 | 0 | 0 | 0 | 0 | 102.1 | E53 V57 | E53-V55 PolarHBondContact O-N 2.82Å; V55-V57 WeakPolarHBondContact O-CG2 3.41Å; V55-V57 PolarHBondContact O-N 3.17Å | ||
| 56 | T | 43.7 | Very low | 54 | Low | 101 Ų | 101 | 132 Ų | 132 | 62% | 0.62 | 69% | 0.69 | S | S | * | * | trans | -63.2 | 95.6 | 178.3 | 26.9 | 0 | 0 | 0 | 0 | 100.3 | P54 N58 | P54-T56 PolarHBondContact O-N 2.64Å; T56-N58 PolarHBondContact O-N 3.32Å | ||
| 57 | V | 44.7 | Very low | 53.6 | Low | 113 Ų | 113 | 136.2 Ų | 136.2 | 69% | 0.685 | 70% | 0.704 | S | S | * | * | trans | -66.8 | 85.3 | 166 | -167.2 | 0 | 0 | 0 | 0 | 99.4 | V55 T59 | V55-V57 WeakPolarHBondContact O-CG2 3.41Å; V55-V57 PolarHBondContact O-N 3.17Å; V57-T59 HydrophobicContact CB-CG2 4.39Å; V57-T59 HydrophobicContact CG1-CG2 3.79Å; V57-T59 PolarHBondContact O-N 3.08Å | ||
| 58 | N | 44.6 | Very low | 53.4 | Low | 128 Ų | 128 | 137.8 Ų | 137.8 | 68% | 0.684 | 72% | 0.716 | S | S | * | * | trans | -66.1 | 81.2 | 170.6 | -123.8 | -22.8 | 0 | 0 | 0 | 101.2 | T56 K60 | T56-N58 PolarHBondContact O-N 3.32Å; N58-K60 PolarHBondContact O-N 2.76Å | ||
| 59 | T | 46.6 | Very low | 53 | Low | 109 Ų | 109 | 137.7 Ų | 137.7 | 67% | 0.669 | 73% | 0.729 | S | S | * | * | trans | -69.7 | 64.8 | 161.2 | 58.9 | 0 | 0 | 0 | 0 | 104.5 | V57 K61 | V57-T59 HydrophobicContact CB-CG2 4.39Å; V57-T59 HydrophobicContact CG1-CG2 3.79Å; V57-T59 PolarHBondContact O-N 3.08Å; T59-K61 PolarHBondContact O-N 2.88Å | ||
| 60 | K | 49.6 | Very low | 52.8 | Low | 183 Ų | 183 | 143.9 Ų | 143.9 | 80% | 0.796 | 75% | 0.747 | S | S | * | * | trans | -54.7 | 97.7 | 145.4 | -84.1 | -173.9 | 175.9 | 178.4 | 0 | 102.6 | N58 S62 | N58-K60 PolarHBondContact O-N 2.76Å; K60-S62 PolarHBondContact O-N 2.74Å; K60-S62 VanDerWaalsContact O-N 3.1Å | ||
| 61 | K | 56.5 | Low | 52.6 | Low | 193 Ų | 193 | 142.8 Ų | 142.8 | 84% | 0.839 | 75% | 0.75 | S | S | * | * | trans | -42.1 | 125.2 | 167.1 | -68 | -176.3 | 176.6 | -177.7 | 0 | 105.1 | T59 K63 | T59-K61 PolarHBondContact O-N 2.88Å; K61-K63 PolarHBondContact O-N 3.25Å | ||
| 62 | S | 53.6 | Low | 52.5 | Low | 100 Ų | 100 | 149.3 Ų | 149.3 | 70% | 0.699 | 76% | 0.759 | S | S | * | * | trans | -52.9 | 117.4 | 170.5 | 44.3 | 0 | 0 | 0 | 0 | 105.9 | K60 T64 | K60-S62 PolarHBondContact O-N 2.74Å; K60-S62 VanDerWaalsContact O-N 3.1Å; S62-T64 PolarHBondContact O-N 2.86Å; S62-T64 PolarHBondContact O-OG1 3.26Å; S62-T64 PolarHBondContact OG-OG1 3.44Å | ||
| 63 | K | 59.5 | Low | 52.5 | Low | 210 Ų | 210 | 146.8 Ų | 146.8 | 91% | 0.913 | 76% | 0.762 | S | S | * | * | trans | -73.2 | 73.3 | 171.9 | -161.4 | 172.4 | -173.9 | 176.4 | 0 | 105.3 | K61 R65 | K61-K63 PolarHBondContact O-N 3.25Å; K63-R65 PolarHBondContact O-N 2.9Å | ||
| 64 | T | 53.6 | Low | 52.9 | Low | 106 Ų | 106 | 144.6 Ų | 144.6 | 65% | 0.65 | 76% | 0.764 | S | S | * | * | trans | -65.2 | 102.6 | 174.2 | -44 | 0 | 0 | 0 | 0 | 105.4 | S62 V66 | S62-T64 PolarHBondContact O-N 2.86Å; S62-T64 PolarHBondContact O-OG1 3.26Å; S62-T64 PolarHBondContact OG-OG1 3.44Å; T64-V66 PolarHBondContact O-N 3.42Å | ||
| 65 | R | 51.3 | Low | 53 | Low | 215 Ų | 215 | 147.3 Ų | 147.3 | 81% | 0.811 | 77% | 0.773 | S | S | * | * | trans | -63.5 | 92.2 | 170.8 | 178.9 | 179.7 | 171.4 | -173.7 | -1.1 | 106.6 | K63 K67 | K63-R65 PolarHBondContact O-N 2.9Å; R65-K67 PolarHBondContact O-N 2.92Å | ||
| 66 | V | 55.9 | Low | 53.2 | Low | 120 Ų | 120 | 144.2 Ų | 144.2 | 73% | 0.727 | 77% | 0.766 | S | S | * | * | trans | -61.9 | 104.4 | 166.3 | -179.6 | 0 | 0 | 0 | 0 | 105.8 | T64 K68 | T64-V66 PolarHBondContact O-N 3.42Å; V66-K68 PolarHBondContact O-N 3.04Å | ||
| 67 | K | 62 | Low | 53.5 | Low | 171 Ų | 171 | 150.6 Ų | 150.6 | 74% | 0.743 | 78% | 0.779 | S | S | * | * | trans | -62.7 | 109.2 | 164.5 | -79.7 | -176.7 | 175.7 | 178.7 | 0 | 105.4 | R65 S69 | R65-K67 PolarHBondContact O-N 2.92Å; K67-S69 PolarHBondContact O-N 2.83Å | ||
| 68 | K | 60.8 | Low | 53.8 | Low | 204 Ų | 204 | 150.7 Ų | 150.7 | 89% | 0.887 | 78% | 0.78 | S | S | * | * | trans | -59.9 | 102 | 168.1 | -68.2 | -176.5 | 177 | -177.6 | 0 | 107 | V66 | V66-K68 PolarHBondContact O-N 3.04Š| ||
| 69 | S | 56.5 | Low | 53.9 | Low | 109 Ų | 109 | 149.6 Ų | 149.6 | 76% | 0.762 | 78% | 0.782 | S | S | * | * | trans | -66.5 | 130.2 | 163.6 | 34.1 | 0 | 0 | 0 | 0 | 107.5 | K67 S71 | K67-S69 PolarHBondContact O-N 2.83Å; S69-S71 PolarHBondContact O-N 2.68Å | ||
| 70 | K | 57.5 | Low | 53.8 | Low | 204 Ų | 204 | 150 Ų | 150 | 89% | 0.887 | 79% | 0.789 | S | S | * | * | trans | -72.6 | 89.2 | 179.8 | -158.1 | 175.9 | -172.5 | 177.1 | 0 | 107.2 | K72 | K70-K72 PolarHBondContact O-N 3.34Š| ||
| 71 | S | 56.7 | Low | 53.9 | Low | 110 Ų | 110 | 147 Ų | 147 | 77% | 0.769 | 79% | 0.791 | S | S | * | * | trans | -71.2 | 112.1 | 169 | 42.7 | 0 | 0 | 0 | 0 | 108.1 | S69 S73 | S69-S71 PolarHBondContact O-N 2.68Å; S71-S73 PolarHBondContact O-N 2.89Å; S71-S73 VanDerWaalsContact O-N 3.15Å | ||
| 72 | K | 57 | Low | 53.2 | Low | 205 Ų | 205 | 145.6 Ų | 145.6 | 89% | 0.891 | 79% | 0.793 | S | S | * | * | trans | -65.3 | 104.1 | 163.1 | -81.2 | 178.6 | 170.1 | 176.7 | 0 | 106.7 | K70 | K70-K72 PolarHBondContact O-N 3.34Š| ||
| 73 | S | 52.4 | Low | 52.8 | Low | 108 Ų | 108 | 144.3 Ų | 144.3 | 76% | 0.755 | 80% | 0.795 | S | S | * | * | trans | -79.5 | 115.4 | 160.1 | 56.9 | 0 | 0 | 0 | 0 | 107.2 | S71 D75 | S71-S73 PolarHBondContact O-N 2.89Å; S71-S73 VanDerWaalsContact O-N 3.15Å; S73-D75 PolarHBondContact O-N 3.21Å | ||
| 74 | S | 57 | Low | 52.1 | Low | 114 Ų | 114 | 141.7 Ų | 141.7 | 80% | 0.797 | 79% | 0.791 | S | S | * | * | trans | -76.5 | 113.6 | 162.9 | 48.9 | 0 | 0 | 0 | 0 | 107.3 | G76 | S74-G76 PolarHBondContact O-N 3.19Š| ||
| 75 | D | 49.8 | Very low | 51.7 | Low | 165 Ų | 165 | 145.5 Ų | 145.5 | 88% | 0.882 | 80% | 0.801 | S | S | * | * | trans | -56.3 | 121.9 | 166.7 | -89.5 | -37.5 | 0 | 0 | 0 | 109.5 | S73 | S73-D75 PolarHBondContact O-N 3.21Š| ||
| 76 | G | 47.8 | Very low | 51.5 | Low | 60 Ų | 60 | 139.4 Ų | 139.4 | 62% | 0.619 | 80% | 0.797 | S | S | * | * | trans | -126.3 | 103 | 168.5 | 0 | 0 | 0 | 0 | 0 | 108.3 | S74 | S74-G76 PolarHBondContact O-N 3.19Š| ||
| 77 | R | 50.7 | Low | 50.9 | Low | 235 Ų | 235 | 142.7 Ų | 142.7 | 89% | 0.887 | 80% | 0.804 | S | S | * | * | trans | 64.7 | 133.1 | 145.6 | -67.8 | 177.6 | 159.6 | 130.4 | -4.3 | 114.6 | ||||
| 78 | T | 50.5 | Low | 50.2 | Low | 116 Ų | 116 | 142.5 Ų | 142.5 | 71% | 0.712 | 81% | 0.81 | S | S | * | * | cis | 174.9 | 148.6 | 31.2 | 13.4 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 79 | S | 47.6 | Very low | 49.8 | Very low | 104 Ų | 104 | 142.2 Ų | 142.2 | 73% | 0.727 | 81% | 0.809 | S | S | * | * | trans | 71 | 108.5 | 143.9 | -45.7 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 80 | S | 44.6 | Very low | 49.5 | Very low | 117 Ų | 117 | 146.3 Ų | 146.3 | 82% | 0.818 | 81% | 0.813 | S | S | * | * | trans | -0.6 | 130.2 | 141.9 | 58 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 81 | S | 49.9 | Very low | 49 | Very low | 120 Ų | 120 | 141.7 Ų | 141.7 | 84% | 0.839 | 81% | 0.806 | S | S | * | * | trans | -156 | 124.9 | 133.9 | -175.8 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 82 | D | 43.4 | Very low | 48.6 | Very low | 165 Ų | 165 | 142.6 Ų | 142.6 | 88% | 0.882 | 81% | 0.807 | S | S | * | * | trans | -55.9 | 147.2 | 167.4 | -89.8 | -41.2 | 0 | 0 | 0 | 111.2 | ||||
| 83 | G | 44.5 | Very low | 48.2 | Very low | 72 Ų | 72 | 138.6 Ų | 138.6 | 74% | 0.742 | 80% | 0.799 | S | S | * | * | trans | -179 | 71.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | H85 | G83-H85 PolarHBondContact O-N 3.46Š| ||
| 84 | D | 44.2 | Very low | 48.4 | Very low | 155 Ų | 155 | 138.2 Ų | 138.2 | 83% | 0.829 | 79% | 0.794 | S | S | * | * | trans | -52.7 | 121.5 | 160.7 | -83.6 | -36.6 | 0 | 0 | 0 | 109.4 | ||||
| 85 | H | 44.9 | Very low | 48.2 | Very low | 186 Ų | 186 | 138.4 Ų | 138.4 | 86% | 0.861 | 79% | 0.793 | S | S | * | * | trans | -167.1 | 114.8 | 142.9 | -99.9 | -60.8 | 0 | 0 | 0 | 111.9 | G83 | G83-H85 PolarHBondContact O-N 3.46Š| ||
| 86 | A | 48.6 | Very low | 48.2 | Very low | 87 Ų | 87 | 142.3 Ų | 142.3 | 72% | 0.719 | 80% | 0.795 | S | S | * | * | trans | 54.2 | 110.3 | 136.2 | 0 | 0 | 0 | 0 | 0 | 119.9 | I88 | A86-I88 PolarHBondContact O-N 3.18Š| ||
| 87 | E | 42.2 | Very low | 48.1 | Very low | 189 Ų | 189 | 146.6 Ų | 146.6 | 88% | 0.883 | 80% | 0.804 | S | S | * | * | trans | -31.1 | 121.5 | 153.8 | -59.6 | 177.3 | 150.8 | 0 | 0 | 115.1 | ||||
| 88 | I | 47 | Very low | 47.7 | Very low | 168 Ų | 168 | 141.3 Ų | 141.3 | 86% | 0.862 | 80% | 0.798 | S | S | * | * | trans | -129 | 117.1 | 153.4 | -60.9 | 179.7 | 0 | 0 | 0 | 109 | A86 | A86-I88 PolarHBondContact O-N 3.18Š| ||
| 89 | K | 53.8 | Low | 47.3 | Very low | 198 Ų | 198 | 142 Ų | 142 | 86% | 0.861 | 80% | 0.802 | S | S | * | * | trans | -57.6 | 134.4 | -178.6 | -68.7 | 172.2 | 176.5 | 174.1 | 0 | 112 | ||||
| 90 | K | 48.7 | Very low | 47.3 | Very low | 194 Ų | 194 | 144.3 Ų | 144.3 | 84% | 0.843 | 81% | 0.805 | S | S | * | * | trans | -61.3 | 140.4 | 167.8 | -68.6 | 171.9 | 178.5 | 171.2 | 0 | 111.1 | ||||
| 91 | S | 46.6 | Very low | 47.3 | Very low | 108 Ų | 108 | 145.8 Ų | 145.8 | 76% | 0.755 | 80% | 0.8 | S | S | * | * | trans | -87.3 | 109.7 | 154.8 | 66.1 | 0 | 0 | 0 | 0 | 109.7 | V93 | S91-V93 PolarHBondContact O-N 3.16Š| ||
| 92 | V | 49.1 | Very low | 46.8 | Very low | 129 Ų | 129 | 147.9 Ų | 147.9 | 78% | 0.782 | 80% | 0.803 | S | S | * | * | trans | -74.6 | 107.7 | 166.3 | 173.5 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 93 | V | 49.6 | Very low | 47.2 | Very low | 120 Ų | 120 | 144.9 Ų | 144.9 | 73% | 0.727 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -91.1 | 121.2 | 169.7 | 179 | 0 | 0 | 0 | 0 | 108.1 | S91 | S91-V93 PolarHBondContact O-N 3.16Š|
| 94 | P | 55.7 | Low | 47 | Very low | 100 Ų | 100 | 150.2 Ų | 150.2 | 65% | 0.649 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 145.8 | 176.3 | 28.2 | -31.8 | 0 | 0 | 0 | 111 | R96 | P94-R96 PolarHBondContact O-N 3.07Š|
| 95 | P | 53.7 | Low | 46.8 | Very low | 119 Ų | 119 | 152.9 Ų | 152.9 | 77% | 0.773 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 121.5 | 177.6 | 27.8 | -31.2 | 0 | 0 | 0 | 110 | N97 | P95-N97 PolarHBondContact O-N 2.85Š|
| 96 | R | 49.9 | Very low | 46.7 | Very low | 247 Ų | 247 | 148.9 Ų | 148.9 | 93% | 0.932 | 79% | 0.793 | S | S | * | * | trans | -68.4 | 101.2 | 177.5 | -152.9 | 172.9 | -171.4 | 144.7 | -0.2 | 108.9 | P94 | P94-R96 PolarHBondContact O-N 3.07Š| ||
| 97 | N | 45.5 | Very low | 46.4 | Very low | 149 Ų | 149 | 156.3 Ų | 156.3 | 80% | 0.797 | 80% | 0.802 | S | S | * | * | trans | -63.9 | 136 | 171.9 | -88.8 | -32.3 | 0 | 0 | 0 | 110.5 | P95 | P95-N97 PolarHBondContact O-N 2.85Š| ||
| 98 | T | 42.4 | Very low | 46.6 | Very low | 124 Ų | 124 | 154.1 Ų | 154.1 | 76% | 0.761 | 80% | 0.795 | S | S | * | * | trans | -73.2 | 124 | 179.2 | 48.9 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 99 | T | 41.6 | Very low | 46.4 | Very low | 131 Ų | 131 | 151.4 Ų | 151.4 | 80% | 0.804 | 79% | 0.788 | S | S | * | * | trans | -102.7 | 103.5 | 163.1 | -50.9 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 100 | I | 47.7 | Very low | 45.7 | Very low | 153 Ų | 153 | 148.1 Ų | 148.1 | 79% | 0.785 | 79% | 0.785 | S | S | * | * | trans | -91.6 | 105.9 | 167.5 | -60.2 | 175.1 | 0 | 0 | 0 | 105.9 | N102 | I100-N102 PolarHBondContact O-N 3.27Š| ||
| 101 | M | 45.2 | Very low | 45.1 | Very low | 147 Ų | 147 | 142.8 Ų | 142.8 | 72% | 0.724 | 78% | 0.777 | S | S | * | * | trans | -64.6 | 123.4 | 171.9 | -78.4 | -173 | 65.6 | 0 | 0 | 109.6 | T103 | M101-T103 HydrophobicContact CE-CG2 4Š| ||
| 102 | N | 38.6 | Very low | 44.9 | Very low | 165 Ų | 165 | 143.3 Ų | 143.3 | 88% | 0.882 | 78% | 0.776 | S | S | * | * | trans | -95.8 | 98.4 | 172.9 | -161.7 | 13.4 | 0 | 0 | 0 | 106.6 | I100 | I100-N102 PolarHBondContact O-N 3.27Š| ||
| 103 | T | 51 | Low | 44.5 | Very low | 101 Ų | 101 | 143 Ų | 143 | 62% | 0.62 | 77% | 0.774 | S | S | * | * | trans | -129.3 | 115.2 | 178.5 | 37.5 | 0 | 0 | 0 | 0 | 112.2 | M101 | M101-T103 HydrophobicContact CE-CG2 4Š| ||
| 104 | Q | 41.3 | Very low | 44.2 | Very low | 185 Ų | 185 | 142.9 Ų | 142.9 | 86% | 0.864 | 77% | 0.773 | S | S | * | * | trans | 63.5 | 100.5 | 150 | -87 | 177.5 | -28.7 | 0 | 0 | 119.8 | S106 | Q104-S106 PolarHBondContact O-N 2.87Š| ||
| 105 | K | 40.5 | Very low | 43.3 | Very low | 211 Ų | 211 | 146.5 Ų | 146.5 | 92% | 0.917 | 78% | 0.782 | S | S | * | * | trans | -55.2 | 96.9 | 147.5 | -66.8 | 171.9 | 176.2 | 178.6 | 0 | 109.9 | R107 | K105-R107 PolarHBondContact O-N 3.24Š| ||
| 106 | S | 43 | Very low | 42.8 | Very low | 102 Ų | 102 | 146.7 Ų | 146.7 | 71% | 0.713 | 78% | 0.78 | S | S | * | * | trans | -84.2 | 97 | 160.1 | 60.9 | 0 | 0 | 0 | 0 | 108.6 | Q104 I108 | Q104-S106 PolarHBondContact O-N 2.87Å; S106-I108 PolarHBondContact O-N 2.89Å | ||
| 107 | R | 42.4 | Very low | 42.1 | Very low | 242 Ų | 242 | 138.5 Ų | 138.5 | 91% | 0.913 | 76% | 0.761 | S | S | * | * | trans | -71.9 | 102.6 | 171.9 | -162.7 | -177.8 | -167.4 | -172.8 | 2.6 | 107.4 | K105 P109 | K105-R107 PolarHBondContact O-N 3.24Å; R107-P109 WeakPolarHBondContact O-CD 3.41Å | ||
| 108 | I | 46.3 | Very low | 42.1 | Very low | 144 Ų | 144 | 136 Ų | 136 | 74% | 0.738 | 75% | 0.753 | S | S | * | * | trans | -82.9 | 116.1 | 169.9 | -59.1 | 170.8 | 0 | 0 | 0 | 106.9 | S106 V110 | S106-I108 PolarHBondContact O-N 2.89Å; I108-V110 PolarHBondContact O-N 3.4Å | ||
| 109 | P | 41.8 | Very low | 42 | Very low | 110 Ų | 110 | 137.8 Ų | 137.8 | 71% | 0.714 | 76% | 0.755 | S | S | * | * | trans | -73.6 | 115.5 | 172.6 | 28.7 | -29.1 | 0 | 0 | 0 | 109 | R107 A111 | R107-P109 WeakPolarHBondContact O-CD 3.41Å; P109-A111 VanDerWaalsContact C-N 3.29Å; P109-A111 PolarHBondContact O-N 3.24Å | ||
| 110 | V | 38.9 | Very low | 42.2 | Very low | 129 Ų | 129 | 140.9 Ų | 140.9 | 78% | 0.782 | 76% | 0.757 | S | S | * | * | trans | -76.6 | 88.1 | 166 | 178.5 | 0 | 0 | 0 | 0 | 107 | I108 | I108-V110 PolarHBondContact O-N 3.4Š| ||
| 111 | A | 37.3 | Very low | 42 | Very low | 82 Ų | 82 | 141.5 Ų | 141.5 | 68% | 0.678 | 76% | 0.757 | S | S | * | * | trans | -109.1 | 75.1 | 162.7 | 0 | 0 | 0 | 0 | 0 | 107.4 | P109 T113 | P109-A111 VanDerWaalsContact C-N 3.29Å; P109-A111 PolarHBondContact O-N 3.24Å; A111-T113 VanDerWaalsContact C-N 3.31Å; A111-T113 PolarHBondContact O-N 2.96Å | ||
| 112 | T | 42.5 | Very low | 41.9 | Very low | 119 Ų | 119 | 141.6 Ų | 141.6 | 73% | 0.73 | 76% | 0.76 | S | S | * | * | trans | -90 | 79.4 | 163.2 | 42.1 | 0 | 0 | 0 | 0 | 107.6 | V114 | T112-V114 PolarHBondContact O-N 3.47Š| ||
| 113 | T | 38.8 | Very low | 42.1 | Very low | 122 Ų | 122 | 142.2 Ų | 142.2 | 75% | 0.748 | 76% | 0.763 | S | S | * | * | trans | -67.6 | 106 | 154.8 | -37.4 | 0 | 0 | 0 | 0 | 105.3 | A111 E115 | A111-T113 VanDerWaalsContact C-N 3.31Å; A111-T113 PolarHBondContact O-N 2.96Å; T113-E115 PolarHBondContact O-N 3.33Å | ||
| 114 | V | 43.4 | Very low | 41.5 | Very low | 118 Ų | 118 | 141.3 Ų | 141.3 | 72% | 0.715 | 77% | 0.765 | S | S | * | * | trans | -73.2 | 88.6 | 167.8 | 178.9 | 0 | 0 | 0 | 0 | 105.4 | T112 V116 | T112-V114 PolarHBondContact O-N 3.47Å; V114-V116 VanDerWaalsContact C-N 3.31Å; V114-V116 HydrophobicContact CG1-CG2 4.04Å; V114-V116 PolarHBondContact O-N 2.76Å | ||
| 115 | E | 38.6 | Very low | 41.4 | Very low | 177 Ų | 177 | 141.7 Ų | 141.7 | 83% | 0.827 | 76% | 0.764 | S | S | * | * | trans | -65.9 | 102.6 | 157.4 | -83.5 | -154.8 | 153.8 | 0 | 0 | 106.7 | T113 S117 | T113-E115 PolarHBondContact O-N 3.33Å; E115-S117 PolarHBondContact O-N 3.49Å | ||
| 116 | V | 42.7 | Very low | 41.5 | Very low | 122 Ų | 122 | 139.5 Ų | 139.5 | 74% | 0.739 | 76% | 0.762 | S | S | * | * | trans | -64.9 | 93 | 164.5 | -178.3 | 0 | 0 | 0 | 0 | 105.6 | V114 P118 | V114-V116 VanDerWaalsContact C-N 3.31Å; V114-V116 HydrophobicContact CG1-CG2 4.04Å; V114-V116 PolarHBondContact O-N 2.76Å; V116-P118 WeakPolarHBondContact O-CD 3.46Å | ||
| 117 | S | 35.3 | Very low | 41.6 | Very low | 75 Ų | 75 | 142.2 Ų | 142.2 | 52% | 0.524 | 77% | 0.769 | S | S | . | * | trans | -56.8 | 122.8 | 173.4 | -173.9 | 0 | 0 | 0 | 0 | 108.3 | E115 M119 | E115-S117 PolarHBondContact O-N 3.49Å; S117-M119 PolarHBondContact O-N 3.02Å | ||
| 118 | P | 44.3 | Very low | 41.5 | Very low | 97 Ų | 97 | 136.2 Ų | 136.2 | 63% | 0.63 | 76% | 0.761 | S | S | * | * | G | 310 helix | trans | -71.2 | 13 | -175.9 | 27.6 | -33 | 0 | 0 | 0 | 113.7 | V116 F120 | V116-P118 WeakPolarHBondContact O-CD 3.46Å; P118-F120 PolarHBondContact O-N 3.39Å |
| 119 | M | 41.4 | Very low | 41.4 | Very low | 162 Ų | 162 | 138 Ų | 138 | 80% | 0.798 | 77% | 0.766 | S | S | * | * | G | 310 helix | trans | -78.7 | -0.6 | -171.9 | -147.1 | 169.5 | 179.3 | 0 | 0 | 114.5 | S117 | S117-M119 PolarHBondContact O-N 3.02Š|
| 120 | F | 45.3 | Very low | 41.4 | Very low | 195 Ų | 195 | 138.8 Ų | 138.8 | 86% | 0.855 | 77% | 0.765 | S | S | * | * | G | 310 helix | trans | -110.9 | 10.7 | 179 | -69.9 | -74.9 | 0 | 0 | 0 | 114.6 | P118 | P118-F120 PolarHBondContact O-N 3.39Š|
| 121 | Q | 43.7 | Very low | 41.4 | Very low | 166 Ų | 166 | 138.8 Ų | 138.8 | 78% | 0.776 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -89 | 2.1 | -179.7 | -87.2 | -179.4 | -10.4 | 0 | 0 | 115.5 | ||
| 122 | N | 43.4 | Very low | 41.4 | Very low | 149 Ų | 149 | 141.1 Ų | 141.1 | 80% | 0.797 | 76% | 0.762 | S | S | * | * | trans | -119.5 | 14.2 | -173.1 | -69.5 | -32.7 | 0 | 0 | 0 | 115.9 | A124 | N122-A124 PolarHBondContact O-N 3.48Š| ||
| 123 | L | 41.3 | Very low | 41.2 | Very low | 179 Ų | 179 | 144.5 Ų | 144.5 | 94% | 0.937 | 77% | 0.766 | S | S | * | * | trans | -101.3 | 64 | 174.5 | -105.3 | 73.4 | 0 | 0 | 0 | 110.8 | ||||
| 124 | A | 39 | Very low | 41.2 | Very low | 81 Ų | 81 | 141.9 Ų | 141.9 | 67% | 0.669 | 76% | 0.763 | S | S | * | * | trans | -142.7 | 91.9 | 168.9 | 0 | 0 | 0 | 0 | 0 | 107.5 | N122 | N122-A124 PolarHBondContact O-N 3.48Š| ||
| 125 | K | 39.9 | Very low | 41.1 | Very low | 193 Ų | 193 | 143.6 Ų | 143.6 | 84% | 0.839 | 77% | 0.768 | S | S | * | * | trans | 147.7 | 102 | 166.4 | -84.2 | 159.5 | -167.1 | -166.4 | 0 | 106.2 | ||||
| 126 | D | 41.7 | Very low | 41.4 | Very low | 166 Ų | 166 | 142.3 Ų | 142.3 | 89% | 0.888 | 77% | 0.767 | S | S | * | * | 176.3 | 144.4 | 128.6 | -80.7 | -18 | 0 | 0 | 0 | 109.7 | |||||
| 127 | D | 45.6 | Very low | 41.6 | Very low | 158 Ų | 158 | 146.9 Ų | 146.9 | 85% | 0.845 | 77% | 0.771 | S | S | * | * | trans | -59.2 | 160.6 | -160.6 | -91.8 | -50.8 | 0 | 0 | 0 | 117 | ||||
| 128 | P | 39.6 | Very low | 42 | Very low | 116 Ų | 116 | 149.2 Ų | 149.2 | 75% | 0.753 | 78% | 0.782 | S | S | * | * | trans | -89.7 | 108.8 | 179 | 34.6 | -25.8 | 0 | 0 | 0 | 110 | ||||
| 129 | E | 45.9 | Very low | 41.8 | Very low | 181 Ų | 181 | 151 Ų | 151 | 85% | 0.846 | 79% | 0.791 | S | S | * | * | trans | -146.1 | 118 | 162.2 | -135.1 | 178.1 | -173.1 | 0 | 0 | 111.9 | ||||
| 130 | N | 40 | Very low | 42.1 | Very low | 128 Ų | 128 | 150.5 Ų | 150.5 | 68% | 0.684 | 79% | 0.79 | S | S | * | * | trans | 77.5 | 123.6 | 144.3 | -119.1 | 6.8 | 0 | 0 | 0 | 121.6 | ||||
| 131 | D | 39.6 | Very low | 42.3 | Very low | 128 Ų | 128 | 150.8 Ų | 150.8 | 68% | 0.684 | 79% | 0.791 | S | S | * | * | trans | 67.9 | 104.1 | 135.5 | -71.2 | -18.3 | 0 | 0 | 0 | 120.2 | ||||
| 132 | D | 37.8 | Very low | 42.5 | Very low | 132 Ų | 132 | 152.9 Ų | 152.9 | 71% | 0.706 | 80% | 0.798 | S | S | * | * | 82.5 | 122.3 | 113.4 | -141.7 | 21.7 | 0 | 0 | 0 | 116.9 | |||||
| 133 | K | 37.4 | Very low | 42.4 | Very low | 189 Ų | 189 | 149.1 Ų | 149.1 | 82% | 0.822 | 80% | 0.795 | S | S | * | * | trans | 78.4 | 113.1 | 165.6 | -51.8 | 176.5 | -174.3 | 175.9 | 0 | 117.4 | ||||
| 134 | G | 38.6 | Very low | 42.4 | Very low | 67 Ų | 67 | 150.4 Ų | 150.4 | 69% | 0.691 | 79% | 0.792 | S | S | * | * | trans | 174.5 | 61.5 | 160.5 | 0 | 0 | 0 | 0 | 0 | 115.7 | N136 | G134-N136 PolarHBondContact O-N 2.97Š| ||
| 135 | D | 42.6 | Very low | 42.8 | Very low | 154 Ų | 154 | 156.3 Ų | 156.3 | 82% | 0.824 | 80% | 0.803 | S | S | * | * | trans | -64.6 | 82.1 | 161.5 | -86.1 | -19.9 | 0 | 0 | 0 | 109.5 | W137 | D135-W137 PolarHBondContact O-N 2.86Š| ||
| 136 | N | 44.8 | Very low | 43.1 | Very low | 150 Ų | 150 | 152.9 Ų | 152.9 | 80% | 0.802 | 80% | 0.799 | S | S | * | * | trans | -90.8 | 77.7 | -177.2 | -136.2 | 10.1 | 0 | 0 | 0 | 109.9 | G134 V138 | G134-N136 PolarHBondContact O-N 2.97Å; N136-V138 PolarHBondContact O-N 3.23Å | ||
| 137 | W | 46.7 | Very low | 43.1 | Very low | 218 Ų | 218 | 150.6 Ų | 150.6 | 83% | 0.826 | 79% | 0.791 | S | S | * | * | trans | -72.5 | 110.3 | 170 | -68 | 90.7 | 0 | 0 | 0 | 109.9 | D135 T139 | D135-W137 PolarHBondContact O-N 2.86Å; W137-T139 PolarHBondContact O-N 3.47Å; W137-T139 VanDerWaalsContact O-N 3.11Å | ||
| 138 | V | 43.2 | Very low | 42.7 | Very low | 124 Ų | 124 | 149.9 Ų | 149.9 | 75% | 0.752 | 79% | 0.787 | S | S | * | * | trans | -74 | 99 | 172.2 | 179.8 | 0 | 0 | 0 | 0 | 109.5 | N136 I140 | N136-V138 PolarHBondContact O-N 3.23Å; V138-I140 HydrophobicContact CG1-CG1 4.26Å; V138-I140 PolarHBondContact O-N 2.95Å | ||
| 139 | T | 40 | Very low | 42.7 | Very low | 134 Ų | 134 | 153.5 Ų | 153.5 | 82% | 0.822 | 79% | 0.794 | S | S | * | * | trans | -74.6 | 108.4 | 168 | 33.5 | 0 | 0 | 0 | 0 | 111.1 | W137 | W137-T139 PolarHBondContact O-N 3.47Å; W137-T139 VanDerWaalsContact O-N 3.11Å | ||
| 140 | I | 48.9 | Very low | 42.2 | Very low | 152 Ų | 152 | 155.4 Ų | 155.4 | 78% | 0.779 | 79% | 0.793 | S | S | * | * | trans | -84.5 | 116 | 170.5 | -50 | 174.7 | 0 | 0 | 0 | 108.5 | V138 K142 | V138-I140 HydrophobicContact CG1-CG1 4.26Å; V138-I140 PolarHBondContact O-N 2.95Å; I140-K142 PolarHBondContact O-N 3.38Å | ||
| 141 | K | 48.6 | Very low | 42.4 | Very low | 201 Ų | 201 | 153.3 Ų | 153.3 | 87% | 0.874 | 79% | 0.787 | S | S | * | * | trans | -59.7 | 115.9 | 173.9 | -80.4 | -176.7 | 174.6 | 176.3 | 0 | 110.2 | G143 | K141-G143 PolarHBondContact O-N 3.37Å; K141-G143 VanDerWaalsContact O-N 3.16Å | ||
| 142 | K | 47.2 | Very low | 42.4 | Very low | 210 Ų | 210 | 156 Ų | 156 | 91% | 0.913 | 79% | 0.792 | S | S | * | * | trans | -62.8 | 112.9 | 166.8 | -96.7 | -176.5 | 176.4 | 174.1 | 0 | 109.4 | I140 K144 | I140-K142 PolarHBondContact O-N 3.38Å; K142-K144 PolarHBondContact O-N 3.1Å | ||
| 143 | G | 43.1 | Very low | 42.8 | Very low | 71 Ų | 71 | 159 Ų | 159 | 73% | 0.732 | 80% | 0.795 | S | S | * | * | trans | -57.4 | 131.6 | 166.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | K141 K145 | K141-G143 PolarHBondContact O-N 3.37Å; K141-G143 VanDerWaalsContact O-N 3.16Å; G143-K145 PolarHBondContact O-N 3.21Å; G143-K145 VanDerWaalsContact O-N 3.17Å | ||
| 144 | K | 39.9 | Very low | 43.2 | Very low | 205 Ų | 205 | 160.3 Ų | 160.3 | 89% | 0.891 | 80% | 0.801 | S | S | * | * | trans | -58.6 | 106.3 | -179.1 | -159.6 | 175.1 | -173.2 | 178.7 | 0 | 110.1 | K142 | K142-K144 PolarHBondContact O-N 3.1Š| ||
| 145 | K | 48.4 | Very low | 43.5 | Very low | 205 Ų | 205 | 165.5 Ų | 165.5 | 89% | 0.891 | 81% | 0.807 | S | S | * | * | trans | -91.5 | 109.7 | 165.3 | -80.9 | -171.6 | 176.4 | -177.2 | 0 | 108.8 | G143 T147 | G143-K145 PolarHBondContact O-N 3.21Å; G143-K145 VanDerWaalsContact O-N 3.17Å; K145-T147 PolarHBondContact O-N 3.32Å | ||
| 146 | T | 46.2 | Very low | 43.6 | Very low | 122 Ų | 122 | 162.4 Ų | 162.4 | 75% | 0.748 | 80% | 0.802 | S | S | * | * | trans | -57.9 | 113.9 | 165.8 | 41.2 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 147 | T | 40.2 | Very low | 43.7 | Very low | 117 Ų | 117 | 162.7 Ų | 162.7 | 72% | 0.718 | 80% | 0.802 | S | S | * | * | 43.2 | 126.9 | 127.1 | -39.6 | 0 | 0 | 0 | 0 | 120 | K145 | K145-T147 PolarHBondContact O-N 3.32Š| |||
| 148 | D | 37.7 | Very low | 43.8 | Very low | 143 Ų | 143 | 161.6 Ų | 161.6 | 77% | 0.765 | 80% | 0.804 | S | S | * | * | trans | 68.7 | 86.5 | 153.8 | -65.9 | -18.7 | 0 | 0 | 0 | 119.5 | ||||
| 149 | Q | 39.1 | Very low | 44 | Very low | 193 Ų | 193 | 163.7 Ų | 163.7 | 90% | 0.902 | 81% | 0.805 | S | S | * | * | -162.2 | 114 | 121.3 | -105.3 | 170.6 | 64.8 | 0 | 0 | 109 | P151 | Q149-P151 WeakPolarHBondContact O-CD 3.38Š| |||
| 150 | R | 35.9 | Very low | 44.1 | Very low | 221 Ų | 221 | 163 Ų | 163 | 83% | 0.834 | 80% | 0.801 | S | S | * | * | trans | -99.2 | 103.3 | 174.4 | -176.4 | -175.5 | -170.2 | -177.3 | 5.7 | 108.3 | ||||
| 151 | P | 45.4 | Very low | 44 | Very low | 84 Ų | 84 | 163.9 Ų | 163.9 | 55% | 0.545 | 80% | 0.799 | S | S | . | * | trans | -87.5 | 116.8 | 163.4 | 12.2 | 4.6 | 0 | 0 | 0 | 108.9 | Q149 Y153 | Q149-P151 WeakPolarHBondContact O-CD 3.38Å; P151-Y153 HydrophobicContact CB-CD2 3.8Å; P151-Y153 HydrophobicContact CB-CE2 3.33Å; P151-Y153 HydrophobicContact CG-CD2 4.46Å; P151-Y153 HydrophobicContact CG-CE2 3.99Å; P151-Y153 PolarHBondContact O-N 3.27Å; P151-Y153 VanDerWaalsContact O-N 3.15Å | ||
| 152 | K | 39.5 | Very low | 43.7 | Very low | 183 Ų | 183 | 160.6 Ų | 160.6 | 80% | 0.796 | 80% | 0.796 | S | S | * | * | trans | -67.8 | 102.1 | 165.8 | -70.6 | 177.9 | 177.3 | 176.6 | 0 | 108.2 | ||||
| 153 | Y | 44.6 | Very low | 43.5 | Very low | 196 Ų | 196 | 157.9 Ų | 157.9 | 77% | 0.769 | 79% | 0.79 | S | S | * | * | trans | -111.6 | 112.5 | 161.9 | -64 | -67.6 | 0 | 0 | 0 | 108.8 | P151 E155 | P151-Y153 HydrophobicContact CB-CD2 3.8Å; P151-Y153 HydrophobicContact CB-CE2 3.33Å; P151-Y153 HydrophobicContact CG-CD2 4.46Å; P151-Y153 HydrophobicContact CG-CE2 3.99Å; P151-Y153 PolarHBondContact O-N 3.27Å; P151-Y153 VanDerWaalsContact O-N 3.15Å; Y153-E155 PolarHBondContact O-N 3.5Å | ||
| 154 | K | 46.2 | Very low | 43.4 | Very low | 217 Ų | 217 | 161.7 Ų | 161.7 | 94% | 0.943 | 79% | 0.792 | S | S | * | * | trans | -73.6 | 95 | 162.4 | -73.4 | -175.8 | 174.9 | -173.8 | 0 | 106.5 | ||||
| 155 | E | 46.4 | Very low | 43.4 | Very low | 176 Ų | 176 | 157.3 Ų | 157.3 | 82% | 0.822 | 79% | 0.787 | S | S | * | * | trans | -85.7 | 114.3 | 168.3 | -100.6 | -179.9 | 166 | 0 | 0 | 109.3 | Y153 I157 | Y153-E155 PolarHBondContact O-N 3.5Å; E155-I157 PolarHBondContact O-N 2.86Å | ||
| 156 | A | 43.7 | Very low | 43.1 | Very low | 88 Ų | 88 | 155.6 Ų | 155.6 | 73% | 0.727 | 78% | 0.782 | S | S | * | * | trans | -61.6 | 114.1 | 166.5 | 0 | 0 | 0 | 0 | 0 | 108.4 | K158 | A156-K158 PolarHBondContact O-N 3.32Š| ||
| 157 | I | 46.9 | Very low | 42.9 | Very low | 156 Ų | 156 | 155.2 Ų | 155.2 | 80% | 0.8 | 78% | 0.779 | S | S | * | * | trans | -61.3 | 103.8 | 171.3 | -61.5 | 169 | 0 | 0 | 0 | 106.9 | E155 E159 | E155-I157 PolarHBondContact O-N 2.86Å; I157-E159 HydrophobicContact CG2-CG 4.42Å; I157-E159 PolarHBondContact O-N 3.14Å | ||
| 158 | K | 49.3 | Very low | 42.9 | Very low | 196 Ų | 196 | 157.1 Ų | 157.1 | 85% | 0.852 | 78% | 0.783 | S | S | * | * | trans | -85.1 | 100.3 | 165.8 | -79.7 | -176.5 | 176.8 | 179.1 | 0 | 107.2 | A156 T160 | A156-K158 PolarHBondContact O-N 3.32Å; K158-T160 PolarHBondContact O-N 3.49Å | ||
| 159 | E | 46.9 | Very low | 43 | Very low | 168 Ų | 168 | 156.3 Ų | 156.3 | 79% | 0.785 | 78% | 0.784 | S | S | * | * | trans | -55.4 | 122.8 | 173 | -69.2 | 179.5 | 163.3 | 0 | 0 | 110.8 | I157 K161 | I157-E159 HydrophobicContact CG2-CG 4.42Å; I157-E159 PolarHBondContact O-N 3.14Å; E159-K161 PolarHBondContact O-N 3.37Å; E159-K161 VanDerWaalsContact O-N 3.13Å | ||
| 160 | T | 43 | Very low | 43 | Very low | 118 Ų | 118 | 152.2 Ų | 152.2 | 72% | 0.724 | 78% | 0.776 | S | S | * | * | trans | -70.1 | 100.1 | 169.2 | 32.5 | 0 | 0 | 0 | 0 | 109.4 | K158 T162 | K158-T160 PolarHBondContact O-N 3.49Å; T160-T162 PolarHBondContact O-N 3.26Å; T160-T162 VanDerWaalsContact O-N 3.13Å | ||
| 161 | K | 46.5 | Very low | 43.2 | Very low | 172 Ų | 172 | 151.7 Ų | 151.7 | 75% | 0.748 | 78% | 0.78 | S | S | * | * | trans | -61.8 | 109.7 | 171.3 | -70.5 | -174.3 | 176.1 | -171.4 | 0 | 110.5 | E159 | E159-K161 PolarHBondContact O-N 3.37Å; E159-K161 VanDerWaalsContact O-N 3.13Å | ||
| 162 | T | 41.4 | Very low | 42.9 | Very low | 131 Ų | 131 | 151 Ų | 151 | 80% | 0.804 | 79% | 0.789 | S | S | * | * | trans | -86.7 | 118.8 | 166.6 | -19.2 | 0 | 0 | 0 | 0 | 107.6 | T160 | T160-T162 PolarHBondContact O-N 3.26Å; T160-T162 VanDerWaalsContact O-N 3.13Å | ||
| 163 | I | 44.2 | Very low | 42.8 | Very low | 154 Ų | 154 | 150.9 Ų | 150.9 | 79% | 0.79 | 79% | 0.791 | S | S | * | * | trans | -85.7 | 113.5 | 179.4 | -62.1 | 167.7 | 0 | 0 | 0 | 107.5 | ||||
| 164 | I | 40.9 | Very low | 42.7 | Very low | 151 Ų | 151 | 149.2 Ų | 149.2 | 77% | 0.774 | 80% | 0.795 | S | S | * | * | trans | -97.1 | 122.8 | 166.1 | -58.7 | 173.6 | 0 | 0 | 0 | 106.5 | E166 | I164-E166 PolarHBondContact O-N 3.25Š| ||
| 165 | S | 39 | Very low | 42.1 | Very low | 112 Ų | 112 | 142.2 Ų | 142.2 | 78% | 0.783 | 79% | 0.785 | S | S | * | * | trans | -80.4 | 104.1 | 177.4 | -49.9 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 166 | E | 42.6 | Very low | 41.8 | Very low | 170 Ų | 170 | 142.1 Ų | 142.1 | 79% | 0.794 | 78% | 0.784 | S | S | * | * | trans | -90.7 | 132.5 | 174.5 | -152.9 | 171.4 | -158 | 0 | 0 | 110.8 | I164 | I164-E166 PolarHBondContact O-N 3.25Š| ||
| 167 | V | 41.8 | Very low | 41.6 | Very low | 114 Ų | 114 | 143.9 Ų | 143.9 | 69% | 0.691 | 78% | 0.781 | S | S | * | * | trans | -84.6 | 110.5 | 178.3 | 174.1 | 0 | 0 | 0 | 0 | 108.1 | T169 | V167-T169 PolarHBondContact O-N 2.96Š| ||
| 168 | I | 40.5 | Very low | 41.3 | Very low | 156 Ų | 156 | 144.1 Ų | 144.1 | 80% | 0.8 | 78% | 0.779 | S | S | * | * | trans | -78.3 | 109.1 | 174.8 | -57.6 | 169 | 0 | 0 | 0 | 108.1 | ||||
| 169 | T | 39.6 | Very low | 40.8 | Very low | 127 Ų | 127 | 141.8 Ų | 141.8 | 78% | 0.779 | 78% | 0.775 | S | S | * | * | trans | -85.8 | 104 | 161.8 | 41.9 | 0 | 0 | 0 | 0 | 108.5 | V167 K171 | V167-T169 PolarHBondContact O-N 2.96Å; T169-K171 PolarHBondContact O-N 2.98Å | ||
| 170 | S | 39.5 | Very low | 40.1 | Very low | 106 Ų | 106 | 140 Ų | 140 | 74% | 0.741 | 78% | 0.776 | S | S | * | * | trans | -70.5 | 115.8 | 171.1 | 56.8 | 0 | 0 | 0 | 0 | 109.5 | G172 | S170-G172 PolarHBondContact O-N 3.04Å; S170-G172 VanDerWaalsContact O-N 3.1Å | ||
| 171 | K | 40.4 | Very low | 39.9 | Very low | 211 Ų | 211 | 138.5 Ų | 138.5 | 92% | 0.917 | 78% | 0.775 | S | S | * | * | trans | -72.9 | 96.7 | 166.6 | -153.8 | -179.1 | -175.1 | -173.9 | 0 | 107.2 | T169 E173 | T169-K171 PolarHBondContact O-N 2.98Å; K171-E173 PolarHBondContact O-N 2.93Å | ||
| 172 | G | 38.2 | Very low | 39.2 | Very low | 70 Ų | 70 | 136 Ų | 136 | 72% | 0.722 | 78% | 0.779 | S | S | * | * | trans | -76.1 | 104.6 | 170.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | S170 N174 | S170-G172 PolarHBondContact O-N 3.04Å; S170-G172 VanDerWaalsContact O-N 3.1Å; G172-N174 PolarHBondContact O-N 2.8Å | ||
| 173 | E | 36.3 | Very low | 39.2 | Very low | 179 Ų | 179 | 136.2 Ų | 136.2 | 84% | 0.836 | 78% | 0.78 | S | S | * | * | trans | -68.1 | 111.9 | 160.2 | -177 | 179.3 | 170.7 | 0 | 0 | 107.8 | K171 | K171-E173 PolarHBondContact O-N 2.93Š| ||
| 174 | N | 42.5 | Very low | 38.8 | Very low | 161 Ų | 161 | 137.8 Ų | 137.8 | 86% | 0.861 | 78% | 0.784 | S | S | * | * | trans | 177.2 | 104.8 | 162.3 | -86.7 | -20.3 | 0 | 0 | 0 | 102.9 | G172 | G172-N174 PolarHBondContact O-N 2.8Š| ||
| 175 | G | 35 | Very low | 38.7 | Very low | 71 Ų | 71 | 136.1 Ų | 136.1 | 73% | 0.732 | 79% | 0.786 | S | S | * | * | 103.2 | 123.2 | 64.2 | 0 | 0 | 0 | 0 | 0 | 106.6 | |||||
| 176 | E | 38.9 | Very low | 38.3 | Very low | 173 Ų | 173 | 134.6 Ų | 134.6 | 81% | 0.808 | 79% | 0.788 | S | S | * | * | trans | 85.9 | 97.3 | 148.9 | -126.2 | 165.4 | -175.5 | 0 | 0 | 119.7 | ||||
| 177 | N | 39.5 | Very low | 38 | Very low | 125 Ų | 125 | 132.6 Ų | 132.6 | 67% | 0.668 | 79% | 0.787 | S | S | * | * | 65.3 | 145.9 | 120.5 | -54.9 | -17.4 | 0 | 0 | 0 | 123.1 | |||||
| 178 | H | 40.9 | Very low | 37.7 | Very low | 161 Ų | 161 | 136.1 Ų | 136.1 | 75% | 0.745 | 80% | 0.796 | S | S | * | * | trans | 87.8 | 98.1 | 160 | -60.9 | -73.6 | 0 | 0 | 0 | 116.9 | ||||
| 179 | L | 38.7 | Very low | 38.2 | Very low | 147 Ų | 147 | 134.3 Ų | 134.3 | 77% | 0.77 | 80% | 0.795 | S | S | * | * | 62.2 | 108 | 82.5 | -85.8 | 154.5 | 0 | 0 | 0 | 113.8 | |||||
| 180 | V | 33.8 | Very low | 38.3 | Very low | 132 Ų | 132 | 134.1 Ų | 134.1 | 80% | 0.8 | 79% | 0.793 | S | S | * | * | 39.3 | 117.8 | 127.4 | -176.8 | 0 | 0 | 0 | 0 | 116.9 | |||||
| 181 | A | 38.2 | Very low | 38.6 | Very low | 85 Ų | 85 | 134.7 Ų | 134.7 | 70% | 0.702 | 79% | 0.794 | S | S | * | * | 177.9 | 133.6 | 114.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 182 | S | 31.8 | Very low | 39 | Very low | 121 Ų | 121 | 132.9 Ų | 132.9 | 85% | 0.846 | 79% | 0.794 | S | S | * | * | trans | -54.8 | 141.4 | 161.2 | -64 | 0 | 0 | 0 | 0 | 111 | ||||
| 183 | T | 40.3 | Very low | 39.5 | Very low | 134 Ų | 134 | 139.1 Ų | 139.1 | 82% | 0.822 | 80% | 0.801 | S | S | * | * | trans | -147.4 | 109.6 | 154 | -20.1 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 184 | E | 36.9 | Very low | 39.8 | Very low | 187 Ų | 187 | 135 Ų | 135 | 87% | 0.874 | 80% | 0.798 | S | S | * | * | trans | -53.4 | 130 | 158.9 | -63.9 | 170.5 | 141.3 | 0 | 0 | 109 | ||||
| 185 | S | 38.9 | Very low | 40.4 | Very low | 116 Ų | 116 | 132.4 Ų | 132.4 | 81% | 0.811 | 79% | 0.792 | S | S | * | * | 171.8 | 135.8 | 128.8 | 67 | 0 | 0 | 0 | 0 | 108.7 | V187 | S185-V187 PolarHBondContact O-N 3.42Š| |||
| 186 | G | 30.8 | Very low | 41.4 | Very low | 81 Ų | 81 | 138.5 Ų | 138.5 | 84% | 0.835 | 80% | 0.798 | S | S | * | * | trans | -63.1 | 120.6 | -172.3 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 187 | V | 35.8 | Very low | 42.6 | Very low | 127 Ų | 127 | 139.5 Ų | 139.5 | 77% | 0.77 | 80% | 0.8 | S | S | * | * | trans | -142.8 | 110.5 | 146 | -179.8 | 0 | 0 | 0 | 0 | 104.8 | S185 P189 | S185-V187 PolarHBondContact O-N 3.42Å; V187-P189 WeakPolarHBondContact O-CD 3.41Å | ||
| 188 | E | 35 | Very low | 44.2 | Very low | 188 Ų | 188 | 141 Ų | 141 | 88% | 0.879 | 81% | 0.807 | S | S | * | * | trans | -57.7 | 122.8 | 170.2 | -82.9 | -154.3 | 151.4 | 0 | 0 | 109.6 | ||||
| 189 | P | 50.6 | Low | 45.4 | Very low | 119 Ų | 119 | 138.4 Ų | 138.4 | 77% | 0.773 | 80% | 0.804 | S | S | * | * | trans | -100 | 108 | 160.3 | 18.3 | 2.9 | 0 | 0 | 0 | 107.9 | V187 | V187-P189 WeakPolarHBondContact O-CD 3.41Š| ||
| 190 | V | 41.9 | Very low | 47.2 | Very low | 122 Ų | 122 | 137.3 Ų | 137.3 | 74% | 0.739 | 81% | 0.806 | S | S | * | * | trans | -6.2 | 124.2 | 157.7 | -179.7 | 0 | 0 | 0 | 0 | 114.1 | L192 | V190-L192 PolarHBondContact O-N 3.03Š| ||
| 191 | P | 46.6 | Very low | 49.2 | Very low | 119 Ų | 119 | 136.4 Ų | 136.4 | 77% | 0.773 | 80% | 0.801 | S | S | * | * | trans | -65.6 | 108.3 | -179.9 | 26 | -31 | 0 | 0 | 0 | 109.7 | K193 | P191-K193 PolarHBondContact O-N 2.87Š| ||
| 192 | L | 48.5 | Very low | 50.9 | Low | 172 Ų | 172 | 137.7 Ų | 137.7 | 90% | 0.901 | 80% | 0.802 | S | S | * | * | trans | -59.3 | 108.6 | 168.2 | -78.7 | 168.5 | 0 | 0 | 0 | 108.1 | V190 A194 | V190-L192 PolarHBondContact O-N 3.03Å; L192-A194 PolarHBondContact O-N 3.4Å; L192-A194 VanDerWaalsContact O-N 3.14Å | ||
| 193 | K | 49.3 | Very low | 53 | Low | 202 Ų | 202 | 140.9 Ų | 140.9 | 88% | 0.878 | 80% | 0.803 | S | S | * | * | trans | -36.7 | 113.6 | 179.2 | -69 | 176.4 | 176.2 | 177 | 0 | 112.1 | P191 S195 | P191-K193 PolarHBondContact O-N 2.87Å; K193-S195 PolarHBondContact O-N 3.42Å | ||
| 194 | A | 42.3 | Very low | 54.7 | Low | 92 Ų | 92 | 141 Ų | 141 | 76% | 0.76 | 80% | 0.798 | S | S | * | * | trans | 11.3 | 83.3 | 151.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | L192 K196 | L192-A194 PolarHBondContact O-N 3.4Å; L192-A194 VanDerWaalsContact O-N 3.14Å; A194-K196 PolarHBondContact O-N 3.28Å | ||
| 195 | S | 53.9 | Low | 56.4 | Low | 106 Ų | 106 | 136.3 Ų | 136.3 | 74% | 0.741 | 78% | 0.784 | S | S | * | * | trans | -62.1 | 111.5 | 156.1 | 72.4 | 0 | 0 | 0 | 0 | 106.2 | K193 K197 | K193-S195 PolarHBondContact O-N 3.42Å; S195-K197 PolarHBondContact O-N 2.87Å | ||
| 196 | K | 56.2 | Low | 58 | Low | 199 Ų | 199 | 137.7 Ų | 137.7 | 87% | 0.865 | 79% | 0.787 | S | S | * | * | trans | -53.4 | 102.7 | 174.8 | -71.1 | 177.4 | 177.3 | 179.5 | 0 | 107.9 | A194 L198 | A194-K196 PolarHBondContact O-N 3.28Å; K196-L198 PolarHBondContact O-N 3.33Å | ||
| 197 | K | 64.5 | Low | 59.7 | Low | 195 Ų | 195 | 143 Ų | 143 | 85% | 0.848 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 124.1 | 171.5 | -76.7 | -176.2 | 176.7 | -177.7 | 0 | 106.6 | S195 | S195-K197 PolarHBondContact O-N 2.87Š|
| 198 | L | 74 | Confident | 61.2 | Low | 157 Ų | 157 | 146.4 Ų | 146.4 | 82% | 0.822 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 144.3 | 173.5 | -72.4 | 166.8 | 0 | 0 | 0 | 108.4 | K196 | K196-L198 PolarHBondContact O-N 3.33Š|
| 199 | P | 66.3 | Low | 62.4 | Low | 105 Ų | 105 | 143 Ų | 143 | 68% | 0.682 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 140.1 | 173.2 | 24.7 | -32.8 | 0 | 0 | 0 | 108.8 | V201 | P199-V201 PolarHBondContact O-N 3.47Š|
| 200 | P | 75.2 | Confident | 62.8 | Low | 124 Ų | 124 | 140.8 Ų | 140.8 | 81% | 0.805 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 125.8 | 177.7 | 23 | -31.4 | 0 | 0 | 0 | 109.2 | ||
| 201 | V | 76.5 | Confident | 63.4 | Low | 113 Ų | 113 | 140.8 Ų | 140.8 | 69% | 0.685 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 128.8 | 173.3 | 179.1 | 0 | 0 | 0 | 0 | 107.3 | P199 Q203 | P199-V201 PolarHBondContact O-N 3.47Å; V201-Q203 PolarHBondContact O-N 3.04Å |
| 202 | P | 74.5 | Confident | 63.5 | Low | 113 Ų | 113 | 143.7 Ų | 143.7 | 73% | 0.734 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 124.4 | 176.4 | 23.2 | -31.4 | 0 | 0 | 0 | 109.2 | I204 | P202-I204 PolarHBondContact O-N 3.3Š|
| 203 | Q | 75.9 | Confident | 63.9 | Low | 187 Ų | 187 | 144.5 Ų | 144.5 | 87% | 0.874 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 123.3 | 175.2 | -70 | 179.7 | 1 | 0 | 0 | 108.5 | V201 | V201-Q203 PolarHBondContact O-N 3.04Š|
| 204 | I | 74.9 | Confident | 64.2 | Low | 137 Ų | 137 | 139 Ų | 139 | 70% | 0.703 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 130.7 | 171.6 | -59.2 | 170.3 | 0 | 0 | 0 | 106.7 | P202 T206 | P202-I204 PolarHBondContact O-N 3.3Å; I204-T206 PolarHBondContact O-N 3.11Å |
| 205 | P | 72.6 | Confident | 65 | Low | 89 Ų | 89 | 142.7 Ų | 142.7 | 58% | 0.578 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 130.1 | 175.9 | -23.4 | 31.8 | 0 | 0 | 0 | 110.6 | Y207 | P205-Y207 VanDerWaalsContact O-CD2 3.26Å; P205-Y207 WeakPolarHBondContact O-CD2 3.13Å; P205-Y207 PolarHBondContact O-N 2.81Å |
| 206 | T | 72.7 | Confident | 65.6 | Low | 144 Ų | 144 | 139.2 Ų | 139.2 | 88% | 0.883 | 75% | 0.752 | S | S | * | * | trans | -68 | 102.3 | 174.8 | -37.3 | 0 | 0 | 0 | 0 | 108.6 | I204 K208 | I204-T206 PolarHBondContact O-N 3.11Å; T206-K208 PolarHBondContact O-N 3.18Å | ||
| 207 | Y | 66.4 | Low | 66.5 | Low | 192 Ų | 192 | 136.8 Ų | 136.8 | 75% | 0.753 | 75% | 0.748 | S | S | * | * | trans | -70.6 | 126.1 | 170.4 | -68.3 | -86.4 | 0 | 0 | 0 | 108.5 | P205 S209 | P205-Y207 VanDerWaalsContact O-CD2 3.26Å; P205-Y207 WeakPolarHBondContact O-CD2 3.13Å; P205-Y207 PolarHBondContact O-N 2.81Å; Y207-S209 PolarHBondContact O-N 3.26Å | ||
| 208 | K | 67.2 | Low | 67.2 | Low | 200 Ų | 200 | 139.3 Ų | 139.3 | 87% | 0.87 | 75% | 0.752 | S | S | * | * | trans | -61.4 | 122.6 | 165.5 | -72.3 | -173.4 | 178.1 | -176.3 | 0 | 106.8 | T206 A210 | T206-K208 PolarHBondContact O-N 3.18Å; K208-A210 VanDerWaalsContact C-N 3.3Å; K208-A210 PolarHBondContact O-N 2.95Å | ||
| 209 | S | 59.9 | Low | 67.2 | Low | 117 Ų | 117 | 139.4 Ų | 139.4 | 82% | 0.818 | 75% | 0.748 | S | S | * | * | trans | -59.8 | 93.7 | 176.8 | -169.3 | 0 | 0 | 0 | 0 | 109 | Y207 V211 | Y207-S209 PolarHBondContact O-N 3.26Å; S209-V211 PolarHBondContact O-N 3Å | ||
| 210 | A | 59.3 | Low | 67.6 | Low | 71 Ų | 71 | 141.1 Ų | 141.1 | 59% | 0.587 | 75% | 0.747 | S | S | * | * | trans | -84.3 | 90.7 | 169.8 | 0 | 0 | 0 | 0 | 0 | 106 | K208 F212 | K208-A210 VanDerWaalsContact C-N 3.3Å; K208-A210 PolarHBondContact O-N 2.95Å; A210-F212 VanDerWaalsContact C-N 3.27Å; A210-F212 VanDerWaalsContact O-CD2 3.27Å; A210-F212 WeakPolarHBondContact O-CD2 3.38Å; A210-F212 PolarHBondContact O-N 3.06Å | ||
| 211 | V | 54.1 | Low | 67.5 | Low | 123 Ų | 123 | 140.7 Ų | 140.7 | 75% | 0.745 | 74% | 0.742 | S | S | * | * | trans | 27.7 | 62.4 | 160.6 | -166.9 | 0 | 0 | 0 | 0 | 112.8 | S209 E213 | S209-V211 PolarHBondContact O-N 3Å; V211-E213 HydrophobicContact CG1-CG 4.12Å; V211-E213 PolarHBondContact O-N 3.2Å | ||
| 212 | F | 49.3 | Very low | 67.2 | Low | 179 Ų | 179 | 144.5 Ų | 144.5 | 79% | 0.785 | 74% | 0.744 | S | S | * | * | trans | -88.3 | 100.8 | 163.5 | -92.5 | -86.8 | 0 | 0 | 0 | 105.2 | A210 S214 | A210-F212 VanDerWaalsContact C-N 3.27Å; A210-F212 VanDerWaalsContact O-CD2 3.27Å; A210-F212 WeakPolarHBondContact O-CD2 3.38Å; A210-F212 PolarHBondContact O-N 3.06Å; F212-S214 PolarHBondContact O-N 3.18Å | ||
| 213 | E | 56.1 | Low | 66.7 | Low | 189 Ų | 189 | 144.4 Ų | 144.4 | 88% | 0.883 | 75% | 0.746 | S | S | * | * | trans | -69.3 | 33.6 | 172.7 | -66.5 | -177 | 148.1 | 0 | 0 | 112.5 | V211 | V211-E213 HydrophobicContact CG1-CG 4.12Å; V211-E213 PolarHBondContact O-N 3.2Å | ||
| 214 | S | 56.6 | Low | 65.7 | Low | 87 Ų | 87 | 140.8 Ų | 140.8 | 61% | 0.608 | 74% | 0.741 | S | S | * | * | trans | -141.3 | 90.9 | 176.5 | -170.7 | 0 | 0 | 0 | 0 | 107.6 | F212 G216 | F212-S214 PolarHBondContact O-N 3.18Å; S214-G216 PolarHBondContact O-N 3.11Å | ||
| 215 | D | 60 | Low | 65 | Low | 169 Ų | 169 | 144.1 Ų | 144.1 | 90% | 0.904 | 75% | 0.751 | S | S | * | * | trans | -59.9 | 82.4 | 151.7 | -84.9 | -23 | 0 | 0 | 0 | 106 | D217 | D215-D217 PolarHBondContact O-N 3.5Š| ||
| 216 | G | 65.8 | Low | 64.3 | Low | 34 Ų | 34 | 149.4 Ų | 149.4 | 35% | 0.351 | 77% | 0.765 | S | S | . | * | trans | -57 | 130.2 | -179.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | S214 W218 | S214-G216 PolarHBondContact O-N 3.11Å; G216-W218 PolarHBondContact O-N 3.35Å; G216-W218 PolarHBondContact O-NE1 3.1Å | ||
| 217 | D | 75.9 | Confident | 63.4 | Low | 148 Ų | 148 | 145.9 Ų | 145.9 | 79% | 0.791 | 76% | 0.757 | S | S | * | * | trans | -61.6 | 106.5 | 175.4 | -85.1 | -30 | 0 | 0 | 0 | 109.8 | D215 | D215-D217 PolarHBondContact O-N 3.5Š| ||
| 218 | W | 78.6 | Confident | 62.8 | Low | 247 Ų | 247 | 147.8 Ų | 147.8 | 94% | 0.936 | 76% | 0.763 | S | S | * | * | trans | -82.1 | 118.8 | 173.5 | -64.3 | 94.9 | 0 | 0 | 0 | 109.5 | G216 | G216-W218 PolarHBondContact O-N 3.35Å; G216-W218 PolarHBondContact O-NE1 3.1Å | ||
| 219 | H | 73.6 | Confident | 62.4 | Low | 160 Ų | 160 | 147.8 Ų | 147.8 | 74% | 0.741 | 76% | 0.763 | S | S | * | * | trans | -95.5 | 126 | 171.9 | -64.5 | -51.1 | 0 | 0 | 0 | 111.1 | V221 | H219-V221 PolarHBondContact O-N 3.32Å; H219-V221 VanDerWaalsContact O-N 3.1Å | ||
| 220 | E | 74.4 | Confident | 62.2 | Low | 140 Ų | 140 | 147.9 Ų | 147.9 | 65% | 0.654 | 76% | 0.759 | S | S | * | * | trans | -65.5 | 109.2 | 172.8 | -170.4 | -173.8 | 179.4 | 0 | 0 | 110 | R222 | E220-R222 HydrophobicContact CG-CG 4.05Å; E220-R222 PolarHBondContact O-N 3.47Å; E220-R222 WeakPolarHBondContact OE1-CG 3.43Å; E220-R222 IonicContact OE1-CZ 2.98Å; E220-R222 IonicContact OE1-NE 2.69Å; E220-R222 PolarHBondContact OE1-NE 3.37Å; E220-R222 IonicContact OE1-NH2 2.9Å; E220-R222 PolarHBondContact OE1-NH2 3.14Å; E220-R222 IonicContact OE2-CZ 3.18Å; E220-R222 IonicContact OE2-NE 3.4Å; E220-R222 IonicContact OE2-NH2 3.56Å; E220-R222 PolarHBondContact OE2-NH2 3.41Å | ||
| 221 | V | 74.3 | Confident | 61.9 | Low | 115 Ų | 115 | 151 Ų | 151 | 70% | 0.697 | 77% | 0.77 | S | S | * | * | trans | -92.9 | 85.3 | 173.1 | -173.9 | 0 | 0 | 0 | 0 | 108.9 | H219 S223 | H219-V221 PolarHBondContact O-N 3.32Å; H219-V221 VanDerWaalsContact O-N 3.1Å; V221-S223 PolarHBondContact O-N 3.21Å | ||
| 222 | R | 69.2 | Low | 62.4 | Low | 193 Ų | 193 | 154.7 Ų | 154.7 | 73% | 0.728 | 78% | 0.776 | S | S | * | * | trans | -67 | 126.4 | 170.7 | -73.5 | -172.3 | 176.5 | 142 | 13.9 | 110.3 | E220 | E220-R222 HydrophobicContact CG-CG 4.05Å; E220-R222 PolarHBondContact O-N 3.47Å; E220-R222 WeakPolarHBondContact OE1-CG 3.43Å; E220-R222 IonicContact OE1-CZ 2.98Å; E220-R222 IonicContact OE1-NE 2.69Å; E220-R222 PolarHBondContact OE1-NE 3.37Å; E220-R222 IonicContact OE1-NH2 2.9Å; E220-R222 PolarHBondContact OE1-NH2 3.14Å; E220-R222 IonicContact OE2-CZ 3.18Å; E220-R222 IonicContact OE2-NE 3.4Å; E220-R222 IonicContact OE2-NH2 3.56Å; E220-R222 PolarHBondContact OE2-NH2 3.41Å | ||
| 223 | S | 63.6 | Low | 62.7 | Low | 111 Ų | 111 | 158.8 Ų | 158.8 | 78% | 0.776 | 80% | 0.798 | S | S | * | * | trans | -66.1 | 137.5 | 166 | 59.4 | 0 | 0 | 0 | 0 | 109.5 | V221 K225 | V221-S223 PolarHBondContact O-N 3.21Å; S223-K225 PolarHBondContact O-N 3.38Å | ||
| 224 | S | 56 | Low | 63 | Low | 111 Ų | 111 | 157.3 Ų | 157.3 | 78% | 0.776 | 79% | 0.794 | S | S | * | * | trans | -63 | 112.2 | 177 | 68.8 | 0 | 0 | 0 | 0 | 108.8 | K226 | S224-K226 PolarHBondContact O-N 2.92Š| ||
| 225 | K | 60 | Low | 63.4 | Low | 208 Ų | 208 | 161 Ų | 161 | 90% | 0.904 | 80% | 0.803 | S | S | * | * | trans | -60.9 | 98.8 | 174 | -165.5 | 175.4 | -174.2 | 175.3 | 0 | 108.3 | S223 G227 | S223-K225 PolarHBondContact O-N 3.38Å; K225-G227 PolarHBondContact O-N 2.91Å | ||
| 226 | K | 57.4 | Low | 63.6 | Low | 200 Ų | 200 | 160.6 Ų | 160.6 | 87% | 0.87 | 80% | 0.798 | S | S | * | * | trans | -69.7 | 97.8 | 179.5 | -148.3 | 176.7 | -170.4 | 179.4 | 0 | 107.6 | S224 R228 | S224-K226 PolarHBondContact O-N 2.92Å; K226-R228 PolarHBondContact O-N 3.46Å; K226-R228 VanDerWaalsContact O-N 3.09Å | ||
| 227 | G | 54.2 | Low | 63.4 | Low | 70 Ų | 70 | 168 Ų | 168 | 72% | 0.722 | 82% | 0.824 | S | S | * | * | trans | -60 | 109.7 | 177 | 0 | 0 | 0 | 0 | 0 | 110.5 | K225 K229 | K225-G227 PolarHBondContact O-N 2.91Å; G227-K229 PolarHBondContact O-N 3.22Å | ||
| 228 | R | 53 | Low | 62.7 | Low | 231 Ų | 231 | 169.3 Ų | 169.3 | 87% | 0.872 | 83% | 0.826 | S | S | * | * | trans | -73.5 | 106.7 | 168.3 | -172.2 | 177.6 | -177.7 | 178.3 | -0.2 | 107.3 | K226 T230 | K226-R228 PolarHBondContact O-N 3.46Å; K226-R228 VanDerWaalsContact O-N 3.09Å; R228-T230 PolarHBondContact O-N 3.46Å | ||
| 229 | K | 60.3 | Low | 61.6 | Low | 200 Ų | 200 | 164.1 Ų | 164.1 | 87% | 0.87 | 82% | 0.819 | S | S | * | * | trans | -71.3 | 115.5 | 164.6 | -72.8 | -173.9 | 177.3 | -177.1 | 0 | 107.8 | G227 | G227-K229 PolarHBondContact O-N 3.22Š| ||
| 230 | T | 54.7 | Low | 60.7 | Low | 119 Ų | 119 | 164.4 Ų | 164.4 | 73% | 0.73 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -77.5 | 127.2 | 162 | 40.4 | 0 | 0 | 0 | 0 | 107.9 | R228 | R228-T230 PolarHBondContact O-N 3.46Š|
| 231 | V | 52.2 | Low | 59.7 | Low | 137 Ų | 137 | 166.2 Ų | 166.2 | 83% | 0.83 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -79.4 | 123.3 | 166.2 | 176.7 | 0 | 0 | 0 | 0 | 106.1 | ||
| 232 | K | 64.7 | Low | 58.5 | Low | 200 Ų | 200 | 170.5 Ų | 170.5 | 87% | 0.87 | 85% | 0.849 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 126.4 | 167.9 | -75.8 | -174.9 | 171.7 | -175.3 | 0 | 108.1 | ||
| 233 | Q | 56.4 | Low | 57.5 | Low | 266 Ų | 266 | 168.5 Ų | 168.5 | 100% | 1.243 | 86% | 0.86 | S | S | * | * | trans | -76.8 | 0 | 156.6 | -83.1 | -175.3 | -48.5 | 0 | 0 | 109.4 |
Retrieved 233 of 233 residues in 148 ms
(Link to these results)