| 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 | 56.2 | Low | 84.5 | Confident | 200 Ų | 200 | 62.9 Ų | 62.9 | 99% | 0.985 | 32% | 0.321 | S | S | * | . | 0 | -34.6 | 0 | -70.7 | -171.7 | -168.9 | 0 | 0 | 112.4 | |||||
| 2 | D | 78.3 | Confident | 84.9 | Confident | 90 Ų | 90 | 63.7 Ų | 63.7 | 48% | 0.481 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -76.6 | -26.4 | -177.7 | -62 | -37.7 | 0 | 0 | 0 | 113.6 | K5 I6 | D2-K5 PolarHBondContact O-N 2.8Å; D2-K5 IonicContact OD1-NZ 2.83Å; D2-I6 VanDerWaalsContact O-CG1 3.32Å; D2-I6 WeakPolarHBondContact O-CG1 3.42Å; D2-I6 PolarHBondContact O-N 3.26Å |
| 3 | L | 82.4 | Confident | 85.4 | Confident | 27 Ų | 27 | 69.3 Ų | 69.3 | 14% | 0.141 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -60.9 | -48.2 | 175.3 | -131.1 | 75.1 | 0 | 0 | 0 | 113 | K5 I6 I7 T36 L87 R91 | L3-K5 VanDerWaalsContact C-N 3.26Å; L3-K5 PolarHBondContact O-N 3.46Å; L3-I6 PolarHBondContact O-N 2.98Å; L3-I6 VanDerWaalsContact O-N 3.1Å; L3-I7 VanDerWaalsContact O-CG1 3.31Å; L3-I7 WeakPolarHBondContact O-CG1 3.5Å; L3-I7 PolarHBondContact O-N 3.22Å; L3-T36 HydrophobicContact CD2-CG2 3.96Å; L3-L87 HydrophobicContact CD1-CD2 3.76Å; L3-L87 HydrophobicContact CD2-CD1 4.15Å; L3-L87 HydrophobicContact CD2-CD2 4.38Å; L3-L87 HydrophobicContact CG-CD1 4.22Å; L3-L87 HydrophobicContact CG-CD2 3.6Å; L3-L87 HydrophobicContact CG-CG 4.37Å; L3-R91 HydrophobicContact CD1-CG 4.15Å |
| 4 | H | 86.5 | Confident | 85.9 | Confident | 57 Ų | 57 | 66.1 Ų | 66.1 | 26% | 0.264 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -60 | -38.3 | 177.3 | -75.9 | -139 | 0 | 0 | 0 | 111.2 | I7 H8 L32 | H4-I7 PolarHBondContact O-N 3.12Å; H4-H8 WeakPolarHBondContact O-CB 3.44Å; H4-H8 PolarHBondContact O-N 2.66Å; H4-L32 HydrophobicContact CB-CD2 4.13Å; H4-L32 WeakPolarHBondContact O-CD2 3.32Å |
| 5 | K | 87.6 | Confident | 86.2 | Confident | 132 Ų | 132 | 61.7 Ų | 61.7 | 57% | 0.574 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -65.6 | -40.7 | 175.5 | -66.5 | 176.4 | -174.3 | 165.1 | 0 | 112.1 | D2 L3 S9 | D2-K5 PolarHBondContact O-N 2.8Å; D2-K5 IonicContact OD1-NZ 2.83Å; L3-K5 VanDerWaalsContact C-N 3.26Å; L3-K5 PolarHBondContact O-N 3.46Å; K5-S9 VanDerWaalsContact O-CB 3.28Å; K5-S9 WeakPolarHBondContact O-CB 3.22Å; K5-S9 PolarHBondContact O-N 3.38Å; K5-S9 PolarHBondContact O-OG 2.84Å; K5-S9 VanDerWaalsContact O-OG 3.08Å |
| 6 | I | 89 | Confident | 86.4 | Confident | 38 Ų | 38 | 64.8 Ų | 64.8 | 20% | 0.195 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -63.2 | -47.6 | 176.8 | -65.5 | 162.8 | 0 | 0 | 0 | 109.8 | D2 L3 S9 A10 K86 L87 A90 | D2-I6 VanDerWaalsContact O-CG1 3.32Å; D2-I6 WeakPolarHBondContact O-CG1 3.42Å; D2-I6 PolarHBondContact O-N 3.26Å; L3-I6 PolarHBondContact O-N 2.98Å; L3-I6 VanDerWaalsContact O-N 3.1Å; I6-S9 PolarHBondContact O-N 2.84Å; I6-S9 PolarHBondContact O-OG 3.44Å; I6-A10 WeakPolarHBondContact O-CB 3.47Å; I6-A10 PolarHBondContact O-N 3.19Å; I6-K86 HydrophobicContact CG2-CD 4.12Å; I6-K86 HydrophobicContact CG2-CG 4.35Å; I6-L87 HydrophobicContact CB-CD2 4.09Å; I6-L87 HydrophobicContact CD1-CD2 4.48Å; I6-L87 HydrophobicContact CG2-CD2 3.8Å; I6-A90 HydrophobicContact CD1-CB 3.86Å |
| 7 | I | 90.2 | Very high | 86.8 | Confident | 0 Ų | 0 | 67.1 Ų | 67.1 | 0% | 0 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -60.1 | -53.1 | 178 | -64.6 | 165.2 | 0 | 0 | 0 | 110.1 | L3 H4 S9 A10 L11 L32 I35 T36 L39 L83 L87 | L3-I7 VanDerWaalsContact O-CG1 3.31Å; L3-I7 WeakPolarHBondContact O-CG1 3.5Å; L3-I7 PolarHBondContact O-N 3.22Å; H4-I7 PolarHBondContact O-N 3.12Å; I7-S9 VanDerWaalsContact C-N 3.31Å; I7-S9 PolarHBondContact O-N 2.78Å; I7-A10 PolarHBondContact O-N 3.25Å; I7-L11 WeakPolarHBondContact O-CB 3.48Å; I7-L11 PolarHBondContact O-N 3.21Å; I7-L32 HydrophobicContact CB-CD2 4.34Å; I7-L32 HydrophobicContact CG2-CD2 4.18Å; I7-I35 HydrophobicContact CG2-CG2 3.76Å; I7-T36 HydrophobicContact CD1-CG2 4.25Å; I7-T36 WeakPolarHBondContact CD1-OG1 3.41Å; I7-L39 HydrophobicContact CD1-CD1 4.14Å; I7-L39 HydrophobicContact CG1-CD1 4.08Å; I7-L83 HydrophobicContact CB-CD2 4.44Å; I7-L83 HydrophobicContact CG1-CD2 3.73Å; I7-L87 HydrophobicContact CD1-CD1 3.86Å; I7-L87 HydrophobicContact CG1-CD1 3.86Å; I7-L87 HydrophobicContact CG1-CD2 4.22Å |
| 8 | H | 89.2 | Confident | 86.9 | Confident | 68 Ų | 68 | 69.3 Ų | 69.3 | 32% | 0.315 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -57.1 | -43.9 | 179.4 | -172 | -64.1 | 0 | 0 | 0 | 111.9 | H4 H12 L32 | H4-H8 WeakPolarHBondContact O-CB 3.44Å; H4-H8 PolarHBondContact O-N 2.66Å; H8-H12 WeakPolarHBondContact O-CB 3.39Å; H8-H12 PolarHBondContact O-N 3.02Å; H8-L32 HydrophobicContact CB-CD2 4.07Å |
| 9 | S | 89.4 | Confident | 87 | Confident | 61 Ų | 61 | 67.2 Ų | 67.2 | 43% | 0.427 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -66.5 | -43.3 | 179.5 | 66.9 | 0 | 0 | 0 | 0 | 112.9 | K5 I6 I7 E13 | K5-S9 VanDerWaalsContact O-CB 3.28Å; K5-S9 WeakPolarHBondContact O-CB 3.22Å; K5-S9 PolarHBondContact O-N 3.38Å; K5-S9 PolarHBondContact O-OG 2.84Å; K5-S9 VanDerWaalsContact O-OG 3.08Å; I6-S9 PolarHBondContact O-N 2.84Å; I6-S9 PolarHBondContact O-OG 3.44Å; I7-S9 VanDerWaalsContact C-N 3.31Å; I7-S9 PolarHBondContact O-N 2.78Å; S9-E13 WeakPolarHBondContact O-CB 3.38Å; S9-E13 PolarHBondContact O-N 2.99Å |
| 10 | A | 90.8 | Very high | 86.9 | Confident | 17 Ų | 17 | 68.6 Ų | 68.6 | 14% | 0.14 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -71 | -41.6 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | I6 I7 E13 F14 L83 | I6-A10 WeakPolarHBondContact O-CB 3.47Å; I6-A10 PolarHBondContact O-N 3.19Å; I7-A10 PolarHBondContact O-N 3.25Å; A10-E13 PolarHBondContact O-N 3.32Å; A10-F14 WeakPolarHBondContact O-CB 3.42Å; A10-F14 PolarHBondContact O-N 3.09Å; A10-L83 HydrophobicContact CB-CD1 3.63Å; A10-L83 HydrophobicContact CB-CG 4.13Å |
| 11 | L | 89.6 | Confident | 86.7 | Confident | 2 Ų | 2 | 72.8 Ų | 72.8 | 1% | 0.01 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -67.7 | -38.3 | 177.4 | -174.9 | 142.2 | 0 | 0 | 0 | 111 | I7 F14 I15 L24 L27 I35 | I7-L11 WeakPolarHBondContact O-CB 3.48Å; I7-L11 PolarHBondContact O-N 3.21Å; L11-F14 PolarHBondContact O-N 3.27Å; L11-I15 HydrophobicContact CD2-CD1 3.29Å; L11-I15 HydrophobicContact CD2-CG1 4.38Å; L11-I15 HydrophobicContact CG-CD1 3.79Å; L11-I15 HydrophobicContact CG-CG1 4.49Å; L11-I15 WeakPolarHBondContact O-CB 3.24Å; L11-I15 VanDerWaalsContact O-CG1 3.26Å; L11-I15 WeakPolarHBondContact O-CG1 3.35Å; L11-I15 PolarHBondContact O-N 2.73Å; L11-L24 HydrophobicContact CD2-CD2 4.26Å; L11-L27 HydrophobicContact CD2-CD2 3.93Å; L11-I35 HydrophobicContact CD1-CD1 3.92Å |
| 12 | H | 89.4 | Confident | 88.1 | Confident | 72 Ų | 72 | 64.5 Ų | 64.5 | 33% | 0.333 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -61.2 | -47.4 | 172.6 | -179.9 | -63.3 | 0 | 0 | 0 | 112.3 | H8 F14 I15 Q16 L24 | H8-H12 WeakPolarHBondContact O-CB 3.39Å; H8-H12 PolarHBondContact O-N 3.02Å; H12-F14 VanDerWaalsContact C-N 3.35Å; H12-F14 PolarHBondContact O-N 3.3Å; H12-I15 PolarHBondContact O-N 2.99Å; H12-Q16 PolarHBondContact CE1-OE1 3.09Å; H12-Q16 WeakPolarHBondContact O-CB 3.4Å; H12-Q16 PolarHBondContact O-N 3.26Å; H12-L24 HydrophobicContact CB-CD1 3.67Å; H12-L24 WeakPolarHBondContact CD2-CD1 3.4Å |
| 13 | E | 91.5 | Very high | 88.3 | Confident | 137 Ų | 137 | 65 Ų | 65 | 64% | 0.64 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -61.6 | -42.9 | 177.9 | -174.9 | 177.9 | -177 | 0 | 0 | 111.8 | S9 A10 T17 | S9-E13 WeakPolarHBondContact O-CB 3.38Å; S9-E13 PolarHBondContact O-N 2.99Å; A10-E13 PolarHBondContact O-N 3.32Å; E13-T17 PolarHBondContact O-N 3.23Å; E13-T17 PolarHBondContact O-OG1 3.13Å |
| 14 | F | 92.1 | Very high | 88.1 | Confident | 25 Ų | 25 | 64.5 Ų | 64.5 | 11% | 0.11 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -62.9 | -52 | 176.9 | 180 | -100.3 | 0 | 0 | 0 | 111.8 | A10 L11 H12 Q16 T17 Y18 F68 I71 K75 V76 M79 | A10-F14 WeakPolarHBondContact O-CB 3.42Å; A10-F14 PolarHBondContact O-N 3.09Å; L11-F14 PolarHBondContact O-N 3.27Å; H12-F14 VanDerWaalsContact C-N 3.35Å; H12-F14 PolarHBondContact O-N 3.3Å; F14-Q16 PolarHBondContact O-N 3.29Å; F14-T17 VanDerWaalsContact O-CB 3.3Å; F14-T17 WeakPolarHBondContact O-CB 3.46Å; F14-T17 PolarHBondContact O-N 3.44Å; F14-T17 VanDerWaalsContact O-N 3.13Å; F14-Y18 HydrophobicContact CD2-CD2 4.46Å; F14-Y18 HydrophobicContact CD2-CE2 4.03Å; F14-Y18 HydrophobicContact CE1-CD2 4.41Å; F14-Y18 HydrophobicContact CE2-CD2 4.2Å; F14-Y18 AromaticContact CE2-CE2 3.6Å; F14-Y18 HydrophobicContact CE2-CE2 3.6Å; F14-Y18 HydrophobicContact CZ-CD2 4.18Å; F14-Y18 AromaticContact CZ-CE2 3.9Å; F14-Y18 HydrophobicContact CZ-CE2 3.9Å; F14-Y18 WeakPolarHBondContact O-CD2 3.22Å; F14-F68 HydrophobicContact CD1-CE2 4.34Å; F14-F68 HydrophobicContact CE1-CE2 4.11Å; F14-F68 HydrophobicContact CE1-CZ 4.26Å; F14-I71 HydrophobicContact CE1-CD1 3.96Å; F14-I71 HydrophobicContact CE1-CG2 4.21Å; F14-I71 HydrophobicContact CZ-CG2 3.85Å; F14-K75 HydrophobicContact CE2-CB 4.42Å; F14-K75 HydrophobicContact CZ-CB 4.37Å; F14-V76 HydrophobicContact CE1-CG2 4.43Å; F14-V76 HydrophobicContact CZ-CG2 4.28Å; F14-M79 HydrophobicContact CB-CG 4.07Å; F14-M79 HydrophobicContact CD1-CE 4.06Å; F14-M79 HydrophobicContact CD1-CG 4.27Å; F14-M79 HydrophobicContact CD2-CB 3.75Å; F14-M79 HydrophobicContact CD2-CG 3.66Å; F14-M79 HydrophobicContact CE1-CE 4.12Å; F14-M79 HydrophobicContact CE2-CB 3.69Å; F14-M79 HydrophobicContact CE2-CG 4.09Å; F14-M79 HydrophobicContact CG-CB 4.28Å; F14-M79 HydrophobicContact CG-CE 4.47Å; F14-M79 HydrophobicContact CG-CG 3.74Å; F14-M79 HydrophobicContact CZ-CB 4.2Å |
| 15 | I | 90.7 | Very high | 87.9 | Confident | 0 Ų | 0 | 66.4 Ų | 66.4 | 0% | 0 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -63.9 | -43.4 | -177.4 | -69.4 | 169.8 | 0 | 0 | 0 | 110.7 | L11 H12 T17 Y18 I19 A22 L24 I65 F68 | L11-I15 HydrophobicContact CD2-CD1 3.29Å; L11-I15 HydrophobicContact CD2-CG1 4.38Å; L11-I15 HydrophobicContact CG-CD1 3.79Å; L11-I15 HydrophobicContact CG-CG1 4.49Å; L11-I15 WeakPolarHBondContact O-CB 3.24Å; L11-I15 VanDerWaalsContact O-CG1 3.26Å; L11-I15 WeakPolarHBondContact O-CG1 3.35Å; L11-I15 PolarHBondContact O-N 2.73Å; H12-I15 PolarHBondContact O-N 2.99Å; I15-T17 PolarHBondContact O-N 3.26Å; I15-T17 VanDerWaalsContact O-N 3.09Å; I15-Y18 PolarHBondContact O-N 2.98Å; I15-I19 HydrophobicContact CG2-CB 4.17Å; I15-I19 CarbonylContact O-C 3.51Å; I15-I19 WeakPolarHBondContact O-CA 3.44Å; I15-I19 PolarHBondContact O-N 3.44Å; I15-A22 HydrophobicContact CG2-CB 3.38Å; I15-L24 HydrophobicContact CB-CD2 4.33Å; I15-L24 HydrophobicContact CD1-CD2 3.53Å; I15-L24 HydrophobicContact CG2-CD2 4.17Å; I15-I65 HydrophobicContact CD1-CD1 3.41Å; I15-I65 VanDerWaalsContact CD1-CD1 3.41Å; I15-I65 HydrophobicContact CD1-CG1 4.16Å; I15-I65 HydrophobicContact CD1-CG2 4.34Å; I15-I65 HydrophobicContact CG2-CG2 4Å; I15-F68 HydrophobicContact CD1-CD2 4.24Å; I15-F68 HydrophobicContact CD1-CE2 4.18Å; I15-F68 HydrophobicContact CG1-CD2 4.06Å; I15-F68 HydrophobicContact CG1-CE2 3.9Å |
| 16 | Q | 89.9 | Confident | 87.6 | Confident | 111 Ų | 111 | 63.2 Ų | 63.2 | 52% | 0.519 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -62.1 | -22.4 | 179.5 | -167.7 | 170.9 | 24.2 | 0 | 0 | 113.1 | H12 F14 | H12-Q16 PolarHBondContact CE1-OE1 3.09Å; H12-Q16 WeakPolarHBondContact O-CB 3.4Å; H12-Q16 PolarHBondContact O-N 3.26Å; F14-Q16 PolarHBondContact O-N 3.29Å |
| 17 | T | 92.1 | Very high | 87.4 | Confident | 103 Ų | 103 | 62.1 Ų | 62.1 | 63% | 0.632 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -72 | -33.3 | 175.8 | -57.5 | 0 | 0 | 0 | 0 | 112.3 | E13 F14 I15 | E13-T17 PolarHBondContact O-N 3.23Å; E13-T17 PolarHBondContact O-OG1 3.13Å; F14-T17 VanDerWaalsContact O-CB 3.3Å; F14-T17 WeakPolarHBondContact O-CB 3.46Å; F14-T17 PolarHBondContact O-N 3.44Å; F14-T17 VanDerWaalsContact O-N 3.13Å; I15-T17 PolarHBondContact O-N 3.26Å; I15-T17 VanDerWaalsContact O-N 3.09Å |
| 18 | Y | 89.1 | Confident | 87.3 | Confident | 108 Ų | 108 | 65.8 Ų | 65.8 | 42% | 0.424 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -105.6 | -30.5 | -176.8 | -66.5 | -82.5 | 0 | 0 | 0 | 113.3 | F14 I15 I71 | F14-Y18 HydrophobicContact CD2-CD2 4.46Å; F14-Y18 HydrophobicContact CD2-CE2 4.03Å; F14-Y18 HydrophobicContact CE1-CD2 4.41Å; F14-Y18 HydrophobicContact CE2-CD2 4.2Å; F14-Y18 AromaticContact CE2-CE2 3.6Å; F14-Y18 HydrophobicContact CE2-CE2 3.6Å; F14-Y18 HydrophobicContact CZ-CD2 4.18Å; F14-Y18 AromaticContact CZ-CE2 3.9Å; F14-Y18 HydrophobicContact CZ-CE2 3.9Å; F14-Y18 WeakPolarHBondContact O-CD2 3.22Å; I15-Y18 PolarHBondContact O-N 2.98Å; Y18-I71 HydrophobicContact CD1-CG2 4.33Å; Y18-I71 HydrophobicContact CD2-CD1 4.3Å; Y18-I71 HydrophobicContact CD2-CG2 4.27Å; Y18-I71 HydrophobicContact CE1-CG2 4.47Å; Y18-I71 HydrophobicContact CE2-CG2 4.42Å; Y18-I71 HydrophobicContact CG-CD1 4.17Å; Y18-I71 HydrophobicContact CG-CG1 4.17Å; Y18-I71 HydrophobicContact CG-CG2 4.24Å |
| 19 | I | 89.4 | Confident | 87.2 | Confident | 29 Ų | 29 | 68.3 Ų | 68.3 | 15% | 0.149 | 38% | 0.376 | C | S | . | . | trans | -134.6 | 84.8 | -174.5 | -46.5 | 173.4 | 0 | 0 | 0 | 107.9 | I15 D21 A22 I65 G67 F68 I71 | I15-I19 HydrophobicContact CG2-CB 4.17Å; I15-I19 CarbonylContact O-C 3.51Å; I15-I19 WeakPolarHBondContact O-CA 3.44Å; I15-I19 PolarHBondContact O-N 3.44Å; I19-D21 PolarHBondContact O-N 3.44Å; I19-A22 HydrophobicContact CB-CB 4.03Å; I19-A22 HydrophobicContact CG2-CB 3.75Å; I19-A22 WeakPolarHBondContact O-CB 3.49Å; I19-A22 PolarHBondContact O-N 3.49Å; I19-I65 HydrophobicContact CD1-CG2 4.03Å; I19-G67 VanDerWaalsContact CD1-C 3.4Å; I19-G67 WeakPolarHBondContact CD1-O 3.3Å; I19-F68 HydrophobicContact CD1-CB 4.44Å; I19-I71 HydrophobicContact CD1-CD1 4.22Å | ||
| 20 | P | 84.1 | Confident | 87.3 | Confident | 94 Ų | 94 | 70.6 Ų | 70.6 | 61% | 0.61 | 39% | 0.387 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.4 | -22.7 | -174.4 | 26.6 | -34.8 | 0 | 0 | 0 | 113.6 | ||
| 21 | D | 83.3 | Confident | 87.2 | Confident | 157 Ų | 157 | 70 Ų | 70 | 84% | 0.84 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.3 | 8.8 | -179.3 | -61.8 | -37.9 | 0 | 0 | 0 | 113 | I19 D23 | I19-D21 PolarHBondContact O-N 3.44Å; D21-D23 PolarHBondContact O-N 3.47Å |
| 22 | A | 84.5 | Confident | 87.3 | Confident | 27 Ų | 27 | 70.3 Ų | 70.3 | 22% | 0.223 | 38% | 0.383 | C | S | . | . | trans | -66 | 127.5 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | I15 I19 I65 | I15-A22 HydrophobicContact CG2-CB 3.38Å; I19-A22 HydrophobicContact CB-CB 4.03Å; I19-A22 HydrophobicContact CG2-CB 3.75Å; I19-A22 WeakPolarHBondContact O-CB 3.49Å; I19-A22 PolarHBondContact O-N 3.49Å; A22-I65 HydrophobicContact CB-CG2 4.1Å | ||
| 23 | D | 82.8 | Confident | 87.3 | Confident | 100 Ų | 100 | 70.3 Ų | 70.3 | 54% | 0.535 | 39% | 0.391 | S | S | . | . | trans | -86.4 | 110.8 | 170.4 | -173.4 | 3.4 | 0 | 0 | 0 | 109.8 | D21 S25 T26 | D21-D23 PolarHBondContact O-N 3.47Å; D23-S25 VanDerWaalsContact OD1-CB 3.24Å; D23-S25 WeakPolarHBondContact OD1-CB 3.11Å; D23-S25 PolarHBondContact OD1-N 2.88Å; D23-S25 PolarHBondContact OD1-OG 3.24Å; D23-S25 PolarHBondContact OD2-OG 3.01Å; D23-S25 VanDerWaalsContact OD2-OG 3.12Å; D23-T26 PolarHBondContact O-OG1 2.86Å | ||
| 24 | L | 80 | Confident | 87.3 | Confident | 17 Ų | 17 | 69 Ų | 69 | 9% | 0.089 | 38% | 0.381 | C | S | . | . | trans | -94.6 | 1.6 | -178.8 | -64.4 | 166.9 | 0 | 0 | 0 | 112.7 | L11 H12 I15 T26 L27 I65 | L11-L24 HydrophobicContact CD2-CD2 4.26Å; H12-L24 HydrophobicContact CB-CD1 3.67Å; H12-L24 WeakPolarHBondContact CD2-CD1 3.4Å; I15-L24 HydrophobicContact CB-CD2 4.33Å; I15-L24 HydrophobicContact CD1-CD2 3.53Å; I15-L24 HydrophobicContact CG2-CD2 4.17Å; L24-T26 PolarHBondContact O-N 2.89Å; L24-L27 WeakPolarHBondContact O-CB 3.26Å; L24-L27 PolarHBondContact O-N 3.19Å; L24-I65 HydrophobicContact CD2-CD1 4.33Å; L24-I65 HydrophobicContact CD2-CG1 4.27Å | ||
| 25 | S | 82.1 | Confident | 87.3 | Confident | 97 Ų | 97 | 67.9 Ų | 67.9 | 68% | 0.678 | 38% | 0.376 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.7 | -14.7 | 174.3 | 70.4 | 0 | 0 | 0 | 0 | 113.2 | D23 L27 | D23-S25 VanDerWaalsContact OD1-CB 3.24Å; D23-S25 WeakPolarHBondContact OD1-CB 3.11Å; D23-S25 PolarHBondContact OD1-N 2.88Å; D23-S25 PolarHBondContact OD1-OG 3.24Å; D23-S25 PolarHBondContact OD2-OG 3.01Å; D23-S25 VanDerWaalsContact OD2-OG 3.12Å; S25-L27 VanDerWaalsContact C-N 3.29Å |
| 26 | T | 79.8 | Confident | 87.2 | Confident | 64 Ų | 64 | 68.4 Ų | 68.4 | 39% | 0.393 | 38% | 0.38 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.4 | -12.5 | 176.7 | 57.8 | 0 | 0 | 0 | 0 | 113.4 | D23 L24 D28 Y64 | D23-T26 PolarHBondContact O-OG1 2.86Å; L24-T26 PolarHBondContact O-N 2.89Å; T26-D28 PolarHBondContact O-N 3.43Å; T26-D28 VanDerWaalsContact O-N 3.09Å; T26-Y64 PolarHBondContact OG1-O 2.9Å |
| 27 | L | 85.1 | Confident | 87.2 | Confident | 16 Ų | 16 | 64.3 Ų | 64.3 | 8% | 0.084 | 37% | 0.367 | C | S | . | . | trans | -75 | 97.2 | 178.9 | -176.5 | 60.5 | 0 | 0 | 0 | 110.1 | L11 L24 S25 L31 L32 I35 | L11-L27 HydrophobicContact CD2-CD2 3.93Å; L24-L27 WeakPolarHBondContact O-CB 3.26Å; L24-L27 PolarHBondContact O-N 3.19Å; S25-L27 VanDerWaalsContact C-N 3.29Å; L27-L31 HydrophobicContact CD1-CB 3.86Å; L27-L31 HydrophobicContact CD1-CD2 3.33Å; L27-L31 HydrophobicContact CD1-CG 3.41Å; L27-L31 VanDerWaalsContact CD1-CG 3.41Å; L27-L32 HydrophobicContact CD1-CD1 4.41Å; L27-L32 HydrophobicContact CD1-CG 4.07Å; L27-L32 HydrophobicContact CD2-CD1 4.2Å; L27-L32 HydrophobicContact CD2-CD2 4.28Å; L27-L32 HydrophobicContact CD2-CG 4.07Å; L27-L32 HydrophobicContact CG-CD1 3.74Å; L27-L32 HydrophobicContact CG-CG 3.82Å; L27-I35 HydrophobicContact CD1-CD1 4.12Å | ||
| 28 | D | 88.4 | Confident | 87.1 | Confident | 76 Ų | 76 | 60.3 Ų | 60.3 | 41% | 0.406 | 34% | 0.342 | S | S | . | . | trans | -87.6 | 166.5 | 179.7 | 69.7 | 3.7 | 0 | 0 | 0 | 113 | T26 V30 L31 L32 | T26-D28 PolarHBondContact O-N 3.43Å; T26-D28 VanDerWaalsContact O-N 3.09Å; D28-V30 PolarHBondContact O-N 3.46Å; D28-V30 VanDerWaalsContact O-N 3.12Å; D28-V30 PolarHBondContact OD1-N 3.14Å; D28-L31 PolarHBondContact O-N 3.49Å; D28-L31 VanDerWaalsContact OD1-CB 3.25Å; D28-L31 WeakPolarHBondContact OD1-CB 3.37Å; D28-L31 PolarHBondContact OD1-N 2.97Å; D28-L32 VanDerWaalsContact O-CD1 3.32Å; D28-L32 WeakPolarHBondContact O-CD1 3.08Å; D28-L32 PolarHBondContact O-N 3.27Å | ||
| 29 | D | 88.3 | Confident | 87.1 | Confident | 122 Ų | 122 | 55.3 Ų | 55.3 | 65% | 0.652 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -58.8 | -25.5 | 179.5 | -73.5 | -38.6 | 0 | 0 | 0 | 112.8 | S33 | D29-S33 VanDerWaalsContact O-CB 3.28Å; D29-S33 WeakPolarHBondContact O-CB 3.38Å; D29-S33 PolarHBondContact O-N 3.49Å |
| 30 | V | 90.3 | Very high | 87 | Confident | 109 Ų | 109 | 58.2 Ų | 58.2 | 66% | 0.661 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -70.7 | -49.6 | 178.1 | 179.5 | 0 | 0 | 0 | 0 | 110.2 | D28 S33 Y34 | D28-V30 PolarHBondContact O-N 3.46Å; D28-V30 VanDerWaalsContact O-N 3.12Å; D28-V30 PolarHBondContact OD1-N 3.14Å; V30-S33 WeakPolarHBondContact O-CB 3.39Å; V30-S33 PolarHBondContact O-N 3.44Å; V30-Y34 PolarHBondContact O-N 2.95Å |
| 31 | L | 89.7 | Confident | 87 | Confident | 5 Ų | 5 | 58.2 Ų | 58.2 | 3% | 0.026 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -65.4 | -41.2 | 176.8 | 179.1 | 56.8 | 0 | 0 | 0 | 111.1 | L27 D28 S33 Y34 I35 M60 L61 Y64 | L27-L31 HydrophobicContact CD1-CB 3.86Å; L27-L31 HydrophobicContact CD1-CD2 3.33Å; L27-L31 HydrophobicContact CD1-CG 3.41Å; L27-L31 VanDerWaalsContact CD1-CG 3.41Å; D28-L31 PolarHBondContact O-N 3.49Å; D28-L31 VanDerWaalsContact OD1-CB 3.25Å; D28-L31 WeakPolarHBondContact OD1-CB 3.37Å; D28-L31 PolarHBondContact OD1-N 2.97Å; L31-S33 VanDerWaalsContact C-N 3.3Å; L31-S33 PolarHBondContact O-N 3.27Å; L31-Y34 PolarHBondContact O-N 3.16Å; L31-I35 HydrophobicContact CD1-CD1 4.11Å; L31-I35 HydrophobicContact CD1-CG1 4.27Å; L31-I35 HydrophobicContact CG-CD1 3.96Å; L31-I35 VanDerWaalsContact O-CG1 3.28Å; L31-I35 WeakPolarHBondContact O-CG1 3.3Å; L31-I35 PolarHBondContact O-N 3.12Å; L31-M60 HydrophobicContact CD1-CE 3.62Å; L31-M60 HydrophobicContact CD1-SD 3.53Å; L31-M60 VanDerWaalsContact CD1-SD 3.53Å; L31-L61 HydrophobicContact CD1-CD2 4.36Å; L31-L61 HydrophobicContact CD2-CD2 4.43Å; L31-Y64 HydrophobicContact CD1-CD2 4.47Å; L31-Y64 HydrophobicContact CD1-CE2 4.27Å; L31-Y64 HydrophobicContact CD2-CD1 3.75Å; L31-Y64 HydrophobicContact CD2-CD2 3.8Å; L31-Y64 HydrophobicContact CD2-CE1 4.09Å; L31-Y64 HydrophobicContact CD2-CE2 4.15Å; L31-Y64 HydrophobicContact CD2-CG 3.6Å |
| 32 | L | 90.1 | Very high | 87.1 | Confident | 8 Ų | 8 | 52 Ų | 52 | 4% | 0.042 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -58.8 | -40.1 | 171.6 | -84.2 | 139.3 | 0 | 0 | 0 | 112.2 | H4 I7 H8 L27 D28 T36 | H4-L32 HydrophobicContact CB-CD2 4.13Å; H4-L32 WeakPolarHBondContact O-CD2 3.32Å; I7-L32 HydrophobicContact CB-CD2 4.34Å; I7-L32 HydrophobicContact CG2-CD2 4.18Å; H8-L32 HydrophobicContact CB-CD2 4.07Å; L27-L32 HydrophobicContact CD1-CD1 4.41Å; L27-L32 HydrophobicContact CD1-CG 4.07Å; L27-L32 HydrophobicContact CD2-CD1 4.2Å; L27-L32 HydrophobicContact CD2-CD2 4.28Å; L27-L32 HydrophobicContact CD2-CG 4.07Å; L27-L32 HydrophobicContact CG-CD1 3.74Å; L27-L32 HydrophobicContact CG-CG 3.82Å; D28-L32 VanDerWaalsContact O-CD1 3.32Å; D28-L32 WeakPolarHBondContact O-CD1 3.08Å; D28-L32 PolarHBondContact O-N 3.27Å; L32-T36 WeakPolarHBondContact O-CB 3.32Å; L32-T36 PolarHBondContact O-N 2.83Å; L32-T36 PolarHBondContact O-OG1 3.4Å |
| 33 | S | 90.8 | Very high | 86.6 | Confident | 72 Ų | 72 | 52.9 Ų | 52.9 | 50% | 0.503 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -66 | -40.8 | 175.7 | -171.6 | 0 | 0 | 0 | 0 | 111.8 | D29 V30 L31 T36 G37 | D29-S33 VanDerWaalsContact O-CB 3.28Å; D29-S33 WeakPolarHBondContact O-CB 3.38Å; D29-S33 PolarHBondContact O-N 3.49Å; V30-S33 WeakPolarHBondContact O-CB 3.39Å; V30-S33 PolarHBondContact O-N 3.44Å; L31-S33 VanDerWaalsContact C-N 3.3Å; L31-S33 PolarHBondContact O-N 3.27Å; S33-T36 WeakPolarHBondContact O-CB 3.32Å; S33-T36 PolarHBondContact O-N 3.16Å; S33-G37 PolarHBondContact O-N 2.85Å |
| 34 | Y | 91.5 | Very high | 86.1 | Confident | 109 Ų | 109 | 50.5 Ų | 50.5 | 43% | 0.427 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -62.4 | -50 | 175.3 | 172.8 | -95.4 | 0 | 0 | 0 | 111.3 | V30 L31 T36 G37 V38 F57 M60 | V30-Y34 PolarHBondContact O-N 2.95Å; L31-Y34 PolarHBondContact O-N 3.16Å; Y34-T36 PolarHBondContact O-N 2.8Å; Y34-G37 PolarHBondContact O-N 3.19Å; Y34-V38 HydrophobicContact CD1-CG2 4.18Å; Y34-V38 HydrophobicContact CE1-CG2 3.68Å; Y34-V38 HydrophobicContact CE2-CG2 4.15Å; Y34-V38 WeakPolarHBondContact O-CG2 3.43Å; Y34-V38 PolarHBondContact O-N 3.35Å; Y34-F57 HydrophobicContact CE1-CD2 4.47Å; Y34-M60 HydrophobicContact CD1-CE 3.66Å; Y34-M60 HydrophobicContact CE1-CE 3.44Å; Y34-M60 VanDerWaalsContact CE1-CE 3.44Å |
| 35 | I | 90.9 | Very high | 84.9 | Confident | 1 Ų | 1 | 59 Ų | 59 | 1% | 0.005 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -59.6 | -39.2 | 177.6 | -65.1 | 165.1 | 0 | 0 | 0 | 110.4 | I7 L11 L27 L31 G37 V38 L39 F57 L61 | I7-I35 HydrophobicContact CG2-CG2 3.76Å; L11-I35 HydrophobicContact CD1-CD1 3.92Å; L27-I35 HydrophobicContact CD1-CD1 4.12Å; L31-I35 HydrophobicContact CD1-CD1 4.11Å; L31-I35 HydrophobicContact CD1-CG1 4.27Å; L31-I35 HydrophobicContact CG-CD1 3.96Å; L31-I35 VanDerWaalsContact O-CG1 3.28Å; L31-I35 WeakPolarHBondContact O-CG1 3.3Å; L31-I35 PolarHBondContact O-N 3.12Å; I35-G37 PolarHBondContact O-N 2.95Å; I35-V38 PolarHBondContact O-N 2.86Å; I35-L39 HydrophobicContact CG2-CD1 3.71Å; I35-L39 HydrophobicContact CG2-CG 4.37Å; I35-L39 WeakPolarHBondContact O-CB 3.46Å; I35-L39 WeakPolarHBondContact O-CD1 3.28Å; I35-L39 WeakPolarHBondContact O-CG 3.25Å; I35-L39 PolarHBondContact O-N 2.95Å; I35-F57 HydrophobicContact CG1-CE2 4.28Å; I35-L61 HydrophobicContact CD1-CD2 4.25Å |
| 36 | T | 89.8 | Confident | 83.5 | Confident | 12 Ų | 12 | 62.3 Ų | 62.3 | 7% | 0.074 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -60.3 | -44.5 | 174.7 | -56.9 | 0 | 0 | 0 | 0 | 111.6 | L3 I7 L32 S33 Y34 L39 E40 | L3-T36 HydrophobicContact CD2-CG2 3.96Å; I7-T36 HydrophobicContact CD1-CG2 4.25Å; I7-T36 WeakPolarHBondContact CD1-OG1 3.41Å; L32-T36 WeakPolarHBondContact O-CB 3.32Å; L32-T36 PolarHBondContact O-N 2.83Å; L32-T36 PolarHBondContact O-OG1 3.4Å; S33-T36 WeakPolarHBondContact O-CB 3.32Å; S33-T36 PolarHBondContact O-N 3.16Å; Y34-T36 PolarHBondContact O-N 2.8Å; T36-L39 PolarHBondContact O-N 3.38Å; T36-E40 WeakPolarHBondContact O-CG 3.18Å; T36-E40 PolarHBondContact O-N 3.33Å |
| 37 | G | 88.9 | Confident | 82.2 | Confident | 24 Ų | 24 | 60.2 Ų | 60.2 | 25% | 0.247 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -60.3 | -49 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | S33 Y34 I35 L39 E40 D41 | S33-G37 PolarHBondContact O-N 2.85Å; Y34-G37 PolarHBondContact O-N 3.19Å; I35-G37 PolarHBondContact O-N 2.95Å; G37-L39 PolarHBondContact O-N 2.99Å; G37-E40 WeakPolarHBondContact O-CA 3.21Å; G37-E40 WeakPolarHBondContact O-CB 3.49Å; G37-E40 PolarHBondContact O-N 3.26Å; G37-D41 PolarHBondContact O-N 3.05Å |
| 38 | V | 90.1 | Very high | 80.5 | Confident | 20 Ų | 20 | 66.9 Ų | 66.9 | 12% | 0.121 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -56.5 | -39.6 | 176.4 | 174.6 | 0 | 0 | 0 | 0 | 111.8 | Y34 I35 L42 F52 M80 | Y34-V38 HydrophobicContact CD1-CG2 4.18Å; Y34-V38 HydrophobicContact CE1-CG2 3.68Å; Y34-V38 HydrophobicContact CE2-CG2 4.15Å; Y34-V38 WeakPolarHBondContact O-CG2 3.43Å; Y34-V38 PolarHBondContact O-N 3.35Å; I35-V38 PolarHBondContact O-N 2.86Å; V38-L42 HydrophobicContact CG1-CD1 4.13Å; V38-L42 WeakPolarHBondContact O-CB 3.32Å; V38-L42 VanDerWaalsContact O-CG 3.29Å; V38-L42 WeakPolarHBondContact O-CG 3.42Å; V38-L42 PolarHBondContact O-N 3.38Å; V38-F52 HydrophobicContact CG1-CD2 4.04Å; V38-F52 HydrophobicContact CG1-CE2 3.56Å; V38-M80 HydrophobicContact CB-CE 4.45Å; V38-M80 HydrophobicContact CG1-CE 3.68Å |
| 39 | L | 89.8 | Confident | 78.6 | Confident | 3 Ų | 3 | 71.9 Ų | 71.9 | 2% | 0.016 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -74.9 | -28.8 | 177.9 | -69.2 | 163.3 | 0 | 0 | 0 | 113.5 | I7 I35 T36 G37 L42 G43 M80 L83 A84 L87 | I7-L39 HydrophobicContact CD1-CD1 4.14Å; I7-L39 HydrophobicContact CG1-CD1 4.08Å; I35-L39 HydrophobicContact CG2-CD1 3.71Å; I35-L39 HydrophobicContact CG2-CG 4.37Å; I35-L39 WeakPolarHBondContact O-CB 3.46Å; I35-L39 WeakPolarHBondContact O-CD1 3.28Å; I35-L39 WeakPolarHBondContact O-CG 3.25Å; I35-L39 PolarHBondContact O-N 2.95Å; T36-L39 PolarHBondContact O-N 3.38Å; G37-L39 PolarHBondContact O-N 2.99Å; L39-L42 HydrophobicContact CD2-CD1 4.38Å; L39-G43 PolarHBondContact O-N 2.9Å; L39-M80 HydrophobicContact CD2-CE 3.53Å; L39-M80 VanDerWaalsContact CD2-O 3.32Å; L39-M80 WeakPolarHBondContact CD2-O 3.32Å; L39-M80 HydrophobicContact CD2-SD 3.98Å; L39-M80 HydrophobicContact CG-CE 3.82Å; L39-L83 HydrophobicContact CD1-CD2 3.37Å; L39-L83 HydrophobicContact CD1-CG 4.43Å; L39-L83 HydrophobicContact CD2-CB 4.11Å; L39-L83 HydrophobicContact CD2-CD2 4.17Å; L39-L83 HydrophobicContact CG-CD2 4.4Å; L39-A84 HydrophobicContact CD2-CB 4Å; L39-L87 HydrophobicContact CB-CD1 4.08Å; L39-L87 HydrophobicContact CD1-CD1 3.83Å |
| 40 | E | 86.7 | Confident | 77.2 | Confident | 90 Ų | 90 | 73.3 Ų | 73.3 | 42% | 0.421 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -66.2 | -44.1 | 171.9 | -79.9 | 175.9 | 176.6 | 0 | 0 | 110.8 | T36 G37 G43 S44 R91 | T36-E40 WeakPolarHBondContact O-CG 3.18Å; T36-E40 PolarHBondContact O-N 3.33Å; G37-E40 WeakPolarHBondContact O-CA 3.21Å; G37-E40 WeakPolarHBondContact O-CB 3.49Å; G37-E40 PolarHBondContact O-N 3.26Å; E40-G43 PolarHBondContact O-N 2.86Å; E40-S44 PolarHBondContact O-N 3.09Å; E40-R91 VanDerWaalsContact CD-NH2 3.3Å; E40-R91 IonicContact OE1-CZ 3.78Å; E40-R91 IonicContact OE1-NH2 3.78Å; E40-R91 PolarHBondContact OE1-NH2 3.05Å |
| 41 | D | 84.9 | Confident | 76.1 | Confident | 93 Ų | 93 | 75.4 Ų | 75.4 | 50% | 0.497 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -61.5 | -54.4 | 175.8 | -61.8 | -24.5 | 0 | 0 | 0 | 109.1 | G37 G43 S44 S47 | G37-D41 PolarHBondContact O-N 3.05Å; D41-G43 PolarHBondContact O-N 3.08Å; D41-G43 VanDerWaalsContact O-N 3.15Å; D41-S44 PolarHBondContact O-N 3.44Å; D41-S44 VanDerWaalsContact O-N 3.08Å; D41-S44 PolarHBondContact O-OG 3.37Å; D41-S47 WeakPolarHBondContact O-CB 3.44Å; D41-S47 PolarHBondContact O-OG 3.18Å |
| 42 | L | 84.2 | Confident | 75.9 | Confident | 28 Ų | 28 | 77.4 Ų | 77.4 | 15% | 0.147 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -55.9 | -31.6 | 176.6 | -78.7 | 170.6 | 0 | 0 | 0 | 114.8 | V38 L39 F52 M80 F81 A84 | V38-L42 HydrophobicContact CG1-CD1 4.13Å; V38-L42 WeakPolarHBondContact O-CB 3.32Å; V38-L42 VanDerWaalsContact O-CG 3.29Å; V38-L42 WeakPolarHBondContact O-CG 3.42Å; V38-L42 PolarHBondContact O-N 3.38Å; L39-L42 HydrophobicContact CD2-CD1 4.38Å; L42-F52 HydrophobicContact CD1-CD2 4.06Å; L42-F52 HydrophobicContact CD1-CE2 4.24Å; L42-F52 HydrophobicContact CD1-CG 4.3Å; L42-F52 HydrophobicContact CD2-CB 3.6Å; L42-F52 HydrophobicContact CD2-CD1 4.46Å; L42-F52 HydrophobicContact CD2-CD2 4.17Å; L42-F52 HydrophobicContact CD2-CG 3.83Å; L42-F52 HydrophobicContact CG-CD2 4.3Å; L42-F52 HydrophobicContact CG-CG 4.43Å; L42-M80 HydrophobicContact CD1-CB 4.04Å; L42-M80 HydrophobicContact CD1-CE 3.87Å; L42-F81 HydrophobicContact CD2-CD1 4.46Å; L42-F81 HydrophobicContact CD2-CE1 3.81Å; L42-F81 HydrophobicContact CD2-CZ 4.21Å; L42-A84 HydrophobicContact CB-CB 4.25Å |
| 43 | G | 74.4 | Confident | 75.8 | Confident | 45 Ų | 45 | 81.3 Ų | 81.3 | 46% | 0.464 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -85.1 | -11.2 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | L39 E40 D41 | L39-G43 PolarHBondContact O-N 2.9Å; E40-G43 PolarHBondContact O-N 2.86Å; D41-G43 PolarHBondContact O-N 3.08Å; D41-G43 VanDerWaalsContact O-N 3.15Å |
| 44 | S | 72.3 | Confident | 75.8 | Confident | 49 Ų | 49 | 78.9 Ų | 78.9 | 34% | 0.343 | 41% | 0.409 | S | S | . | . | S | Bend | trans | -80.6 | 140.5 | -179.4 | 74.3 | 0 | 0 | 0 | 0 | 111.5 | E40 D41 Q46 S47 | E40-S44 PolarHBondContact O-N 3.09Å; D41-S44 PolarHBondContact O-N 3.44Å; D41-S44 VanDerWaalsContact O-N 3.08Å; D41-S44 PolarHBondContact O-OG 3.37Å; S44-Q46 PolarHBondContact O-N 3.39Å; S44-S47 PolarHBondContact O-N 3.31Å; S44-S47 PolarHBondContact O-OG 3.48Å; S44-S47 WeakPolarHBondContact OG-CB 3.39Å; S44-S47 PolarHBondContact OG-OG 2.91Å |
| 45 | Q | 55.8 | Low | 75.8 | Confident | 196 Ų | 196 | 79.1 Ų | 79.1 | 92% | 0.916 | 41% | 0.414 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.5 | -10.1 | 177.9 | -79.6 | 175.9 | -37.6 | 0 | 0 | 113.7 | ||
| 46 | Q | 51 | Low | 75.8 | Confident | 167 Ų | 167 | 82.6 Ų | 82.6 | 78% | 0.78 | 44% | 0.435 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.8 | -18.1 | -177.8 | -149.1 | 76.7 | 27.4 | 0 | 0 | 112.8 | S44 | S44-Q46 PolarHBondContact O-N 3.39Š|
| 47 | S | 52.6 | Low | 75.9 | Confident | 19 Ų | 19 | 82.1 Ų | 82.1 | 13% | 0.133 | 43% | 0.432 | C | S | . | . | G | 310 helix | trans | -93.1 | 2.5 | -169.3 | 63.7 | 0 | 0 | 0 | 0 | 115.6 | D41 S44 E49 E50 | D41-S47 WeakPolarHBondContact O-CB 3.44Å; D41-S47 PolarHBondContact O-OG 3.18Å; S44-S47 PolarHBondContact O-N 3.31Å; S44-S47 PolarHBondContact O-OG 3.48Å; S44-S47 WeakPolarHBondContact OG-CB 3.39Å; S44-S47 PolarHBondContact OG-OG 2.91Å; S47-E49 PolarHBondContact O-N 2.94Å; S47-E49 VanDerWaalsContact O-N 3.08Å; S47-E50 PolarHBondContact O-N 2.91Å; S47-E50 VanDerWaalsContact O-N 3.09Å |
| 48 | I | 50.6 | Low | 76.1 | Confident | 156 Ų | 156 | 81.4 Ų | 81.4 | 80% | 0.8 | 42% | 0.424 | S | S | * | . | G | 310 helix | trans | -59.8 | -19.5 | 170.9 | -71.8 | 169.1 | 0 | 0 | 0 | 111.2 | ||
| 49 | E | 48.1 | Very low | 76.1 | Confident | 181 Ų | 181 | 87 Ų | 87 | 85% | 0.846 | 45% | 0.449 | S | S | * | . | G | 310 helix | trans | -88 | -18.5 | 178 | -129.4 | 172.1 | -174 | 0 | 0 | 114.2 | S47 | S47-E49 PolarHBondContact O-N 2.94Å; S47-E49 VanDerWaalsContact O-N 3.08Å |
| 50 | E | 59.2 | Low | 76.2 | Confident | 152 Ų | 152 | 89 Ų | 89 | 71% | 0.71 | 46% | 0.459 | S | S | * | . | S | Bend | trans | -96.1 | 104.4 | 171.7 | -85.1 | -173.8 | 159 | 0 | 0 | 109.5 | S47 F52 | S47-E50 PolarHBondContact O-N 2.91Å; S47-E50 VanDerWaalsContact O-N 3.09Å; E50-F52 PolarHBondContact O-N 3.33Å |
| 51 | N | 67.1 | Low | 76.4 | Confident | 154 Ų | 154 | 84.7 Ų | 84.7 | 82% | 0.824 | 44% | 0.439 | S | S | * | . | trans | -55.8 | 106.1 | 173.5 | -72 | 24.1 | 0 | 0 | 0 | 109.5 | D53 | N51-D53 PolarHBondContact O-N 3Š| ||
| 52 | F | 84.2 | Confident | 76.8 | Confident | 46 Ų | 46 | 83.3 Ų | 83.3 | 20% | 0.202 | 43% | 0.429 | C | S | . | . | trans | -54.7 | 115.6 | 170.2 | 168.6 | -111.5 | 0 | 0 | 0 | 109.8 | V38 L42 E50 V54 F57 M80 | V38-F52 HydrophobicContact CG1-CD2 4.04Å; V38-F52 HydrophobicContact CG1-CE2 3.56Å; L42-F52 HydrophobicContact CD1-CD2 4.06Å; L42-F52 HydrophobicContact CD1-CE2 4.24Å; L42-F52 HydrophobicContact CD1-CG 4.3Å; L42-F52 HydrophobicContact CD2-CB 3.6Å; L42-F52 HydrophobicContact CD2-CD1 4.46Å; L42-F52 HydrophobicContact CD2-CD2 4.17Å; L42-F52 HydrophobicContact CD2-CG 3.83Å; L42-F52 HydrophobicContact CG-CD2 4.3Å; L42-F52 HydrophobicContact CG-CG 4.43Å; E50-F52 PolarHBondContact O-N 3.33Å; F52-V54 HydrophobicContact CD1-CB 4.14Å; F52-V54 HydrophobicContact CE1-CB 3.74Å; F52-V54 HydrophobicContact CE1-CG2 4.07Å; F52-V54 PolarHBondContact O-N 3.35Å; F52-V54 VanDerWaalsContact O-N 3.09Å; F52-F57 HydrophobicContact CE2-CB 3.99Å; F52-F57 HydrophobicContact CE2-CD2 4.36Å; F52-F57 HydrophobicContact CE2-CG 4.11Å; F52-F57 HydrophobicContact CZ-CB 3.76Å; F52-F57 AromaticContact CZ-CD1 3.91Å; F52-F57 HydrophobicContact CZ-CD1 3.91Å; F52-F57 HydrophobicContact CZ-CD2 4.34Å; F52-F57 AromaticContact CZ-CG 3.75Å; F52-F57 HydrophobicContact CZ-CG 3.75Å; F52-M80 HydrophobicContact CE1-CB 4.48Å; F52-M80 HydrophobicContact CE1-CG 4.31Å; F52-M80 HydrophobicContact CE2-CE 4.39Å; F52-M80 HydrophobicContact CZ-CE 4.24Å; F52-M80 HydrophobicContact CZ-CG 4.09Å | ||
| 53 | D | 88.8 | Confident | 77.1 | Confident | 90 Ų | 90 | 86 Ų | 86 | 48% | 0.481 | 46% | 0.455 | S | S | . | . | trans | -83 | 88.3 | 179.8 | -163 | -29.3 | 0 | 0 | 0 | 109.8 | N51 E55 V56 F57 | N51-D53 PolarHBondContact O-N 3Å; D53-E55 PolarHBondContact O-N 2.83Å; D53-E55 PolarHBondContact OD1-N 2.94Å; D53-V56 HydrophobicContact CB-CB 4.14Å; D53-V56 HydrophobicContact CB-CG2 4.2Å; D53-V56 VanDerWaalsContact CG-CG2 3.41Å; D53-V56 PolarHBondContact O-N 2.97Å; D53-V56 PolarHBondContact OD1-N 3.05Å; D53-V56 VanDerWaalsContact OD1-N 3.08Å; D53-V56 WeakPolarHBondContact OD2-CG2 3.28Å; D53-F57 PolarHBondContact O-N 3.31Å | ||
| 54 | V | 90.8 | Very high | 77.8 | Confident | 21 Ų | 21 | 88.5 Ų | 88.5 | 13% | 0.127 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -63 | -29.6 | 178.5 | 63.3 | 0 | 0 | 0 | 0 | 112.7 | F52 G58 V76 C77 | F52-V54 HydrophobicContact CD1-CB 4.14Å; F52-V54 HydrophobicContact CE1-CB 3.74Å; F52-V54 HydrophobicContact CE1-CG2 4.07Å; F52-V54 PolarHBondContact O-N 3.35Å; F52-V54 VanDerWaalsContact O-N 3.09Å; V54-G58 PolarHBondContact O-N 2.9Å; V54-V76 HydrophobicContact CG2-CB 3.85Å; V54-V76 HydrophobicContact CG2-CG1 3.8Å; V54-C77 VanDerWaalsContact CB-SG 3.58Å |
| 55 | E | 91 | Very high | 78.6 | Confident | 114 Ų | 114 | 86.3 Ų | 86.3 | 53% | 0.533 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -71.2 | -45.9 | -179.1 | -57.5 | -62.6 | 132.4 | 0 | 0 | 109.4 | D53 F57 G58 E59 S73 | D53-E55 PolarHBondContact O-N 2.83Å; D53-E55 PolarHBondContact OD1-N 2.94Å; E55-F57 VanDerWaalsContact C-N 3.34Å; E55-F57 PolarHBondContact O-N 3.19Å; E55-G58 PolarHBondContact O-N 2.91Å; E55-E59 WeakPolarHBondContact O-CB 3.45Å; E55-E59 WeakPolarHBondContact O-CG 3.36Å; E55-E59 PolarHBondContact O-N 3.21Å; E55-S73 WeakPolarHBondContact OE1-CB 3.35Å |
| 56 | V | 91.2 | Very high | 80.2 | Confident | 74 Ų | 74 | 81.5 Ų | 81.5 | 45% | 0.448 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -63.7 | -40.4 | 174.7 | 174.1 | 0 | 0 | 0 | 0 | 111.7 | D53 E59 M60 | D53-V56 HydrophobicContact CB-CB 4.14Å; D53-V56 HydrophobicContact CB-CG2 4.2Å; D53-V56 VanDerWaalsContact CG-CG2 3.41Å; D53-V56 PolarHBondContact O-N 2.97Å; D53-V56 PolarHBondContact OD1-N 3.05Å; D53-V56 VanDerWaalsContact OD1-N 3.08Å; D53-V56 WeakPolarHBondContact OD2-CG2 3.28Å; V56-E59 PolarHBondContact O-N 3.4Å; V56-M60 WeakPolarHBondContact O-CB 3.41Å; V56-M60 PolarHBondContact O-N 2.68Å |
| 57 | F | 92.4 | Very high | 81.9 | Confident | 3 Ų | 3 | 74.3 Ų | 74.3 | 1% | 0.013 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -63.2 | -42.7 | 175.7 | 177.9 | -101.8 | 0 | 0 | 0 | 112.1 | Y34 I35 F52 D53 E55 M60 L61 F68 V76 M80 | Y34-F57 HydrophobicContact CE1-CD2 4.47Å; I35-F57 HydrophobicContact CG1-CE2 4.28Å; F52-F57 HydrophobicContact CE2-CB 3.99Å; F52-F57 HydrophobicContact CE2-CD2 4.36Å; F52-F57 HydrophobicContact CE2-CG 4.11Å; F52-F57 HydrophobicContact CZ-CB 3.76Å; F52-F57 AromaticContact CZ-CD1 3.91Å; F52-F57 HydrophobicContact CZ-CD1 3.91Å; F52-F57 HydrophobicContact CZ-CD2 4.34Å; F52-F57 AromaticContact CZ-CG 3.75Å; F52-F57 HydrophobicContact CZ-CG 3.75Å; D53-F57 PolarHBondContact O-N 3.31Å; E55-F57 VanDerWaalsContact C-N 3.34Å; E55-F57 PolarHBondContact O-N 3.19Å; F57-M60 HydrophobicContact CD2-CE 4.31Å; F57-M60 HydrophobicContact CE2-CE 4.32Å; F57-M60 PolarHBondContact O-N 3.27Å; F57-L61 HydrophobicContact CD1-CD1 3.99Å; F57-L61 HydrophobicContact CE1-CD1 3.29Å; F57-L61 HydrophobicContact CE1-CG 4.28Å; F57-L61 HydrophobicContact CE2-CD1 4.1Å; F57-L61 HydrophobicContact CE2-CG 4.44Å; F57-L61 HydrophobicContact CZ-CD1 3.36Å; F57-L61 HydrophobicContact CZ-CG 4.17Å; F57-L61 PolarHBondContact O-N 3.44Å; F57-F68 HydrophobicContact CE1-CE1 4.47Å; F57-F68 HydrophobicContact CE1-CZ 4.47Å; F57-V76 HydrophobicContact CD1-CG1 3.85Å; F57-V76 HydrophobicContact CE1-CG1 3.92Å; F57-M80 HydrophobicContact CE1-CE 4.25Å; F57-M80 HydrophobicContact CE1-CG 4.08Å; F57-M80 HydrophobicContact CE1-SD 3.76Å; F57-M80 HydrophobicContact CE2-CE 3.9Å; F57-M80 HydrophobicContact CE2-SD 4.31Å; F57-M80 HydrophobicContact CZ-CE 3.71Å; F57-M80 HydrophobicContact CZ-CG 4.41Å; F57-M80 HydrophobicContact CZ-SD 3.51Å; F57-M80 VanDerWaalsContact CZ-SD 3.51Å |
| 58 | G | 92.1 | Very high | 83.8 | Confident | 8 Ų | 8 | 73.5 Ų | 73.5 | 8% | 0.082 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -64.2 | -45.1 | 176 | 0 | 0 | 0 | 0 | 0 | 112.6 | V54 E55 M60 L61 E62 | V54-G58 PolarHBondContact O-N 2.9Å; E55-G58 PolarHBondContact O-N 2.91Å; G58-M60 VanDerWaalsContact C-N 3.32Å; G58-M60 PolarHBondContact O-N 3.32Å; G58-L61 PolarHBondContact O-N 2.98Å; G58-E62 WeakPolarHBondContact O-CB 3.46Å; G58-E62 PolarHBondContact O-N 3.5Å |
| 59 | E | 91.8 | Very high | 85.7 | Confident | 139 Ų | 139 | 68.9 Ų | 68.9 | 65% | 0.65 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -60 | -41 | 175.2 | -76.3 | -177.5 | -176.3 | 0 | 0 | 112.1 | E55 V56 E62 | E55-E59 WeakPolarHBondContact O-CB 3.45Å; E55-E59 WeakPolarHBondContact O-CG 3.36Å; E55-E59 PolarHBondContact O-N 3.21Å; V56-E59 PolarHBondContact O-N 3.4Å; E59-E62 PolarHBondContact O-N 2.9Å |
| 60 | M | 91.6 | Very high | 87.8 | Confident | 44 Ų | 44 | 68.7 Ų | 68.7 | 22% | 0.217 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -64 | -46.8 | 175.8 | -177.2 | -72.6 | -67.4 | 0 | 0 | 110.7 | L31 Y34 V56 F57 G58 E62 A63 Y64 | L31-M60 HydrophobicContact CD1-CE 3.62Å; L31-M60 HydrophobicContact CD1-SD 3.53Å; L31-M60 VanDerWaalsContact CD1-SD 3.53Å; Y34-M60 HydrophobicContact CD1-CE 3.66Å; Y34-M60 HydrophobicContact CE1-CE 3.44Å; Y34-M60 VanDerWaalsContact CE1-CE 3.44Å; V56-M60 WeakPolarHBondContact O-CB 3.41Å; V56-M60 PolarHBondContact O-N 2.68Å; F57-M60 HydrophobicContact CD2-CE 4.31Å; F57-M60 HydrophobicContact CE2-CE 4.32Å; F57-M60 PolarHBondContact O-N 3.27Å; G58-M60 VanDerWaalsContact C-N 3.32Å; G58-M60 PolarHBondContact O-N 3.32Å; M60-E62 VanDerWaalsContact C-N 3.33Å; M60-E62 PolarHBondContact O-N 2.83Å; M60-A63 WeakPolarHBondContact O-CB 3.19Å; M60-A63 PolarHBondContact O-N 3.1Å; M60-Y64 WeakPolarHBondContact O-CD2 3.31Å; M60-Y64 HydrophobicContact SD-CD2 4Å; M60-Y64 HydrophobicContact SD-CE2 3.74Å |
| 61 | L | 91.1 | Very high | 89.3 | Confident | 0 Ų | 0 | 62.3 Ų | 62.3 | 0% | 0 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -67.5 | -30.8 | 179.7 | -78 | -178.4 | 0 | 0 | 0 | 113.3 | L31 I35 F57 G58 A63 Y64 I65 F68 | L31-L61 HydrophobicContact CD1-CD2 4.36Å; L31-L61 HydrophobicContact CD2-CD2 4.43Å; I35-L61 HydrophobicContact CD1-CD2 4.25Å; F57-L61 HydrophobicContact CD1-CD1 3.99Å; F57-L61 HydrophobicContact CE1-CD1 3.29Å; F57-L61 HydrophobicContact CE1-CG 4.28Å; F57-L61 HydrophobicContact CE2-CD1 4.1Å; F57-L61 HydrophobicContact CE2-CG 4.44Å; F57-L61 HydrophobicContact CZ-CD1 3.36Å; F57-L61 HydrophobicContact CZ-CG 4.17Å; F57-L61 PolarHBondContact O-N 3.44Å; G58-L61 PolarHBondContact O-N 2.98Å; L61-A63 PolarHBondContact O-N 3.07Å; L61-Y64 PolarHBondContact O-N 2.87Å; L61-I65 HydrophobicContact CD2-CD1 4.27Å; L61-I65 PolarHBondContact O-N 2.91Å; L61-F68 HydrophobicContact CB-CB 4.43Å; L61-F68 HydrophobicContact CB-CD1 3.48Å; L61-F68 VanDerWaalsContact CB-CD1 3.48Å; L61-F68 HydrophobicContact CB-CD2 4.45Å; L61-F68 HydrophobicContact CB-CE1 3.81Å; L61-F68 HydrophobicContact CB-CG 3.86Å; L61-F68 HydrophobicContact CB-CZ 4.41Å; L61-F68 HydrophobicContact CD1-CD1 3.93Å; L61-F68 HydrophobicContact CD1-CD2 4.39Å; L61-F68 HydrophobicContact CD1-CE1 3.34Å; L61-F68 HydrophobicContact CD1-CE2 3.86Å; L61-F68 HydrophobicContact CD1-CG 4.42Å; L61-F68 HydrophobicContact CD1-CZ 3.31Å; L61-F68 HydrophobicContact CG-CD1 4.37Å; L61-F68 HydrophobicContact CG-CE1 4.21Å; L61-F68 HydrophobicContact CG-CZ 4.5Å |
| 62 | E | 92 | Very high | 90.6 | Very high | 64 Ų | 64 | 59.3 Ų | 59.3 | 30% | 0.299 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -56.6 | -33.2 | 174.5 | -177.9 | 62.4 | -154.2 | 0 | 0 | 112.4 | G58 E59 M60 Y64 I65 P66 G67 F68 A69 | G58-E62 WeakPolarHBondContact O-CB 3.46Å; G58-E62 PolarHBondContact O-N 3.5Å; E59-E62 PolarHBondContact O-N 2.9Å; M60-E62 VanDerWaalsContact C-N 3.33Å; M60-E62 PolarHBondContact O-N 2.83Å; E62-Y64 PolarHBondContact O-N 3.32Å; E62-I65 WeakPolarHBondContact CA-O 3.28Å; E62-I65 CarbonylContact O-C 3.54Å; E62-P66 WeakPolarHBondContact OE1-CA 3.33Å; E62-G67 VanDerWaalsContact CD-N 3.26Å; E62-G67 PolarHBondContact OE1-N 3.39Å; E62-G67 VanDerWaalsContact OE2-C 3.3Å; E62-G67 WeakPolarHBondContact OE2-CA 3.44Å; E62-G67 PolarHBondContact OE2-N 2.84Å; E62-F68 PolarHBondContact OE2-N 3.08Å; E62-A69 HydrophobicContact CB-CB 4.11Å; E62-A69 HydrophobicContact CG-CB 4.16Å; E62-A69 PolarHBondContact OE2-N 2.93Å |
| 63 | A | 90.4 | Very high | 91 | Very high | 84 Ų | 84 | 59 Ų | 59 | 69% | 0.694 | 33% | 0.329 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.4 | -23.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | M60 L61 | M60-A63 WeakPolarHBondContact O-CB 3.19Å; M60-A63 PolarHBondContact O-N 3.1Å; L61-A63 PolarHBondContact O-N 3.07Å |
| 64 | Y | 88.9 | Confident | 91.1 | Very high | 98 Ų | 98 | 59 Ų | 59 | 38% | 0.384 | 33% | 0.332 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -106.4 | -35.4 | -179.6 | -63.2 | -90.9 | 0 | 0 | 0 | 112.6 | T26 L31 M60 L61 E62 | T26-Y64 PolarHBondContact OG1-O 2.9Å; L31-Y64 HydrophobicContact CD1-CD2 4.47Å; L31-Y64 HydrophobicContact CD1-CE2 4.27Å; L31-Y64 HydrophobicContact CD2-CD1 3.75Å; L31-Y64 HydrophobicContact CD2-CD2 3.8Å; L31-Y64 HydrophobicContact CD2-CE1 4.09Å; L31-Y64 HydrophobicContact CD2-CE2 4.15Å; L31-Y64 HydrophobicContact CD2-CG 3.6Å; M60-Y64 WeakPolarHBondContact O-CD2 3.31Å; M60-Y64 HydrophobicContact SD-CD2 4Å; M60-Y64 HydrophobicContact SD-CE2 3.74Å; L61-Y64 PolarHBondContact O-N 2.87Å; E62-Y64 PolarHBondContact O-N 3.32Å |
| 65 | I | 89.6 | Confident | 91.2 | Very high | 2 Ų | 2 | 61.6 Ų | 61.6 | 1% | 0.01 | 34% | 0.342 | C | S | . | . | S | Bend | trans | -125.4 | 95.2 | -177.7 | -61 | 139.2 | 0 | 0 | 0 | 107.4 | I15 I19 A22 L24 L61 E62 G67 F68 | I15-I65 HydrophobicContact CD1-CD1 3.41Å; I15-I65 VanDerWaalsContact CD1-CD1 3.41Å; I15-I65 HydrophobicContact CD1-CG1 4.16Å; I15-I65 HydrophobicContact CD1-CG2 4.34Å; I15-I65 HydrophobicContact CG2-CG2 4Å; I19-I65 HydrophobicContact CD1-CG2 4.03Å; A22-I65 HydrophobicContact CB-CG2 4.1Å; L24-I65 HydrophobicContact CD2-CD1 4.33Å; L24-I65 HydrophobicContact CD2-CG1 4.27Å; L61-I65 HydrophobicContact CD2-CD1 4.27Å; L61-I65 PolarHBondContact O-N 2.91Å; E62-I65 WeakPolarHBondContact CA-O 3.28Å; E62-I65 CarbonylContact O-C 3.54Å; I65-G67 PolarHBondContact O-N 3.16Å; I65-F68 HydrophobicContact CB-CB 4.21Å; I65-F68 HydrophobicContact CG2-CB 4.16Å; I65-F68 HydrophobicContact CG2-CD2 4.38Å; I65-F68 WeakPolarHBondContact O-CB 3.4Å; I65-F68 PolarHBondContact O-N 3.42Å |
| 66 | P | 89.7 | Confident | 91.2 | Very high | 96 Ų | 96 | 56.4 Ų | 56.4 | 62% | 0.623 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.8 | 135.5 | 178.1 | -24.5 | 34.4 | 0 | 0 | 0 | 112 | E62 | E62-P66 WeakPolarHBondContact OE1-CA 3.33Š|
| 67 | G | 88 | Confident | 91.2 | Very high | 16 Ų | 16 | 54.2 Ų | 54.2 | 17% | 0.165 | 31% | 0.305 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 84.9 | 1.9 | -177.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | I19 E62 I65 A69 E70 | I19-G67 VanDerWaalsContact CD1-C 3.4Å; I19-G67 WeakPolarHBondContact CD1-O 3.3Å; E62-G67 VanDerWaalsContact CD-N 3.26Å; E62-G67 PolarHBondContact OE1-N 3.39Å; E62-G67 VanDerWaalsContact OE2-C 3.3Å; E62-G67 WeakPolarHBondContact OE2-CA 3.44Å; E62-G67 PolarHBondContact OE2-N 2.84Å; I65-G67 PolarHBondContact O-N 3.16Å; G67-A69 VanDerWaalsContact C-N 3.34Å; G67-E70 WeakPolarHBondContact O-CB 3.39Å; G67-E70 PolarHBondContact O-N 3.48Å |
| 68 | F | 91.4 | Very high | 91.2 | Very high | 2 Ų | 2 | 59.4 Ų | 59.4 | 1% | 0.009 | 33% | 0.329 | C | S | . | . | G | 310 helix | trans | -64.9 | -36.9 | 176 | -169.3 | -87.3 | 0 | 0 | 0 | 112.4 | F14 I15 I19 F57 L61 E62 I65 E70 I71 V76 | F14-F68 HydrophobicContact CD1-CE2 4.34Å; F14-F68 HydrophobicContact CE1-CE2 4.11Å; F14-F68 HydrophobicContact CE1-CZ 4.26Å; I15-F68 HydrophobicContact CD1-CD2 4.24Å; I15-F68 HydrophobicContact CD1-CE2 4.18Å; I15-F68 HydrophobicContact CG1-CD2 4.06Å; I15-F68 HydrophobicContact CG1-CE2 3.9Å; I19-F68 HydrophobicContact CD1-CB 4.44Å; F57-F68 HydrophobicContact CE1-CE1 4.47Å; F57-F68 HydrophobicContact CE1-CZ 4.47Å; L61-F68 HydrophobicContact CB-CB 4.43Å; L61-F68 HydrophobicContact CB-CD1 3.48Å; L61-F68 VanDerWaalsContact CB-CD1 3.48Å; L61-F68 HydrophobicContact CB-CD2 4.45Å; L61-F68 HydrophobicContact CB-CE1 3.81Å; L61-F68 HydrophobicContact CB-CG 3.86Å; L61-F68 HydrophobicContact CB-CZ 4.41Å; L61-F68 HydrophobicContact CD1-CD1 3.93Å; L61-F68 HydrophobicContact CD1-CD2 4.39Å; L61-F68 HydrophobicContact CD1-CE1 3.34Å; L61-F68 HydrophobicContact CD1-CE2 3.86Å; L61-F68 HydrophobicContact CD1-CG 4.42Å; L61-F68 HydrophobicContact CD1-CZ 3.31Å; L61-F68 HydrophobicContact CG-CD1 4.37Å; L61-F68 HydrophobicContact CG-CE1 4.21Å; L61-F68 HydrophobicContact CG-CZ 4.5Å; E62-F68 PolarHBondContact OE2-N 3.08Å; I65-F68 HydrophobicContact CB-CB 4.21Å; I65-F68 HydrophobicContact CG2-CB 4.16Å; I65-F68 HydrophobicContact CG2-CD2 4.38Å; I65-F68 WeakPolarHBondContact O-CB 3.4Å; I65-F68 PolarHBondContact O-N 3.42Å; F68-E70 PolarHBondContact O-N 2.72Å; F68-I71 HydrophobicContact CD2-CD1 3.86Å; F68-I71 HydrophobicContact CE2-CD1 4.04Å; F68-I71 HydrophobicContact CG-CD1 4.34Å; F68-I71 WeakPolarHBondContact O-CB 3.32Å; F68-I71 WeakPolarHBondContact O-CG1 3.32Å; F68-I71 PolarHBondContact O-N 2.87Å; F68-I71 VanDerWaalsContact O-N 3.14Å; F68-V76 HydrophobicContact CE1-CG1 4.23Å; F68-V76 HydrophobicContact CE1-CG2 4.19Å; F68-V76 HydrophobicContact CZ-CG1 4.25Å; F68-V76 HydrophobicContact CZ-CG2 4.24Å |
| 69 | A | 90.8 | Very high | 91.2 | Very high | 59 Ų | 59 | 59.7 Ų | 59.7 | 49% | 0.488 | 33% | 0.329 | S | S | . | . | G | 310 helix | trans | -67.6 | -13 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | E62 G67 I71 | E62-A69 HydrophobicContact CB-CB 4.11Å; E62-A69 HydrophobicContact CG-CB 4.16Å; E62-A69 PolarHBondContact OE2-N 2.93Å; G67-A69 VanDerWaalsContact C-N 3.34Å; A69-I71 VanDerWaalsContact C-N 3.3Å |
| 70 | E | 90.9 | Very high | 91.2 | Very high | 177 Ų | 177 | 53.1 Ų | 53.1 | 83% | 0.827 | 30% | 0.298 | S | S | * | . | G | 310 helix | trans | -80.8 | -12.9 | 174.9 | -59.5 | -177.3 | 172.2 | 0 | 0 | 112.7 | G67 F68 | G67-E70 WeakPolarHBondContact O-CB 3.39Å; G67-E70 PolarHBondContact O-N 3.48Å; F68-E70 PolarHBondContact O-N 2.72Å |
| 71 | I | 92.3 | Very high | 91.1 | Very high | 17 Ų | 17 | 56.2 Ų | 56.2 | 9% | 0.087 | 31% | 0.311 | C | S | . | . | S | Bend | trans | -72.9 | 135.6 | 177.5 | -55.4 | 174.7 | 0 | 0 | 0 | 109.2 | F14 Y18 I19 F68 A69 S73 K75 V76 | F14-I71 HydrophobicContact CE1-CD1 3.96Å; F14-I71 HydrophobicContact CE1-CG2 4.21Å; F14-I71 HydrophobicContact CZ-CG2 3.85Å; Y18-I71 HydrophobicContact CD1-CG2 4.33Å; Y18-I71 HydrophobicContact CD2-CD1 4.3Å; Y18-I71 HydrophobicContact CD2-CG2 4.27Å; Y18-I71 HydrophobicContact CE1-CG2 4.47Å; Y18-I71 HydrophobicContact CE2-CG2 4.42Å; Y18-I71 HydrophobicContact CG-CD1 4.17Å; Y18-I71 HydrophobicContact CG-CG1 4.17Å; Y18-I71 HydrophobicContact CG-CG2 4.24Å; I19-I71 HydrophobicContact CD1-CD1 4.22Å; F68-I71 HydrophobicContact CD2-CD1 3.86Å; F68-I71 HydrophobicContact CE2-CD1 4.04Å; F68-I71 HydrophobicContact CG-CD1 4.34Å; F68-I71 WeakPolarHBondContact O-CB 3.32Å; F68-I71 WeakPolarHBondContact O-CG1 3.32Å; F68-I71 PolarHBondContact O-N 2.87Å; F68-I71 VanDerWaalsContact O-N 3.14Å; A69-I71 VanDerWaalsContact C-N 3.3Å; I71-S73 PolarHBondContact O-N 3Å; I71-K75 HydrophobicContact CG2-CB 4.32Å; I71-V76 HydrophobicContact CB-CG2 4.18Å; I71-V76 HydrophobicContact CG2-CG2 3.9Å |
| 72 | D | 93.6 | Very high | 91.1 | Very high | 91 Ų | 91 | 59.7 Ų | 59.7 | 49% | 0.487 | 34% | 0.335 | S | S | . | . | trans | -55.1 | 126.6 | 178.5 | -177.5 | 38.6 | 0 | 0 | 0 | 111.4 | V74 K75 V76 | D72-V74 PolarHBondContact O-N 3.4Å; D72-V74 VanDerWaalsContact O-N 3.16Å; D72-V74 WeakPolarHBondContact OD2-CB 3.33Å; D72-K75 HydrophobicContact CB-CB 4.44Å; D72-K75 HydrophobicContact CB-CG 4.09Å; D72-K75 WeakPolarHBondContact O-CA 3.08Å; D72-K75 WeakPolarHBondContact O-CB 3.24Å; D72-K75 PolarHBondContact O-N 3.21Å; D72-V76 PolarHBondContact O-N 3Å; D72-V76 VanDerWaalsContact O-N 3.16Å | ||
| 73 | S | 92 | Very high | 91 | Very high | 41 Ų | 41 | 56.8 Ų | 56.8 | 29% | 0.287 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -61.3 | -30.2 | -174.4 | 59.1 | 0 | 0 | 0 | 0 | 112.3 | E55 I71 K75 V76 C77 | E55-S73 WeakPolarHBondContact OE1-CB 3.35Å; I71-S73 PolarHBondContact O-N 3Å; S73-K75 VanDerWaalsContact C-N 3.28Å; S73-K75 PolarHBondContact O-N 3.37Å; S73-V76 PolarHBondContact O-N 3.01Å; S73-C77 WeakPolarHBondContact O-CB 3.01Å; S73-C77 PolarHBondContact O-N 2.96Å; S73-C77 PolarHBondContact O-SG 3.29Å; S73-C77 VanDerWaalsContact O-SG 3.39Å |
| 74 | V | 90.8 | Very high | 91 | Very high | 90 Ų | 90 | 53 Ų | 53 | 55% | 0.545 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -60 | -39.2 | 172.2 | -175 | 0 | 0 | 0 | 0 | 111.3 | D72 E78 | D72-V74 PolarHBondContact O-N 3.4Å; D72-V74 VanDerWaalsContact O-N 3.16Å; D72-V74 WeakPolarHBondContact OD2-CB 3.33Å; V74-E78 WeakPolarHBondContact O-CB 3.32Å; V74-E78 PolarHBondContact O-N 3.02Å |
| 75 | K | 92.8 | Very high | 91 | Very high | 75 Ų | 75 | 52 Ų | 52 | 33% | 0.326 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -72.7 | -37.6 | 179.3 | -65.4 | -70.4 | 160.6 | -158.8 | 0 | 112.3 | F14 I71 D72 S73 E78 M79 | F14-K75 HydrophobicContact CE2-CB 4.42Å; F14-K75 HydrophobicContact CZ-CB 4.37Å; I71-K75 HydrophobicContact CG2-CB 4.32Å; D72-K75 HydrophobicContact CB-CB 4.44Å; D72-K75 HydrophobicContact CB-CG 4.09Å; D72-K75 WeakPolarHBondContact O-CA 3.08Å; D72-K75 WeakPolarHBondContact O-CB 3.24Å; D72-K75 PolarHBondContact O-N 3.21Å; S73-K75 VanDerWaalsContact C-N 3.28Å; S73-K75 PolarHBondContact O-N 3.37Å; K75-E78 IonicContact NZ-OE2 2.91Å; K75-E78 PolarHBondContact NZ-OE2 3.23Å; K75-E78 PolarHBondContact O-N 2.99Å; K75-M79 WeakPolarHBondContact O-CB 3.49Å; K75-M79 PolarHBondContact O-N 3.02Å |
| 76 | V | 92.4 | Very high | 90.9 | Very high | 4 Ų | 4 | 56.8 Ų | 56.8 | 2% | 0.024 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -63.5 | -47.1 | 173.6 | -179.3 | 0 | 0 | 0 | 0 | 110.2 | F14 V54 F57 F68 I71 D72 S73 M79 M80 | F14-V76 HydrophobicContact CE1-CG2 4.43Å; F14-V76 HydrophobicContact CZ-CG2 4.28Å; V54-V76 HydrophobicContact CG2-CB 3.85Å; V54-V76 HydrophobicContact CG2-CG1 3.8Å; F57-V76 HydrophobicContact CD1-CG1 3.85Å; F57-V76 HydrophobicContact CE1-CG1 3.92Å; F68-V76 HydrophobicContact CE1-CG1 4.23Å; F68-V76 HydrophobicContact CE1-CG2 4.19Å; F68-V76 HydrophobicContact CZ-CG1 4.25Å; F68-V76 HydrophobicContact CZ-CG2 4.24Å; I71-V76 HydrophobicContact CB-CG2 4.18Å; I71-V76 HydrophobicContact CG2-CG2 3.9Å; D72-V76 PolarHBondContact O-N 3Å; D72-V76 VanDerWaalsContact O-N 3.16Å; S73-V76 PolarHBondContact O-N 3.01Å; V76-M79 HydrophobicContact CG1-CE 4.4Å; V76-M79 PolarHBondContact O-N 3.22Å; V76-M80 HydrophobicContact CG1-CG 4.45Å; V76-M80 VanDerWaalsContact O-CG 3.3Å; V76-M80 WeakPolarHBondContact O-CG 3.5Å; V76-M80 PolarHBondContact O-N 2.89Å |
| 77 | C | 91 | Very high | 90.9 | Very high | 28 Ų | 28 | 52.3 Ų | 52.3 | 19% | 0.189 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -57.9 | -49.9 | 174.3 | -76.3 | 0 | 0 | 0 | 0 | 112.4 | V54 S73 M79 M80 F81 | V54-C77 VanDerWaalsContact CB-SG 3.58Å; S73-C77 WeakPolarHBondContact O-CB 3.01Å; S73-C77 PolarHBondContact O-N 2.96Å; S73-C77 PolarHBondContact O-SG 3.29Å; S73-C77 VanDerWaalsContact O-SG 3.39Å; C77-M79 VanDerWaalsContact C-N 3.29Å; C77-M79 PolarHBondContact O-N 2.82Å; C77-M80 PolarHBondContact O-N 2.91Å; C77-M80 VanDerWaalsContact O-N 3.16Å; C77-F81 HydrophobicContact CB-CD2 4.39Å; C77-F81 HydrophobicContact CB-CE2 4.26Å; C77-F81 WeakPolarHBondContact O-CD2 3.34Å; C77-F81 PolarHBondContact O-N 3.37Å |
| 78 | E | 91.6 | Very high | 90.7 | Very high | 112 Ų | 112 | 53.5 Ų | 53.5 | 52% | 0.523 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -55.7 | -45.4 | 178.7 | -175 | 178.2 | -173.6 | 0 | 0 | 111.2 | V74 K75 S82 | V74-E78 WeakPolarHBondContact O-CB 3.32Å; V74-E78 PolarHBondContact O-N 3.02Å; K75-E78 IonicContact NZ-OE2 2.91Å; K75-E78 PolarHBondContact NZ-OE2 3.23Å; K75-E78 PolarHBondContact O-N 2.99Å; E78-S82 WeakPolarHBondContact O-CB 3.38Å; E78-S82 PolarHBondContact O-N 2.91Å; E78-S82 PolarHBondContact O-OG 2.85Å |
| 79 | M | 92.6 | Very high | 90.4 | Very high | 15 Ų | 15 | 57.6 Ų | 57.6 | 7% | 0.074 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -61 | -50.4 | 175.1 | 177.4 | -83.6 | -62.8 | 0 | 0 | 111.3 | F14 K75 V76 C77 F81 S82 L83 | F14-M79 HydrophobicContact CB-CG 4.07Å; F14-M79 HydrophobicContact CD1-CE 4.06Å; F14-M79 HydrophobicContact CD1-CG 4.27Å; F14-M79 HydrophobicContact CD2-CB 3.75Å; F14-M79 HydrophobicContact CD2-CG 3.66Å; F14-M79 HydrophobicContact CE1-CE 4.12Å; F14-M79 HydrophobicContact CE2-CB 3.69Å; F14-M79 HydrophobicContact CE2-CG 4.09Å; F14-M79 HydrophobicContact CG-CB 4.28Å; F14-M79 HydrophobicContact CG-CE 4.47Å; F14-M79 HydrophobicContact CG-CG 3.74Å; F14-M79 HydrophobicContact CZ-CB 4.2Å; K75-M79 WeakPolarHBondContact O-CB 3.49Å; K75-M79 PolarHBondContact O-N 3.02Å; V76-M79 HydrophobicContact CG1-CE 4.4Å; V76-M79 PolarHBondContact O-N 3.22Å; C77-M79 VanDerWaalsContact C-N 3.29Å; C77-M79 PolarHBondContact O-N 2.82Å; M79-F81 PolarHBondContact O-N 3.03Å; M79-S82 PolarHBondContact O-N 2.94Å; M79-S82 PolarHBondContact O-OG 3.49Å; M79-L83 WeakPolarHBondContact O-CB 3.29Å; M79-L83 PolarHBondContact O-N 3.01Å; M79-L83 HydrophobicContact SD-CD1 4.01Å |
| 80 | M | 91.4 | Very high | 90 | Very high | 1 Ų | 1 | 56.1 Ų | 56.1 | 1% | 0.005 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -60 | -44.5 | -179.2 | -71.9 | -62.9 | -72.8 | 0 | 0 | 112.6 | V38 L39 L42 F52 F57 V76 C77 L83 A84 | V38-M80 HydrophobicContact CB-CE 4.45Å; V38-M80 HydrophobicContact CG1-CE 3.68Å; L39-M80 HydrophobicContact CD2-CE 3.53Å; L39-M80 VanDerWaalsContact CD2-O 3.32Å; L39-M80 WeakPolarHBondContact CD2-O 3.32Å; L39-M80 HydrophobicContact CD2-SD 3.98Å; L39-M80 HydrophobicContact CG-CE 3.82Å; L42-M80 HydrophobicContact CD1-CB 4.04Å; L42-M80 HydrophobicContact CD1-CE 3.87Å; F52-M80 HydrophobicContact CE1-CB 4.48Å; F52-M80 HydrophobicContact CE1-CG 4.31Å; F52-M80 HydrophobicContact CE2-CE 4.39Å; F52-M80 HydrophobicContact CZ-CE 4.24Å; F52-M80 HydrophobicContact CZ-CG 4.09Å; F57-M80 HydrophobicContact CE1-CE 4.25Å; F57-M80 HydrophobicContact CE1-CG 4.08Å; F57-M80 HydrophobicContact CE1-SD 3.76Å; F57-M80 HydrophobicContact CE2-CE 3.9Å; F57-M80 HydrophobicContact CE2-SD 4.31Å; F57-M80 HydrophobicContact CZ-CE 3.71Å; F57-M80 HydrophobicContact CZ-CG 4.41Å; F57-M80 HydrophobicContact CZ-SD 3.51Å; F57-M80 VanDerWaalsContact CZ-SD 3.51Å; V76-M80 HydrophobicContact CG1-CG 4.45Å; V76-M80 VanDerWaalsContact O-CG 3.3Å; V76-M80 WeakPolarHBondContact O-CG 3.5Å; V76-M80 PolarHBondContact O-N 2.89Å; C77-M80 PolarHBondContact O-N 2.91Å; C77-M80 VanDerWaalsContact O-N 3.16Å; M80-L83 PolarHBondContact O-N 3.46Å; M80-A84 WeakPolarHBondContact O-CB 3.37Å; M80-A84 PolarHBondContact O-N 3.09Å |
| 81 | F | 89.7 | Confident | 89.3 | Confident | 109 Ų | 109 | 51.5 Ų | 51.5 | 48% | 0.478 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -65.6 | -40.4 | 176 | -74.5 | -62 | 0 | 0 | 0 | 112.7 | L42 C77 M79 L83 S85 | L42-F81 HydrophobicContact CD2-CD1 4.46Å; L42-F81 HydrophobicContact CD2-CE1 3.81Å; L42-F81 HydrophobicContact CD2-CZ 4.21Å; C77-F81 HydrophobicContact CB-CD2 4.39Å; C77-F81 HydrophobicContact CB-CE2 4.26Å; C77-F81 WeakPolarHBondContact O-CD2 3.34Å; C77-F81 PolarHBondContact O-N 3.37Å; M79-F81 PolarHBondContact O-N 3.03Å; F81-L83 VanDerWaalsContact C-N 3.29Å; F81-L83 PolarHBondContact O-N 3.04Å; F81-S85 WeakPolarHBondContact O-CB 3.42Å; F81-S85 PolarHBondContact O-N 3.22Å; F81-S85 PolarHBondContact O-OG 3.47Å |
| 82 | S | 90.2 | Very high | 88.1 | Confident | 72 Ų | 72 | 57.3 Ų | 57.3 | 50% | 0.503 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -63.7 | -39.1 | 176.3 | 78.3 | 0 | 0 | 0 | 0 | 111.5 | E78 M79 S85 K86 | E78-S82 WeakPolarHBondContact O-CB 3.38Å; E78-S82 PolarHBondContact O-N 2.91Å; E78-S82 PolarHBondContact O-OG 2.85Å; M79-S82 PolarHBondContact O-N 2.94Å; M79-S82 PolarHBondContact O-OG 3.49Å; S82-S85 PolarHBondContact O-N 3.3Å; S82-K86 WeakPolarHBondContact O-CB 3.41Å; S82-K86 PolarHBondContact O-N 2.87Å |
| 83 | L | 91.4 | Very high | 86.6 | Confident | 3 Ų | 3 | 56.5 Ų | 56.5 | 2% | 0.016 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -70.8 | -45.7 | -179.8 | -153 | 159.6 | 0 | 0 | 0 | 110.3 | I7 A10 L39 M79 M80 F81 S85 K86 L87 | I7-L83 HydrophobicContact CB-CD2 4.44Å; I7-L83 HydrophobicContact CG1-CD2 3.73Å; A10-L83 HydrophobicContact CB-CD1 3.63Å; A10-L83 HydrophobicContact CB-CG 4.13Å; L39-L83 HydrophobicContact CD1-CD2 3.37Å; L39-L83 HydrophobicContact CD1-CG 4.43Å; L39-L83 HydrophobicContact CD2-CB 4.11Å; L39-L83 HydrophobicContact CD2-CD2 4.17Å; L39-L83 HydrophobicContact CG-CD2 4.4Å; M79-L83 WeakPolarHBondContact O-CB 3.29Å; M79-L83 PolarHBondContact O-N 3.01Å; M79-L83 HydrophobicContact SD-CD1 4.01Å; M80-L83 PolarHBondContact O-N 3.46Å; F81-L83 VanDerWaalsContact C-N 3.29Å; F81-L83 PolarHBondContact O-N 3.04Å; L83-S85 VanDerWaalsContact C-N 3.31Å; L83-S85 PolarHBondContact O-N 2.98Å; L83-K86 CarbonylContact O-C 3.52Å; L83-K86 WeakPolarHBondContact O-CB 3.41Å; L83-K86 PolarHBondContact O-N 2.9Å; L83-K86 VanDerWaalsContact O-N 3.09Å; L83-L87 HydrophobicContact CD2-CD1 3.8Å; L83-L87 HydrophobicContact CD2-CD2 4.26Å; L83-L87 HydrophobicContact CD2-CG 3.77Å; L83-L87 WeakPolarHBondContact O-CG 3.39Å; L83-L87 PolarHBondContact O-N 2.95Å |
| 84 | A | 90.6 | Very high | 84.8 | Confident | 5 Ų | 5 | 61.3 Ų | 61.3 | 4% | 0.041 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -56.9 | -44.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | L39 L42 M80 K86 L87 A88 | L39-A84 HydrophobicContact CD2-CB 4Å; L42-A84 HydrophobicContact CB-CB 4.25Å; M80-A84 WeakPolarHBondContact O-CB 3.37Å; M80-A84 PolarHBondContact O-N 3.09Å; A84-K86 PolarHBondContact O-N 3.07Å; A84-L87 PolarHBondContact O-N 2.89Å; A84-A88 PolarHBondContact O-N 3.48Å |
| 85 | S | 88.1 | Confident | 82.8 | Confident | 77 Ų | 77 | 63.4 Ų | 63.4 | 54% | 0.538 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -61.9 | -42 | 174.9 | -59.2 | 0 | 0 | 0 | 0 | 112.2 | F81 S82 L83 L87 A88 T89 | F81-S85 WeakPolarHBondContact O-CB 3.42Å; F81-S85 PolarHBondContact O-N 3.22Å; F81-S85 PolarHBondContact O-OG 3.47Å; S82-S85 PolarHBondContact O-N 3.3Å; L83-S85 VanDerWaalsContact C-N 3.31Å; L83-S85 PolarHBondContact O-N 2.98Å; S85-L87 VanDerWaalsContact C-N 3.34Å; S85-A88 PolarHBondContact O-N 3.44Å; S85-T89 WeakPolarHBondContact O-CG2 3.37Å; S85-T89 PolarHBondContact O-N 3.41Å; S85-T89 VanDerWaalsContact O-N 3.1Å; S85-T89 PolarHBondContact O-OG1 2.92Å |
| 86 | K | 88.4 | Confident | 80.5 | Confident | 102 Ų | 102 | 63.2 Ų | 63.2 | 44% | 0.443 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -65.2 | -36.6 | 176.1 | -169.1 | 176.8 | 179.9 | -177.6 | 0 | 111.7 | I6 S82 L83 A84 T89 A90 | I6-K86 HydrophobicContact CG2-CD 4.12Å; I6-K86 HydrophobicContact CG2-CG 4.35Å; S82-K86 WeakPolarHBondContact O-CB 3.41Å; S82-K86 PolarHBondContact O-N 2.87Å; L83-K86 CarbonylContact O-C 3.52Å; L83-K86 WeakPolarHBondContact O-CB 3.41Å; L83-K86 PolarHBondContact O-N 2.9Å; L83-K86 VanDerWaalsContact O-N 3.09Å; A84-K86 PolarHBondContact O-N 3.07Å; K86-T89 PolarHBondContact O-OG1 3.43Å; K86-A90 WeakPolarHBondContact O-CB 3.47Å; K86-A90 PolarHBondContact O-N 2.92Å |
| 87 | L | 88.3 | Confident | 78 | Confident | 3 Ų | 3 | 68.8 Ų | 68.8 | 2% | 0.016 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -70.1 | -41 | 175.2 | -68.2 | -170.5 | 0 | 0 | 0 | 112.4 | L3 I6 I7 L39 L83 A84 S85 T89 A90 R91 | L3-L87 HydrophobicContact CD1-CD2 3.76Å; L3-L87 HydrophobicContact CD2-CD1 4.15Å; L3-L87 HydrophobicContact CD2-CD2 4.38Å; L3-L87 HydrophobicContact CG-CD1 4.22Å; L3-L87 HydrophobicContact CG-CD2 3.6Å; L3-L87 HydrophobicContact CG-CG 4.37Å; I6-L87 HydrophobicContact CB-CD2 4.09Å; I6-L87 HydrophobicContact CD1-CD2 4.48Å; I6-L87 HydrophobicContact CG2-CD2 3.8Å; I7-L87 HydrophobicContact CD1-CD1 3.86Å; I7-L87 HydrophobicContact CG1-CD1 3.86Å; I7-L87 HydrophobicContact CG1-CD2 4.22Å; L39-L87 HydrophobicContact CB-CD1 4.08Å; L39-L87 HydrophobicContact CD1-CD1 3.83Å; L83-L87 HydrophobicContact CD2-CD1 3.8Å; L83-L87 HydrophobicContact CD2-CD2 4.26Å; L83-L87 HydrophobicContact CD2-CG 3.77Å; L83-L87 WeakPolarHBondContact O-CG 3.39Å; L83-L87 PolarHBondContact O-N 2.95Å; A84-L87 PolarHBondContact O-N 2.89Å; S85-L87 VanDerWaalsContact C-N 3.34Å; L87-T89 VanDerWaalsContact C-N 3.32Å; L87-T89 PolarHBondContact O-N 3.46Å; L87-A90 PolarHBondContact O-N 3.3Å; L87-R91 WeakPolarHBondContact O-CG 3.4Å; L87-R91 PolarHBondContact O-N 3.04Å |
| 88 | A | 85.1 | Confident | 75.6 | Confident | 40 Ų | 40 | 74.5 Ų | 74.5 | 33% | 0.331 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -59.3 | -44.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | A84 S85 R91 M92 | A84-A88 PolarHBondContact O-N 3.48Å; S85-A88 PolarHBondContact O-N 3.44Å; A88-R91 PolarHBondContact O-N 3.28Å; A88-M92 WeakPolarHBondContact O-CG 3.19Å; A88-M92 PolarHBondContact O-N 2.9Å |
| 89 | T | 84.3 | Confident | 73.1 | Confident | 88 Ų | 88 | 78.7 Ų | 78.7 | 54% | 0.54 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -68.5 | -39.1 | 177 | 55.8 | 0 | 0 | 0 | 0 | 113.1 | S85 K86 L87 R91 M92 S93 | S85-T89 WeakPolarHBondContact O-CG2 3.37Å; S85-T89 PolarHBondContact O-N 3.41Å; S85-T89 VanDerWaalsContact O-N 3.1Å; S85-T89 PolarHBondContact O-OG1 2.92Å; K86-T89 PolarHBondContact O-OG1 3.43Å; L87-T89 VanDerWaalsContact C-N 3.32Å; L87-T89 PolarHBondContact O-N 3.46Å; T89-R91 VanDerWaalsContact C-N 3.35Å; T89-R91 PolarHBondContact O-N 3.5Å; T89-M92 PolarHBondContact O-N 2.95Å; T89-S93 PolarHBondContact O-N 3.37Å |
| 90 | A | 82.7 | Confident | 70.1 | Confident | 29 Ų | 29 | 85 Ų | 85 | 24% | 0.24 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -61.4 | -41.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | I6 K86 L87 M92 S93 E94 | I6-A90 HydrophobicContact CD1-CB 3.86Å; K86-A90 WeakPolarHBondContact O-CB 3.47Å; K86-A90 PolarHBondContact O-N 2.92Å; L87-A90 PolarHBondContact O-N 3.3Å; A90-M92 PolarHBondContact O-N 2.62Å; A90-S93 PolarHBondContact O-N 3.46Å; A90-E94 PolarHBondContact O-N 3.5Å; A90-E94 VanDerWaalsContact O-N 3.15Å |
| 91 | R | 76.7 | Confident | 67.2 | Low | 80 Ų | 80 | 88.5 Ų | 88.5 | 30% | 0.302 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.8 | -37.4 | 175.8 | -70.9 | 176.8 | -178.3 | 152.9 | 4.4 | 112.9 | L3 E40 L87 A88 T89 S93 E94 N95 | L3-R91 HydrophobicContact CD1-CG 4.15Å; E40-R91 VanDerWaalsContact CD-NH2 3.3Å; E40-R91 IonicContact OE1-CZ 3.78Å; E40-R91 IonicContact OE1-NH2 3.78Å; E40-R91 PolarHBondContact OE1-NH2 3.05Å; L87-R91 WeakPolarHBondContact O-CG 3.4Å; L87-R91 PolarHBondContact O-N 3.04Å; A88-R91 PolarHBondContact O-N 3.28Å; T89-R91 VanDerWaalsContact C-N 3.35Å; T89-R91 PolarHBondContact O-N 3.5Å; R91-S93 VanDerWaalsContact C-N 3.35Å; R91-E94 PolarHBondContact O-N 3.15Å; R91-N95 PolarHBondContact O-N 3.11Å |
| 92 | M | 66.6 | Low | 64.5 | Low | 138 Ų | 138 | 89.5 Ų | 89.5 | 68% | 0.68 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -67.8 | -35.7 | 175.9 | -68.9 | 179.8 | 72.8 | 0 | 0 | 112.2 | A88 T89 A90 N95 S96 | A88-M92 WeakPolarHBondContact O-CG 3.19Å; A88-M92 PolarHBondContact O-N 2.9Å; T89-M92 PolarHBondContact O-N 2.95Å; A90-M92 PolarHBondContact O-N 2.62Å; M92-N95 PolarHBondContact O-N 3.38Å; M92-S96 WeakPolarHBondContact O-CB 3.43Å; M92-S96 PolarHBondContact O-N 3.07Å |
| 93 | S | 61.5 | Low | 61.9 | Low | 74 Ų | 74 | 94.9 Ų | 94.9 | 52% | 0.517 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -68.7 | -32.8 | 176.2 | -172.2 | 0 | 0 | 0 | 0 | 112.9 | T89 A90 R91 N95 S96 | T89-S93 PolarHBondContact O-N 3.37Å; A90-S93 PolarHBondContact O-N 3.46Å; R91-S93 VanDerWaalsContact C-N 3.35Å; S93-N95 VanDerWaalsContact C-N 3.35Å; S93-S96 PolarHBondContact O-N 2.87Å; S93-S96 PolarHBondContact O-OG 3.38Å |
| 94 | E | 54.8 | Low | 59.3 | Low | 143 Ų | 143 | 103.1 Ų | 103.1 | 67% | 0.668 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -69.2 | -36.3 | 173.8 | -137.8 | -175.7 | 143.3 | 0 | 0 | 110.9 | A90 R91 | A90-E94 PolarHBondContact O-N 3.5Å; A90-E94 VanDerWaalsContact O-N 3.15Å; R91-E94 PolarHBondContact O-N 3.15Å |
| 95 | N | 49.7 | Very low | 56.6 | Low | 133 Ų | 133 | 109 Ų | 109 | 71% | 0.711 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -76.3 | -16.7 | 175 | -80.9 | -20.1 | 0 | 0 | 0 | 114.4 | R91 M92 S93 | R91-N95 PolarHBondContact O-N 3.11Å; M92-N95 PolarHBondContact O-N 3.38Å; S93-N95 VanDerWaalsContact C-N 3.35Å |
| 96 | S | 42.6 | Very low | 53.8 | Low | 72 Ų | 72 | 110.4 Ų | 110.4 | 50% | 0.503 | 62% | 0.619 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -90 | -5.3 | -177 | 73.8 | 0 | 0 | 0 | 0 | 115.1 | M92 S93 L98 | M92-S96 WeakPolarHBondContact O-CB 3.43Å; M92-S96 PolarHBondContact O-N 3.07Å; S93-S96 PolarHBondContact O-N 2.87Å; S93-S96 PolarHBondContact O-OG 3.38Å; S96-L98 PolarHBondContact O-N 2.8Å |
| 97 | V | 40.3 | Very low | 51.4 | Low | 120 Ų | 120 | 113.2 Ų | 113.2 | 73% | 0.727 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.6 | -9.9 | 174 | 178.1 | 0 | 0 | 0 | 0 | 112 | ||
| 98 | L | 40.8 | Very low | 48.8 | Very low | 149 Ų | 149 | 122.4 Ų | 122.4 | 78% | 0.78 | 68% | 0.678 | S | S | * | * | S | Bend | trans | -122.1 | 71.2 | 169.4 | -71.9 | 167.9 | 0 | 0 | 0 | 110 | S96 | S96-L98 PolarHBondContact O-N 2.8Š|
| 99 | K | 38.8 | Very low | 46.3 | Very low | 199 Ų | 199 | 127.7 Ų | 127.7 | 87% | 0.865 | 70% | 0.7 | S | S | * | * | trans | 172.9 | 79.6 | 150.1 | -91.5 | 152 | -159.5 | -171.7 | 0 | 110.4 | ||||
| 100 | T | 31 | Very low | 43.7 | Very low | 149 Ų | 149 | 130.1 Ų | 130.1 | 91% | 0.914 | 71% | 0.709 | S | S | * | * | trans | -100.3 | 110.1 | 155.5 | -32.9 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 101 | G | 30 | Very low | 41.3 | Very low | 73 Ų | 73 | 132.5 Ų | 132.5 | 75% | 0.753 | 73% | 0.729 | S | S | * | * | trans | 167.3 | 77.6 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 102 | T | 33.2 | Very low | 39.3 | Very low | 130 Ų | 130 | 136.6 Ų | 136.6 | 80% | 0.798 | 76% | 0.756 | S | S | * | * | trans | -12.9 | 127.7 | 158.4 | -27.3 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 103 | E | 34.6 | Very low | 37.5 | Very low | 186 Ų | 186 | 135.1 Ų | 135.1 | 87% | 0.869 | 76% | 0.755 | S | S | * | * | 160.5 | 153.5 | 112.8 | -83.9 | -174.1 | -174.2 | 0 | 0 | 111.8 | |||||
| 104 | E | 36.9 | Very low | 36 | Very low | 176 Ų | 176 | 136.7 Ų | 136.7 | 82% | 0.822 | 77% | 0.766 | S | S | * | * | trans | -74 | 165 | -166.8 | -60 | -161.3 | 145.3 | 0 | 0 | 115.7 | ||||
| 105 | V | 34.2 | Very low | 34.8 | Very low | 128 Ų | 128 | 137.1 Ų | 137.1 | 78% | 0.776 | 77% | 0.768 | S | S | * | * | trans | 79.8 | 134.8 | 149.8 | 171.9 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 106 | S | 28.8 | Very low | 34.3 | Very low | 107 Ų | 107 | 136 Ų | 136 | 75% | 0.748 | 77% | 0.769 | S | S | * | * | trans | 105.7 | 106.4 | 151.9 | -108 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 107 | L | 39.2 | Very low | 33.7 | Very low | 160 Ų | 160 | 140 Ų | 140 | 84% | 0.838 | 78% | 0.779 | S | S | * | * | trans | -9.8 | 126.4 | 143.5 | -55.4 | 165.6 | 0 | 0 | 0 | 116.1 | ||||
| 108 | K | 34.1 | Very low | 33.6 | Very low | 197 Ų | 197 | 139.9 Ų | 139.9 | 86% | 0.857 | 78% | 0.781 | S | S | * | * | 149.8 | 119 | 126.7 | -83.3 | 178.8 | 179.9 | -175.3 | 0 | 113.3 | |||||
| 109 | L | 31.7 | Very low | 32.8 | Very low | 151 Ų | 151 | 136 Ų | 136 | 79% | 0.791 | 78% | 0.777 | S | S | * | * | 51 | 121.8 | 123.8 | -140.4 | 127.8 | 0 | 0 | 0 | 121.1 | |||||
| 110 | N | 30.7 | Very low | 32.3 | Very low | 138 Ų | 138 | 136.3 Ų | 136.3 | 74% | 0.738 | 78% | 0.782 | S | S | * | * | trans | 77.4 | 115.1 | 146 | -72.3 | 15.1 | 0 | 0 | 0 | 123.8 | ||||
| 111 | A | 31.1 | Very low | 32.3 | Very low | 80 Ų | 80 | 136.5 Ų | 136.5 | 66% | 0.661 | 77% | 0.772 | S | S | * | * | 84.7 | 125.6 | 113.5 | 0 | 0 | 0 | 0 | 0 | 123.1 | |||||
| 112 | L | 34.2 | Very low | 32.7 | Very low | 165 Ų | 165 | 139 Ų | 139 | 86% | 0.864 | 78% | 0.775 | S | S | * | * | trans | 74 | 144.4 | 148.5 | -61.2 | 153.6 | 0 | 0 | 0 | 117.5 | ||||
| 113 | T | 30.6 | Very low | 32.7 | Very low | 108 Ų | 108 | 138 Ų | 138 | 66% | 0.663 | 77% | 0.765 | S | S | * | * | cis | -178.6 | 156.9 | -2.6 | -88.8 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 114 | S | 28.2 | Very low | 32.3 | Very low | 107 Ų | 107 | 135.4 Ų | 135.4 | 75% | 0.748 | 77% | 0.765 | S | S | * | * | trans | 135.8 | 105.4 | 142.2 | 61.2 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 115 | Q | 30.9 | Very low | 32 | Very low | 152 Ų | 152 | 133.8 Ų | 133.8 | 71% | 0.71 | 76% | 0.762 | S | S | * | * | 78.4 | 153.3 | 82.8 | -78.8 | -79.6 | -31.1 | 0 | 0 | 114.1 | |||||
| 116 | P | 39.1 | Very low | 32.5 | Very low | 110 Ų | 110 | 136.3 Ų | 136.3 | 71% | 0.714 | 76% | 0.762 | S | S | * | * | cis | -147.7 | 160.1 | 20.5 | 35.3 | -10.4 | 0 | 0 | 0 | 122.5 | ||||
| 117 | E | 29.1 | Very low | 33 | Very low | 154 Ų | 154 | 137.5 Ų | 137.5 | 72% | 0.72 | 77% | 0.767 | S | S | * | * | trans | 63.7 | 164.1 | 135 | -66.5 | -72.8 | 139.1 | 0 | 0 | 124.7 | ||||
| 118 | P | 37.8 | Very low | 32.9 | Very low | 118 Ų | 118 | 138 Ų | 138 | 77% | 0.766 | 77% | 0.765 | S | S | * | * | cis | -137.8 | 166.7 | -7.1 | 34 | -13.5 | 0 | 0 | 0 | 117.7 | ||||
| 119 | G | 24.4 | Very low | 32.7 | Very low | 69 Ų | 69 | 135.8 Ų | 135.8 | 71% | 0.711 | 77% | 0.769 | S | S | * | * | trans | 149.7 | 96.6 | 140.4 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 120 | Q | 28.9 | Very low | 33.2 | Very low | 205 Ų | 205 | 138.2 Ų | 138.2 | 96% | 0.958 | 78% | 0.776 | S | S | * | * | trans | 98.5 | 112.2 | 148.9 | -56.5 | -170.4 | -4.4 | 0 | 0 | 120.5 | ||||
| 121 | E | 31.2 | Very low | 33.3 | Very low | 153 Ų | 153 | 135.2 Ų | 135.2 | 72% | 0.715 | 78% | 0.777 | S | S | * | * | trans | -92 | 169 | 172.8 | -121.6 | -166.4 | 172.1 | 0 | 0 | 110.7 | ||||
| 122 | P | 38.8 | Very low | 34 | Very low | 124 Ų | 124 | 136.7 Ų | 136.7 | 81% | 0.805 | 79% | 0.789 | S | S | * | * | -142.8 | 131.3 | 61.7 | 33.7 | -11.7 | 0 | 0 | 0 | 118 | |||||
| 123 | L | 31.8 | Very low | 34.2 | Very low | 111 Ų | 111 | 134.9 Ų | 134.9 | 58% | 0.581 | 79% | 0.786 | S | S | * | * | trans | 10.4 | 134.1 | 134.7 | -153 | 85.3 | 0 | 0 | 0 | 121.1 | L125 | L123-L125 HydrophobicContact CD2-CD1 4.45Å; L123-L125 HydrophobicContact CD2-CD2 4.15Å; L123-L125 HydrophobicContact CD2-CG 4.09Å; L123-L125 HydrophobicContact CG-CD2 4.46Å; L123-L125 HydrophobicContact CG-CG 4.44Å | ||
| 124 | C | 25.9 | Very low | 34.8 | Very low | 131 Ų | 131 | 134.4 Ų | 134.4 | 89% | 0.885 | 79% | 0.793 | S | S | * | * | -151 | 147.5 | 128.2 | -159.4 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 125 | L | 32.4 | Very low | 35.6 | Very low | 142 Ų | 142 | 138.3 Ų | 138.3 | 74% | 0.743 | 80% | 0.796 | S | S | * | * | trans | -85.9 | 161.1 | -154.5 | -63.6 | 158.1 | 0 | 0 | 0 | 115.5 | L123 | L123-L125 HydrophobicContact CD2-CD1 4.45Å; L123-L125 HydrophobicContact CD2-CD2 4.15Å; L123-L125 HydrophobicContact CD2-CG 4.09Å; L123-L125 HydrophobicContact CG-CD2 4.46Å; L123-L125 HydrophobicContact CG-CG 4.44Å | ||
| 126 | K | 43.2 | Very low | 36.2 | Very low | 180 Ų | 180 | 137.6 Ų | 137.6 | 78% | 0.783 | 80% | 0.796 | S | S | * | * | trans | -63.6 | 174.1 | 177.9 | -53.7 | 173.9 | 176.4 | 172.7 | 0 | 113.6 | ||||
| 127 | P | 39.1 | Very low | 36.7 | Very low | 132 Ų | 132 | 134.6 Ų | 134.6 | 86% | 0.857 | 78% | 0.778 | S | S | * | * | -138.4 | 159.5 | 86.6 | 30.3 | -11.8 | 0 | 0 | 0 | 116 | |||||
| 128 | Q | 37.3 | Very low | 38 | Very low | 170 Ų | 170 | 130 Ų | 130 | 79% | 0.794 | 77% | 0.766 | S | S | * | * | trans | -71 | 148.6 | -175.4 | -60.4 | 164.3 | -87.5 | 0 | 0 | 113.3 | ||||
| 129 | T | 29.7 | Very low | 39.2 | Very low | 152 Ų | 152 | 128.1 Ų | 128.1 | 93% | 0.933 | 76% | 0.756 | S | S | * | * | trans | -145.6 | 147.3 | 139.8 | 14.9 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 130 | E | 43 | Very low | 41.7 | Very low | 202 Ų | 202 | 129.6 Ų | 129.6 | 94% | 0.944 | 74% | 0.744 | S | S | * | * | trans | -84.5 | 141.9 | -155.7 | -174.9 | -179.5 | -177 | 0 | 0 | 113.1 | ||||
| 131 | G | 32.6 | Very low | 44.1 | Very low | 74 Ų | 74 | 124 Ų | 124 | 76% | 0.763 | 71% | 0.714 | S | S | * | * | trans | 165 | 109.3 | 174 | 0 | 0 | 0 | 0 | 0 | 112.5 | T133 | G131-T133 PolarHBondContact O-N 3.43Š| ||
| 132 | A | 45.7 | Very low | 46.7 | Very low | 111 Ų | 111 | 122.5 Ų | 122.5 | 92% | 0.917 | 71% | 0.708 | S | S | * | * | trans | -66.1 | 116.8 | -173.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 133 | T | 38.8 | Very low | 49.2 | Very low | 128 Ų | 128 | 123.4 Ų | 123.4 | 79% | 0.785 | 70% | 0.699 | S | S | * | * | trans | -158.4 | 139.1 | 148.2 | -117.4 | 0 | 0 | 0 | 0 | 106.7 | G131 K135 | G131-T133 PolarHBondContact O-N 3.43Å; T133-K135 PolarHBondContact O-N 2.57Å | ||
| 134 | A | 42.8 | Very low | 52 | Low | 98 Ų | 98 | 120 Ų | 120 | 81% | 0.81 | 68% | 0.68 | S | S | * | * | trans | -57.4 | 103.2 | -177.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | L136 | A134-L136 VanDerWaalsContact C-N 3.3Å; A134-L136 PolarHBondContact O-N 3.08Å | ||
| 135 | K | 45.7 | Very low | 55.2 | Low | 189 Ų | 189 | 114.9 Ų | 114.9 | 82% | 0.822 | 64% | 0.643 | S | S | * | * | trans | -69.7 | 89.3 | 166.1 | -93.6 | -173.9 | 171 | -175.3 | 0 | 107.7 | T133 | T133-K135 PolarHBondContact O-N 2.57Š| ||
| 136 | L | 43.5 | Very low | 58.1 | Low | 137 Ų | 137 | 113.7 Ų | 113.7 | 72% | 0.717 | 63% | 0.634 | S | S | * | * | trans | -55.8 | 131.9 | 141.5 | -73.6 | 169.7 | 0 | 0 | 0 | 106 | A134 A138 | A134-L136 VanDerWaalsContact C-N 3.3Å; A134-L136 PolarHBondContact O-N 3.08Å; L136-A138 PolarHBondContact O-N 3.15Å | ||
| 137 | S | 48.4 | Very low | 60.5 | Low | 46 Ų | 46 | 108 Ų | 108 | 32% | 0.322 | 61% | 0.61 | S | S | . | * | trans | -64.9 | 129.7 | -153.8 | 65.8 | 0 | 0 | 0 | 0 | 109.7 | S139 E140 | S137-S139 PolarHBondContact O-N 3.31Å; S137-E140 PolarHBondContact N-OE2 3.43Å; S137-E140 PolarHBondContact O-N 3.4Å; S137-E140 WeakPolarHBondContact OG-CG 3.37Å; S137-E140 PolarHBondContact OG-N 3.31Å; S137-E140 PolarHBondContact OG-OE2 3.24Å | ||
| 138 | A | 56.8 | Low | 63.2 | Low | 57 Ų | 57 | 101.7 Ų | 101.7 | 47% | 0.471 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -53.5 | -23 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112 | L136 E142 | L136-A138 PolarHBondContact O-N 3.15Å; A138-E142 WeakPolarHBondContact O-CG 3.48Å; A138-E142 PolarHBondContact O-N 3.2Å |
| 139 | S | 64.1 | Low | 65.9 | Low | 80 Ų | 80 | 96.3 Ų | 96.3 | 56% | 0.559 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -66.4 | -32.1 | 174.6 | -169.9 | 0 | 0 | 0 | 0 | 114.5 | S137 F143 | S137-S139 PolarHBondContact O-N 3.31Å; S139-F143 PolarHBondContact O-N 3.1Å |
| 140 | E | 76.4 | Confident | 69 | Low | 100 Ų | 100 | 94.9 Ų | 94.9 | 47% | 0.467 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -68.5 | -40.5 | 178.4 | -80.8 | 154.6 | 149.7 | 0 | 0 | 110.6 | S137 F143 Q144 | S137-E140 PolarHBondContact N-OE2 3.43Å; S137-E140 PolarHBondContact O-N 3.4Å; S137-E140 WeakPolarHBondContact OG-CG 3.37Å; S137-E140 PolarHBondContact OG-N 3.31Å; S137-E140 PolarHBondContact OG-OE2 3.24Å; E140-F143 PolarHBondContact O-N 3.22Å; E140-Q144 VanDerWaalsContact O-CG 3.29Å; E140-Q144 WeakPolarHBondContact O-CG 3.26Å; E140-Q144 PolarHBondContact O-N 3.35Å |
| 141 | W | 78.5 | Confident | 71.4 | Confident | 87 Ų | 87 | 89.5 Ų | 89.5 | 33% | 0.33 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.6 | -40.1 | 177.7 | -72.3 | 68.5 | 0 | 0 | 0 | 111.6 | F143 Q144 E145 L164 | W141-F143 PolarHBondContact O-N 3.06Å; W141-Q144 PolarHBondContact O-N 3.27Å; W141-E145 WeakPolarHBondContact O-CB 3.26Å; W141-E145 VanDerWaalsContact O-CG 3.24Å; W141-E145 WeakPolarHBondContact O-CG 3.38Å; W141-E145 PolarHBondContact O-N 3.09Å; W141-L164 HydrophobicContact CE3-CB 4.26Å; W141-L164 HydrophobicContact CZ3-CB 4.09Å |
| 142 | E | 86.9 | Confident | 74.3 | Confident | 122 Ų | 122 | 88 Ų | 88 | 57% | 0.57 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -64.6 | -38.6 | 177.1 | -71.5 | 170.3 | 178.5 | 0 | 0 | 112.1 | A138 E145 Q146 | A138-E142 WeakPolarHBondContact O-CG 3.48Å; A138-E142 PolarHBondContact O-N 3.2Å; E142-E145 PolarHBondContact O-N 3.08Å; E142-Q146 WeakPolarHBondContact O-CB 3.38Å; E142-Q146 PolarHBondContact O-N 3.28Å |
| 143 | F | 90 | Very high | 76.4 | Confident | 142 Ų | 142 | 88.4 Ų | 88.4 | 62% | 0.623 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -66.4 | -43.6 | 174.7 | -178 | -97 | 0 | 0 | 0 | 111.8 | S139 E140 W141 Q146 H147 | S139-F143 PolarHBondContact O-N 3.1Å; E140-F143 PolarHBondContact O-N 3.22Å; W141-F143 PolarHBondContact O-N 3.06Å; F143-Q146 PolarHBondContact O-N 3.04Å; F143-H147 WeakPolarHBondContact O-CB 3.43Å; F143-H147 PolarHBondContact O-N 2.86Å |
| 144 | Q | 91.9 | Very high | 78.7 | Confident | 41 Ų | 41 | 92.3 Ų | 92.3 | 19% | 0.192 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -64.1 | -40.5 | 175.7 | -68.4 | 178.6 | -40.2 | 0 | 0 | 111.8 | E140 W141 H147 L148 L164 G169 M171 | E140-Q144 VanDerWaalsContact O-CG 3.29Å; E140-Q144 WeakPolarHBondContact O-CG 3.26Å; E140-Q144 PolarHBondContact O-N 3.35Å; W141-Q144 PolarHBondContact O-N 3.27Å; Q144-H147 PolarHBondContact O-N 3.01Å; Q144-L148 WeakPolarHBondContact O-CG 3.39Å; Q144-L148 PolarHBondContact O-N 3.11Å; Q144-L148 VanDerWaalsContact O-N 3.08Å; Q144-L164 HydrophobicContact CB-CD1 3.78Å; Q144-L164 HydrophobicContact CB-CD2 3.96Å; Q144-G169 PolarHBondContact NE2-O 3.44Å; Q144-M171 HydrophobicContact CB-CE 4.12Å; Q144-M171 HydrophobicContact CG-CE 3.85Å |
| 145 | E | 92.5 | Very high | 80.9 | Confident | 23 Ų | 23 | 88.4 Ų | 88.4 | 11% | 0.107 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -60.4 | -45.3 | 174.5 | -78.1 | 176.5 | -169.3 | 0 | 0 | 111 | W141 E142 L148 L149 R161 L164 | W141-E145 WeakPolarHBondContact O-CB 3.26Å; W141-E145 VanDerWaalsContact O-CG 3.24Å; W141-E145 WeakPolarHBondContact O-CG 3.38Å; W141-E145 PolarHBondContact O-N 3.09Å; E142-E145 PolarHBondContact O-N 3.08Å; E145-L148 PolarHBondContact O-N 2.94Å; E145-L149 WeakPolarHBondContact O-CG 3.25Å; E145-L149 PolarHBondContact O-N 3.17Å; E145-L149 VanDerWaalsContact O-N 3.17Å; E145-R161 HydrophobicContact CG-CB 4.31Å; E145-R161 WeakPolarHBondContact OE1-CB 3.44Å; E145-R161 VanDerWaalsContact OE1-CD 3.28Å; E145-R161 WeakPolarHBondContact OE1-CD 2.95Å; E145-R161 WeakPolarHBondContact OE1-CG 3.44Å; E145-R161 IonicContact OE1-NE 2.86Å; E145-L164 HydrophobicContact CB-CD1 4.2Å; E145-L164 HydrophobicContact CG-CD1 3.51Å |
| 146 | Q | 93.6 | Very high | 83.1 | Confident | 117 Ų | 117 | 81.5 Ų | 81.5 | 55% | 0.547 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -65 | -41.6 | 178.2 | -173.1 | 168.8 | -19.3 | 0 | 0 | 111.9 | E142 F143 L148 L149 E150 | E142-Q146 WeakPolarHBondContact O-CB 3.38Å; E142-Q146 PolarHBondContact O-N 3.28Å; F143-Q146 PolarHBondContact O-N 3.04Å; Q146-L148 VanDerWaalsContact C-N 3.33Å; Q146-L148 PolarHBondContact O-N 3.03Å; Q146-L149 WeakPolarHBondContact O-CB 3.26Å; Q146-L149 PolarHBondContact O-N 3.44Å; Q146-L149 VanDerWaalsContact O-N 3.11Å; Q146-E150 WeakPolarHBondContact O-CG 3.48Å; Q146-E150 PolarHBondContact O-N 2.86Å |
| 147 | H | 94 | Very high | 85.4 | Confident | 59 Ų | 59 | 79.8 Ų | 79.8 | 27% | 0.273 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -61.6 | -40 | 177 | -168 | 68.1 | 0 | 0 | 0 | 112.4 | F143 Q144 L149 E150 M151 M171 | F143-H147 WeakPolarHBondContact O-CB 3.43Å; F143-H147 PolarHBondContact O-N 2.86Å; Q144-H147 PolarHBondContact O-N 3.01Å; H147-L149 VanDerWaalsContact C-N 3.32Å; H147-L149 PolarHBondContact O-N 3.41Å; H147-E150 PolarHBondContact O-N 2.95Å; H147-M151 WeakPolarHBondContact O-CG 2.97Å; H147-M151 PolarHBondContact O-N 3.5Å; H147-M171 HydrophobicContact CB-CE 4.09Å; H147-M171 PolarHBondContact CD2-SD 3.24Å |
| 148 | L | 94.2 | Very high | 87.4 | Confident | 0 Ų | 0 | 81.5 Ų | 81.5 | 0% | 0 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -64.9 | -34.8 | 174.3 | -71.5 | 176.3 | 0 | 0 | 0 | 112.8 | Q144 E145 Q146 E150 M151 F152 A160 L164 A174 V175 I178 | Q144-L148 WeakPolarHBondContact O-CG 3.39Å; Q144-L148 PolarHBondContact O-N 3.11Å; Q144-L148 VanDerWaalsContact O-N 3.08Å; E145-L148 PolarHBondContact O-N 2.94Å; Q146-L148 VanDerWaalsContact C-N 3.33Å; Q146-L148 PolarHBondContact O-N 3.03Å; L148-E150 VanDerWaalsContact C-N 3.34Å; L148-M151 PolarHBondContact O-N 3.06Å; L148-F152 HydrophobicContact CD2-CE2 4.29Å; L148-F152 WeakPolarHBondContact O-CB 3.39Å; L148-F152 WeakPolarHBondContact O-CD2 3.45Å; L148-F152 PolarHBondContact O-N 3.32Å; L148-A160 HydrophobicContact CB-CB 3.93Å; L148-A160 HydrophobicContact CD1-CB 4.18Å; L148-L164 HydrophobicContact CD1-CD1 3.74Å; L148-L164 HydrophobicContact CD1-CD2 3.91Å; L148-L164 HydrophobicContact CD1-CG 3.53Å; L148-A174 HydrophobicContact CD1-CB 4Å; L148-V175 HydrophobicContact CD2-CG2 3.56Å; L148-I178 HydrophobicContact CB-CD1 4.4Å; L148-I178 HydrophobicContact CD1-CD1 3.99Å; L148-I178 HydrophobicContact CD2-CD1 4.02Å; L148-I178 HydrophobicContact CG-CD1 4.38Å |
| 149 | L | 94.2 | Very high | 89 | Confident | 57 Ų | 57 | 82.2 Ų | 82.2 | 30% | 0.298 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -70.3 | -31 | 175.6 | -69.8 | 169.5 | 0 | 0 | 0 | 112.5 | E145 Q146 H147 F152 C155 L157 A160 | E145-L149 WeakPolarHBondContact O-CG 3.25Å; E145-L149 PolarHBondContact O-N 3.17Å; E145-L149 VanDerWaalsContact O-N 3.17Å; Q146-L149 WeakPolarHBondContact O-CB 3.26Å; Q146-L149 PolarHBondContact O-N 3.44Å; Q146-L149 VanDerWaalsContact O-N 3.11Å; H147-L149 VanDerWaalsContact C-N 3.32Å; H147-L149 PolarHBondContact O-N 3.41Å; L149-F152 CarbonylContact O-C 3.56Å; L149-C155 VanDerWaalsContact CD2-O 3.23Å; L149-C155 WeakPolarHBondContact CD2-O 3.23Å; L149-L157 HydrophobicContact CD1-CB 4.29Å; L149-L157 HydrophobicContact CD1-CD1 4.45Å; L149-L157 HydrophobicContact CD1-CG 4.43Å; L149-A160 HydrophobicContact CG-CB 4.45Å |
| 150 | E | 95 | Very high | 90.4 | Very high | 122 Ų | 122 | 78.4 Ų | 78.4 | 57% | 0.57 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -68.7 | -43.7 | 173.4 | -71.4 | 172 | -174.5 | 0 | 0 | 111.4 | Q146 H147 L148 | Q146-E150 WeakPolarHBondContact O-CG 3.48Å; Q146-E150 PolarHBondContact O-N 2.86Å; H147-E150 PolarHBondContact O-N 2.95Å; L148-E150 VanDerWaalsContact C-N 3.34Å |
| 151 | M | 93.9 | Very high | 91.1 | Very high | 90 Ų | 90 | 81 Ų | 81 | 44% | 0.443 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -72 | -32.5 | 178.1 | -63.7 | -142.8 | -60.6 | 0 | 0 | 113.3 | H147 L148 P153 V175 | H147-M151 WeakPolarHBondContact O-CG 2.97Å; H147-M151 PolarHBondContact O-N 3.5Å; L148-M151 PolarHBondContact O-N 3.06Å; M151-P153 WeakPolarHBondContact O-CD 3.29Å; M151-V175 HydrophobicContact CE-CB 4.45Å; M151-V175 HydrophobicContact CE-CG1 4.27Å; M151-V175 HydrophobicContact CE-CG2 3.28Å |
| 152 | F | 93.3 | Very high | 91.8 | Very high | 42 Ų | 42 | 78.4 Ų | 78.4 | 18% | 0.184 | 39% | 0.389 | C | S | . | . | trans | -122.3 | 85.7 | -177.7 | -59.3 | -77.7 | 0 | 0 | 0 | 111.9 | L148 L149 K154 C155 V175 I178 I179 | L148-F152 HydrophobicContact CD2-CE2 4.29Å; L148-F152 WeakPolarHBondContact O-CB 3.39Å; L148-F152 WeakPolarHBondContact O-CD2 3.45Å; L148-F152 PolarHBondContact O-N 3.32Å; L149-F152 CarbonylContact O-C 3.56Å; F152-K154 PolarHBondContact O-N 3.01Å; F152-C155 HydrophobicContact CB-CB 3.39Å; F152-C155 HydrophobicContact CG-CB 4.38Å; F152-C155 VanDerWaalsContact O-CB 3.27Å; F152-C155 WeakPolarHBondContact O-CB 3.38Å; F152-C155 PolarHBondContact O-N 3.24Å; F152-V175 HydrophobicContact CE2-CB 4.38Å; F152-V175 HydrophobicContact CE2-CG1 4.16Å; F152-V175 HydrophobicContact CE2-CG2 4.17Å; F152-V175 HydrophobicContact CZ-CB 4.49Å; F152-V175 HydrophobicContact CZ-CG1 3.86Å; F152-I178 HydrophobicContact CB-CG2 4.42Å; F152-I178 HydrophobicContact CD1-CG2 3.9Å; F152-I178 HydrophobicContact CD2-CB 4.47Å; F152-I178 HydrophobicContact CD2-CD1 4.18Å; F152-I178 HydrophobicContact CD2-CG2 3.85Å; F152-I178 HydrophobicContact CE1-CG2 4.04Å; F152-I178 HydrophobicContact CE2-CB 4.22Å; F152-I178 HydrophobicContact CE2-CD1 4.25Å; F152-I178 HydrophobicContact CE2-CG2 3.98Å; F152-I178 HydrophobicContact CG-CG2 3.8Å; F152-I178 HydrophobicContact CZ-CB 4.35Å; F152-I178 HydrophobicContact CZ-CG2 4.06Å; F152-I179 HydrophobicContact CE1-CD1 4.28Å; F152-I179 HydrophobicContact CE1-CG1 3.64Å; F152-I179 HydrophobicContact CZ-CD1 4.03Å; F152-I179 HydrophobicContact CZ-CG1 3.68Å | ||
| 153 | P | 90.9 | Very high | 92.1 | Very high | 119 Ų | 119 | 72.6 Ų | 72.6 | 77% | 0.773 | 36% | 0.361 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.6 | -16.6 | -179.8 | -25.2 | 33.5 | 0 | 0 | 0 | 115 | M151 | M151-P153 WeakPolarHBondContact O-CD 3.29Š|
| 154 | K | 86.9 | Confident | 92.2 | Very high | 210 Ų | 210 | 65.8 Ų | 65.8 | 91% | 0.913 | 33% | 0.332 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.4 | -12.8 | 176.3 | -62.8 | -178.6 | -177.4 | 174.3 | 0 | 113.3 | F152 | F152-K154 PolarHBondContact O-N 3.01Š|
| 155 | C | 88.9 | Confident | 92.2 | Very high | 16 Ų | 16 | 67.6 Ų | 67.6 | 11% | 0.108 | 35% | 0.349 | C | S | . | . | trans | -75.6 | 134.5 | 177.6 | -176 | 0 | 0 | 0 | 0 | 109.2 | L149 F152 I178 | L149-C155 VanDerWaalsContact CD2-O 3.23Å; L149-C155 WeakPolarHBondContact CD2-O 3.23Å; F152-C155 HydrophobicContact CB-CB 3.39Å; F152-C155 HydrophobicContact CG-CB 4.38Å; F152-C155 VanDerWaalsContact O-CB 3.27Å; F152-C155 WeakPolarHBondContact O-CB 3.38Å; F152-C155 PolarHBondContact O-N 3.24Å; C155-I178 HydrophobicContact CB-CG2 4.43Å | ||
| 156 | S | 90.6 | Very high | 92.2 | Very high | 44 Ų | 44 | 69.8 Ų | 69.8 | 31% | 0.308 | 36% | 0.36 | S | S | . | . | trans | -84 | 155.7 | 174 | 64.7 | 0 | 0 | 0 | 0 | 111.4 | S158 E159 A160 | S156-S158 PolarHBondContact O-N 3.15Å; S156-S158 VanDerWaalsContact O-N 3.16Å; S156-S158 PolarHBondContact OG-OG 2.71Å; S156-E159 WeakPolarHBondContact CB-OE2 3.42Å; S156-E159 PolarHBondContact N-OE2 3.2Å; S156-E159 PolarHBondContact O-N 3.37Å; S156-E159 VanDerWaalsContact OG-CG 3.27Å; S156-E159 WeakPolarHBondContact OG-CG 3.48Å; S156-E159 PolarHBondContact OG-N 3.14Å; S156-E159 PolarHBondContact OG-OE2 3.43Å; S156-A160 PolarHBondContact O-N 3.32Å | ||
| 157 | L | 91.7 | Very high | 92.1 | Very high | 102 Ų | 102 | 65 Ų | 65 | 53% | 0.534 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -54.9 | -36.9 | 176.5 | -174.6 | 151.3 | 0 | 0 | 0 | 112.1 | L149 R161 | L149-L157 HydrophobicContact CD1-CB 4.29Å; L149-L157 HydrophobicContact CD1-CD1 4.45Å; L149-L157 HydrophobicContact CD1-CG 4.43Å; L157-R161 VanDerWaalsContact O-CB 3.3Å; L157-R161 WeakPolarHBondContact O-CB 3.48Å; L157-R161 PolarHBondContact O-N 3.44Å |
| 158 | S | 90.1 | Very high | 91.9 | Very high | 81 Ų | 81 | 70.8 Ų | 70.8 | 57% | 0.566 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -65.5 | -35.8 | 175.5 | 41.5 | 0 | 0 | 0 | 0 | 113.6 | S156 S162 | S156-S158 PolarHBondContact O-N 3.15Å; S156-S158 VanDerWaalsContact O-N 3.16Å; S156-S158 PolarHBondContact OG-OG 2.71Å; S158-S162 WeakPolarHBondContact O-CB 3.27Å; S158-S162 PolarHBondContact O-N 2.93Å |
| 159 | E | 91.9 | Very high | 91.5 | Very high | 73 Ų | 73 | 71.7 Ų | 71.7 | 34% | 0.341 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -73.9 | -45 | 178.3 | -75 | 161.9 | 149.4 | 0 | 0 | 110.9 | S156 R161 S162 A163 V183 | S156-E159 WeakPolarHBondContact CB-OE2 3.42Å; S156-E159 PolarHBondContact N-OE2 3.2Å; S156-E159 PolarHBondContact O-N 3.37Å; S156-E159 VanDerWaalsContact OG-CG 3.27Å; S156-E159 WeakPolarHBondContact OG-CG 3.48Å; S156-E159 PolarHBondContact OG-N 3.14Å; S156-E159 PolarHBondContact OG-OE2 3.43Å; E159-R161 VanDerWaalsContact C-N 3.33Å; E159-R161 PolarHBondContact O-N 2.82Å; E159-S162 PolarHBondContact O-N 3.35Å; E159-A163 WeakPolarHBondContact O-CB 3.37Å; E159-A163 PolarHBondContact O-N 3.45Å; E159-V183 HydrophobicContact CB-CG1 4Å; E159-V183 HydrophobicContact CG-CG1 4.18Å; E159-V183 WeakPolarHBondContact O-CG1 3.35Å |
| 160 | A | 92.3 | Very high | 91.4 | Very high | 0 Ų | 0 | 72.3 Ų | 72.3 | 0% | 0 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -56.8 | -46.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | L148 L149 S156 A163 L164 | L148-A160 HydrophobicContact CB-CB 3.93Å; L148-A160 HydrophobicContact CD1-CB 4.18Å; L149-A160 HydrophobicContact CG-CB 4.45Å; S156-A160 PolarHBondContact O-N 3.32Å; A160-A163 PolarHBondContact O-N 3.4Å; A160-L164 WeakPolarHBondContact O-CG 3.47Å; A160-L164 PolarHBondContact O-N 2.94Å |
| 161 | R | 92.8 | Very high | 91.3 | Very high | 153 Ų | 153 | 68.3 Ų | 68.3 | 58% | 0.577 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -64.9 | -40 | 176.4 | -177.8 | 166.1 | -177 | 174.3 | 5.5 | 113 | E145 L157 E159 S165 | E145-R161 HydrophobicContact CG-CB 4.31Å; E145-R161 WeakPolarHBondContact OE1-CB 3.44Å; E145-R161 VanDerWaalsContact OE1-CD 3.28Å; E145-R161 WeakPolarHBondContact OE1-CD 2.95Å; E145-R161 WeakPolarHBondContact OE1-CG 3.44Å; E145-R161 IonicContact OE1-NE 2.86Å; L157-R161 VanDerWaalsContact O-CB 3.3Å; L157-R161 WeakPolarHBondContact O-CB 3.48Å; L157-R161 PolarHBondContact O-N 3.44Å; E159-R161 VanDerWaalsContact C-N 3.33Å; E159-R161 PolarHBondContact O-N 2.82Å; R161-S165 VanDerWaalsContact O-CB 3.29Å; R161-S165 WeakPolarHBondContact O-CB 3.37Å; R161-S165 PolarHBondContact O-N 2.82Å |
| 162 | S | 92.1 | Very high | 91.3 | Very high | 33 Ų | 33 | 70.6 Ų | 70.6 | 23% | 0.231 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -63.7 | -45.6 | 175.9 | -177.1 | 0 | 0 | 0 | 0 | 110.8 | S158 E159 S165 I166 | S158-S162 WeakPolarHBondContact O-CB 3.27Å; S158-S162 PolarHBondContact O-N 2.93Å; E159-S162 PolarHBondContact O-N 3.35Å; S162-S165 WeakPolarHBondContact O-CB 3.34Å; S162-S165 PolarHBondContact O-N 2.79Å; S162-I166 VanDerWaalsContact O-CG1 3.26Å; S162-I166 WeakPolarHBondContact O-CG1 3.18Å; S162-I166 PolarHBondContact O-N 3.46Å |
| 163 | A | 93 | Very high | 91.3 | Very high | 0 Ų | 0 | 72.3 Ų | 72.3 | 0% | 0 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -59.1 | -49.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | E159 A160 S165 I166 A167 A174 I178 V183 | E159-A163 WeakPolarHBondContact O-CB 3.37Å; E159-A163 PolarHBondContact O-N 3.45Å; A160-A163 PolarHBondContact O-N 3.4Å; A163-S165 VanDerWaalsContact C-N 3.29Å; A163-S165 PolarHBondContact O-N 2.67Å; A163-I166 PolarHBondContact O-N 3.01Å; A163-A167 VanDerWaalsContact O-CB 3.25Å; A163-A167 WeakPolarHBondContact O-CB 3.3Å; A163-A167 PolarHBondContact O-N 3.37Å; A163-A174 HydrophobicContact CB-CB 3.97Å; A163-I178 HydrophobicContact CB-CD1 3.84Å; A163-I178 HydrophobicContact CB-CG1 3.72Å; A163-V183 HydrophobicContact CB-CG2 3.74Å |
| 164 | L | 93.1 | Very high | 91.5 | Very high | 0 Ų | 0 | 66.6 Ų | 66.6 | 0% | 0 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -62.5 | -36.7 | 175.7 | -73.2 | 167 | 0 | 0 | 0 | 112.4 | W141 Q144 E145 L148 A160 A167 K168 G169 A174 | W141-L164 HydrophobicContact CE3-CB 4.26Å; W141-L164 HydrophobicContact CZ3-CB 4.09Å; Q144-L164 HydrophobicContact CB-CD1 3.78Å; Q144-L164 HydrophobicContact CB-CD2 3.96Å; E145-L164 HydrophobicContact CB-CD1 4.2Å; E145-L164 HydrophobicContact CG-CD1 3.51Å; L148-L164 HydrophobicContact CD1-CD1 3.74Å; L148-L164 HydrophobicContact CD1-CD2 3.91Å; L148-L164 HydrophobicContact CD1-CG 3.53Å; A160-L164 WeakPolarHBondContact O-CG 3.47Å; A160-L164 PolarHBondContact O-N 2.94Å; L164-A167 CarbonylContact O-C 3.5Å; L164-K168 WeakPolarHBondContact O-CA 3.27Å; L164-K168 PolarHBondContact O-N 3.01Å; L164-G169 PolarHBondContact O-N 3.16Å; L164-A174 HydrophobicContact CD2-CB 3.89Å; L164-A174 HydrophobicContact CG-CB 4.24Å |
| 165 | S | 91.7 | Very high | 91.8 | Very high | 78 Ų | 78 | 58 Ų | 58 | 55% | 0.545 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -66.5 | -38.7 | 176 | -171.2 | 0 | 0 | 0 | 0 | 112.2 | R161 S162 A163 | R161-S165 VanDerWaalsContact O-CB 3.29Å; R161-S165 WeakPolarHBondContact O-CB 3.37Å; R161-S165 PolarHBondContact O-N 2.82Å; S162-S165 WeakPolarHBondContact O-CB 3.34Å; S162-S165 PolarHBondContact O-N 2.79Å; A163-S165 VanDerWaalsContact C-N 3.29Å; A163-S165 PolarHBondContact O-N 2.67Å |
| 166 | I | 91.9 | Very high | 92.1 | Very high | 69 Ų | 69 | 61.7 Ų | 61.7 | 35% | 0.354 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -71.1 | -43.8 | 177.2 | -65.4 | 163.1 | 0 | 0 | 0 | 110 | S162 A163 K168 L177 | S162-I166 VanDerWaalsContact O-CG1 3.26Å; S162-I166 WeakPolarHBondContact O-CG1 3.18Å; S162-I166 PolarHBondContact O-N 3.46Å; A163-I166 PolarHBondContact O-N 3.01Å; I166-K168 PolarHBondContact O-N 3.04Å; I166-L177 HydrophobicContact CB-CD1 3.84Å; I166-L177 HydrophobicContact CG2-CD1 3.58Å |
| 167 | A | 91.3 | Very high | 92.2 | Very high | 16 Ų | 16 | 60.2 Ų | 60.2 | 13% | 0.132 | 31% | 0.306 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -76.2 | -1.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | A163 L164 G169 D170 E173 A174 L177 | A163-A167 VanDerWaalsContact O-CB 3.25Å; A163-A167 WeakPolarHBondContact O-CB 3.3Å; A163-A167 PolarHBondContact O-N 3.37Å; L164-A167 CarbonylContact O-C 3.5Å; A167-G169 PolarHBondContact O-N 3.38Å; A167-D170 HydrophobicContact CB-CB 4.26Å; A167-D170 VanDerWaalsContact CB-O 3.25Å; A167-D170 WeakPolarHBondContact CB-O 3.42Å; A167-D170 VanDerWaalsContact O-CB 3.27Å; A167-D170 WeakPolarHBondContact O-CB 3.36Å; A167-D170 PolarHBondContact O-N 2.93Å; A167-D170 VanDerWaalsContact O-N 3.1Å; A167-E173 HydrophobicContact CB-CB 3.84Å; A167-A174 HydrophobicContact CB-CB 3.98Å; A167-L177 HydrophobicContact CB-CD1 4.31Å |
| 168 | K | 89.4 | Confident | 92.2 | Very high | 182 Ų | 182 | 56.8 Ų | 56.8 | 79% | 0.791 | 29% | 0.288 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.5 | 35.5 | -179.4 | -57.3 | 176.3 | -178.7 | 170.6 | 0 | 113.6 | L164 I166 | L164-K168 WeakPolarHBondContact O-CA 3.27Å; L164-K168 PolarHBondContact O-N 3.01Å; I166-K168 PolarHBondContact O-N 3.04Å |
| 169 | G | 86.8 | Confident | 92.4 | Very high | 19 Ų | 19 | 58.5 Ų | 58.5 | 20% | 0.196 | 29% | 0.29 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 86.7 | 6.5 | -179.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | Q144 L164 A167 | Q144-G169 PolarHBondContact NE2-O 3.44Å; L164-G169 PolarHBondContact O-N 3.16Å; A167-G169 PolarHBondContact O-N 3.38Å |
| 170 | D | 91.9 | Very high | 92.2 | Very high | 70 Ų | 70 | 60.3 Ų | 60.3 | 37% | 0.374 | 30% | 0.298 | S | S | . | . | trans | -77.7 | 121.8 | 167.8 | -173.2 | -38.8 | 0 | 0 | 0 | 109.5 | A167 E172 E173 A174 | A167-D170 HydrophobicContact CB-CB 4.26Å; A167-D170 VanDerWaalsContact CB-O 3.25Å; A167-D170 WeakPolarHBondContact CB-O 3.42Å; A167-D170 VanDerWaalsContact O-CB 3.27Å; A167-D170 WeakPolarHBondContact O-CB 3.36Å; A167-D170 PolarHBondContact O-N 2.93Å; A167-D170 VanDerWaalsContact O-N 3.1Å; D170-E172 PolarHBondContact OD1-N 3.39Å; D170-E172 VanDerWaalsContact OD1-N 3.17Å; D170-E173 HydrophobicContact CB-CB 4.1Å; D170-E173 HydrophobicContact CB-CG 4.45Å; D170-E173 PolarHBondContact OD1-N 3.47Å; D170-A174 VanDerWaalsContact O-CB 3.31Å; D170-A174 WeakPolarHBondContact O-CB 3.36Å; D170-A174 PolarHBondContact O-N 3.18Å | ||
| 171 | M | 93.5 | Very high | 91.5 | Very high | 37 Ų | 37 | 62.6 Ų | 62.6 | 18% | 0.182 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -77.5 | -44 | -172.9 | -177 | 174.2 | -75.4 | 0 | 0 | 110.9 | Q144 H147 E173 A174 V175 | Q144-M171 HydrophobicContact CB-CE 4.12Å; Q144-M171 HydrophobicContact CG-CE 3.85Å; H147-M171 HydrophobicContact CB-CE 4.09Å; H147-M171 PolarHBondContact CD2-SD 3.24Å; M171-E173 VanDerWaalsContact C-N 3.35Å; M171-E173 PolarHBondContact O-N 2.97Å; M171-A174 WeakPolarHBondContact O-CB 3.46Å; M171-A174 PolarHBondContact O-N 3.32Å; M171-A174 VanDerWaalsContact O-N 3.15Å; M171-V175 HydrophobicContact CG-CG2 4.44Å; M171-V175 WeakPolarHBondContact O-CB 3.37Å; M171-V175 WeakPolarHBondContact O-CG2 3.49Å; M171-V175 PolarHBondContact O-N 3.2Å |
| 172 | E | 93.4 | Very high | 90.5 | Very high | 139 Ų | 139 | 59.3 Ų | 59.3 | 65% | 0.65 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -63.1 | -42.8 | -179.1 | -68 | 70.2 | -159.7 | 0 | 0 | 110.9 | D170 V175 R176 | D170-E172 PolarHBondContact OD1-N 3.39Å; D170-E172 VanDerWaalsContact OD1-N 3.17Å; E172-V175 PolarHBondContact O-N 3.21Å; E172-R176 PolarHBondContact O-N 3.05Å |
| 173 | E | 93.6 | Very high | 89.3 | Confident | 77 Ų | 77 | 58.6 Ų | 58.6 | 36% | 0.36 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -67.7 | -37.3 | 173.8 | -75.3 | -63.1 | 149.3 | 0 | 0 | 112.2 | A167 D170 M171 R176 L177 | A167-E173 HydrophobicContact CB-CB 3.84Å; D170-E173 HydrophobicContact CB-CB 4.1Å; D170-E173 HydrophobicContact CB-CG 4.45Å; D170-E173 PolarHBondContact OD1-N 3.47Å; M171-E173 VanDerWaalsContact C-N 3.35Å; M171-E173 PolarHBondContact O-N 2.97Å; E173-R176 PolarHBondContact O-N 2.83Å; E173-R176 IonicContact OE1-NE 2.62Å; E173-R176 IonicContact OE2-CZ 2.66Å; E173-R176 VanDerWaalsContact OE2-CZ 3.24Å; E173-R176 IonicContact OE2-NE 3.52Å; E173-R176 PolarHBondContact OE2-NE 3.46Å; E173-R176 IonicContact OE2-NH2 3.81Å; E173-R176 PolarHBondContact OE2-NH2 3.2Å; E173-L177 VanDerWaalsContact O-CG 3.26Å; E173-L177 WeakPolarHBondContact O-CG 3.29Å; E173-L177 PolarHBondContact O-N 2.81Å |
| 174 | A | 94.4 | Very high | 87.8 | Confident | 0 Ų | 0 | 66 Ų | 66 | 0% | 0 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -64.6 | -40 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | L148 A163 L164 A167 D170 M171 L177 I178 | L148-A174 HydrophobicContact CD1-CB 4Å; A163-A174 HydrophobicContact CB-CB 3.97Å; L164-A174 HydrophobicContact CD2-CB 3.89Å; L164-A174 HydrophobicContact CG-CB 4.24Å; A167-A174 HydrophobicContact CB-CB 3.98Å; D170-A174 VanDerWaalsContact O-CB 3.31Å; D170-A174 WeakPolarHBondContact O-CB 3.36Å; D170-A174 PolarHBondContact O-N 3.18Å; M171-A174 WeakPolarHBondContact O-CB 3.46Å; M171-A174 PolarHBondContact O-N 3.32Å; M171-A174 VanDerWaalsContact O-N 3.15Å; A174-L177 PolarHBondContact O-N 3.08Å; A174-I178 WeakPolarHBondContact O-CD1 3.5Å; A174-I178 VanDerWaalsContact O-CG1 3.29Å; A174-I178 WeakPolarHBondContact O-CG1 3.18Å; A174-I178 PolarHBondContact O-N 3.05Å |
| 175 | V | 94.3 | Very high | 85.6 | Confident | 28 Ų | 28 | 73.9 Ų | 73.9 | 17% | 0.17 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -60.8 | -48.4 | 174 | 168.6 | 0 | 0 | 0 | 0 | 110.4 | L148 M151 F152 M171 E172 L177 I178 I179 | L148-V175 HydrophobicContact CD2-CG2 3.56Å; M151-V175 HydrophobicContact CE-CB 4.45Å; M151-V175 HydrophobicContact CE-CG1 4.27Å; M151-V175 HydrophobicContact CE-CG2 3.28Å; F152-V175 HydrophobicContact CE2-CB 4.38Å; F152-V175 HydrophobicContact CE2-CG1 4.16Å; F152-V175 HydrophobicContact CE2-CG2 4.17Å; F152-V175 HydrophobicContact CZ-CB 4.49Å; F152-V175 HydrophobicContact CZ-CG1 3.86Å; M171-V175 HydrophobicContact CG-CG2 4.44Å; M171-V175 WeakPolarHBondContact O-CB 3.37Å; M171-V175 WeakPolarHBondContact O-CG2 3.49Å; M171-V175 PolarHBondContact O-N 3.2Å; E172-V175 PolarHBondContact O-N 3.21Å; V175-L177 PolarHBondContact O-N 3.02Å; V175-I178 PolarHBondContact O-N 3.36Å; V175-I179 HydrophobicContact CG1-CD1 3.83Å; V175-I179 WeakPolarHBondContact O-CG1 3.48Å; V175-I179 PolarHBondContact O-N 3.41Å |
| 176 | R | 94.2 | Very high | 83 | Confident | 94 Ų | 94 | 74.1 Ų | 74.1 | 36% | 0.355 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -57.6 | -47.4 | 176.8 | -171.9 | -175.4 | 63.6 | 73.2 | 5.5 | 111.5 | E172 E173 I178 I179 E180 | E172-R176 PolarHBondContact O-N 3.05Å; E173-R176 PolarHBondContact O-N 2.83Å; E173-R176 IonicContact OE1-NE 2.62Å; E173-R176 IonicContact OE2-CZ 2.66Å; E173-R176 VanDerWaalsContact OE2-CZ 3.24Å; E173-R176 IonicContact OE2-NE 3.52Å; E173-R176 PolarHBondContact OE2-NE 3.46Å; E173-R176 IonicContact OE2-NH2 3.81Å; E173-R176 PolarHBondContact OE2-NH2 3.2Å; R176-I178 VanDerWaalsContact C-N 3.31Å; R176-I178 PolarHBondContact O-N 3.44Å; R176-I179 PolarHBondContact O-N 2.85Å; R176-E180 HydrophobicContact CG-CG 4.4Å; R176-E180 WeakPolarHBondContact CG-OE1 3.44Å; R176-E180 IonicContact CZ-OE2 2.69Å; R176-E180 IonicContact NH1-OE1 3.57Å; R176-E180 IonicContact NH1-OE2 3.24Å; R176-E180 PolarHBondContact NH1-OE2 3.17Å; R176-E180 WeakPolarHBondContact O-CB 3.45Å; R176-E180 WeakPolarHBondContact O-CG 3.42Å; R176-E180 PolarHBondContact O-N 3.41Å |
| 177 | L | 93.1 | Very high | 80.8 | Confident | 14 Ų | 14 | 77 Ų | 77 | 7% | 0.073 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -59.1 | -39.8 | 177.6 | -71.9 | 169.4 | 0 | 0 | 0 | 112.5 | I166 A167 E173 A174 V175 G181 D182 V183 | I166-L177 HydrophobicContact CB-CD1 3.84Å; I166-L177 HydrophobicContact CG2-CD1 3.58Å; A167-L177 HydrophobicContact CB-CD1 4.31Å; E173-L177 VanDerWaalsContact O-CG 3.26Å; E173-L177 WeakPolarHBondContact O-CG 3.29Å; E173-L177 PolarHBondContact O-N 2.81Å; A174-L177 PolarHBondContact O-N 3.08Å; V175-L177 PolarHBondContact O-N 3.02Å; L177-G181 PolarHBondContact O-N 3.48Å; L177-D182 HydrophobicContact CD2-CB 3.55Å; L177-D182 PolarHBondContact O-N 2.99Å; L177-V183 HydrophobicContact CB-CG2 4Å |
| 178 | I | 92.3 | Very high | 78.2 | Confident | 29 Ų | 29 | 82.1 Ų | 82.1 | 15% | 0.149 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -68.8 | -40.7 | 178.5 | -69.5 | 163.9 | 0 | 0 | 0 | 111.2 | L148 F152 C155 A163 A174 V175 R176 V183 | L148-I178 HydrophobicContact CB-CD1 4.4Å; L148-I178 HydrophobicContact CD1-CD1 3.99Å; L148-I178 HydrophobicContact CD2-CD1 4.02Å; L148-I178 HydrophobicContact CG-CD1 4.38Å; F152-I178 HydrophobicContact CB-CG2 4.42Å; F152-I178 HydrophobicContact CD1-CG2 3.9Å; F152-I178 HydrophobicContact CD2-CB 4.47Å; F152-I178 HydrophobicContact CD2-CD1 4.18Å; F152-I178 HydrophobicContact CD2-CG2 3.85Å; F152-I178 HydrophobicContact CE1-CG2 4.04Å; F152-I178 HydrophobicContact CE2-CB 4.22Å; F152-I178 HydrophobicContact CE2-CD1 4.25Å; F152-I178 HydrophobicContact CE2-CG2 3.98Å; F152-I178 HydrophobicContact CG-CG2 3.8Å; F152-I178 HydrophobicContact CZ-CB 4.35Å; F152-I178 HydrophobicContact CZ-CG2 4.06Å; C155-I178 HydrophobicContact CB-CG2 4.43Å; A163-I178 HydrophobicContact CB-CD1 3.84Å; A163-I178 HydrophobicContact CB-CG1 3.72Å; A174-I178 WeakPolarHBondContact O-CD1 3.5Å; A174-I178 VanDerWaalsContact O-CG1 3.29Å; A174-I178 WeakPolarHBondContact O-CG1 3.18Å; A174-I178 PolarHBondContact O-N 3.05Å; V175-I178 PolarHBondContact O-N 3.36Å; R176-I178 VanDerWaalsContact C-N 3.31Å; R176-I178 PolarHBondContact O-N 3.44Å; I178-V183 HydrophobicContact CB-CG2 4.49Å; I178-V183 HydrophobicContact CG1-CG2 3.8Å |
| 179 | I | 92.8 | Very high | 76.3 | Confident | 118 Ų | 118 | 79.2 Ų | 79.2 | 61% | 0.605 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -68.2 | -43.8 | 178.8 | -67.7 | 168.3 | 0 | 0 | 0 | 111.3 | F152 V175 R176 G181 | F152-I179 HydrophobicContact CE1-CD1 4.28Å; F152-I179 HydrophobicContact CE1-CG1 3.64Å; F152-I179 HydrophobicContact CZ-CD1 4.03Å; F152-I179 HydrophobicContact CZ-CG1 3.68Å; V175-I179 HydrophobicContact CG1-CD1 3.83Å; V175-I179 WeakPolarHBondContact O-CG1 3.48Å; V175-I179 PolarHBondContact O-N 3.41Å; R176-I179 PolarHBondContact O-N 2.85Å; I179-G181 VanDerWaalsContact C-N 3.26Å; I179-G181 PolarHBondContact O-N 3.15Å |
| 180 | E | 88.4 | Confident | 74.2 | Confident | 110 Ų | 110 | 86 Ų | 86 | 51% | 0.514 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -77.4 | -14.5 | -178 | -68.6 | 175.3 | -177.9 | 0 | 0 | 112.5 | R176 D182 | R176-E180 HydrophobicContact CG-CG 4.4Å; R176-E180 WeakPolarHBondContact CG-OE1 3.44Å; R176-E180 IonicContact CZ-OE2 2.69Å; R176-E180 IonicContact NH1-OE1 3.57Å; R176-E180 IonicContact NH1-OE2 3.24Å; R176-E180 PolarHBondContact NH1-OE2 3.17Å; R176-E180 WeakPolarHBondContact O-CB 3.45Å; R176-E180 WeakPolarHBondContact O-CG 3.42Å; R176-E180 PolarHBondContact O-N 3.41Å; E180-D182 VanDerWaalsContact C-N 3.31Å |
| 181 | G | 77.9 | Confident | 71.7 | Confident | 48 Ų | 48 | 88.5 Ų | 88.5 | 50% | 0.495 | 48% | 0.484 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 80.5 | 11.5 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | L177 I179 V183 | L177-G181 PolarHBondContact O-N 3.48Å; I179-G181 VanDerWaalsContact C-N 3.26Å; I179-G181 PolarHBondContact O-N 3.15Å; G181-V183 PolarHBondContact O-N 3.47Å |
| 182 | D | 71 | Confident | 69.2 | Low | 85 Ų | 85 | 92.4 Ų | 92.4 | 46% | 0.455 | 51% | 0.509 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.5 | -2.6 | -177.3 | -78.2 | -8.6 | 0 | 0 | 0 | 113.5 | L177 E180 Q184 | L177-D182 HydrophobicContact CD2-CB 3.55Å; L177-D182 PolarHBondContact O-N 2.99Å; E180-D182 VanDerWaalsContact C-N 3.31Å; D182-Q184 CarbonylContact O-C 3.55Å; D182-Q184 PolarHBondContact O-N 2.91Å |
| 183 | V | 67.4 | Low | 66.6 | Low | 18 Ų | 18 | 92.5 Ų | 92.5 | 11% | 0.109 | 51% | 0.514 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64.3 | -19.1 | 176.5 | 179.7 | 0 | 0 | 0 | 0 | 112.7 | E159 A163 L177 I178 G181 L185 | E159-V183 HydrophobicContact CB-CG1 4Å; E159-V183 HydrophobicContact CG-CG1 4.18Å; E159-V183 WeakPolarHBondContact O-CG1 3.35Å; A163-V183 HydrophobicContact CB-CG2 3.74Å; L177-V183 HydrophobicContact CB-CG2 4Å; I178-V183 HydrophobicContact CB-CG2 4.49Å; I178-V183 HydrophobicContact CG1-CG2 3.8Å; G181-V183 PolarHBondContact O-N 3.47Å; V183-L185 PolarHBondContact O-N 2.66Å |
| 184 | Q | 61 | Low | 64.2 | Low | 156 Ų | 156 | 97.2 Ų | 97.2 | 73% | 0.729 | 54% | 0.536 | S | S | * | . | trans | -87.1 | 97.1 | 163.9 | -75.1 | 169.8 | 25.4 | 0 | 0 | 108.1 | D182 | D182-Q184 CarbonylContact O-C 3.55Å; D182-Q184 PolarHBondContact O-N 2.91Å | ||
| 185 | L | 47.3 | Very low | 61.9 | Low | 165 Ų | 165 | 100.5 Ų | 100.5 | 86% | 0.864 | 57% | 0.57 | S | S | * | * | trans | 172.4 | 73.2 | 145.9 | -86.5 | -173 | 0 | 0 | 0 | 109.8 | V183 | V183-L185 PolarHBondContact O-N 2.66Š| ||
| 186 | S | 38.2 | Very low | 59.6 | Low | 83 Ų | 83 | 108.5 Ų | 108.5 | 58% | 0.58 | 60% | 0.602 | S | S | * | * | trans | -130.5 | 120.7 | 143.8 | 69.9 | 0 | 0 | 0 | 0 | 109.6 | T188 | S186-T188 PolarHBondContact O-N 2.98Š| ||
| 187 | P | 44.2 | Very low | 57.5 | Low | 128 Ų | 128 | 110.1 Ų | 110.1 | 83% | 0.831 | 63% | 0.628 | S | S | * | * | trans | -85.6 | 105.5 | 172.6 | 32.1 | -26.4 | 0 | 0 | 0 | 108 | ||||
| 188 | T | 36.3 | Very low | 55.8 | Low | 124 Ų | 124 | 116.3 Ų | 116.3 | 76% | 0.761 | 66% | 0.659 | S | S | * | * | trans | -135.4 | 125.9 | 149.3 | -26.3 | 0 | 0 | 0 | 0 | 107.7 | S186 I190 | S186-T188 PolarHBondContact O-N 2.98Å; T188-I190 PolarHBondContact O-N 3.31Å | ||
| 189 | P | 50.7 | Low | 54.2 | Low | 121 Ų | 121 | 117.9 Ų | 117.9 | 79% | 0.786 | 67% | 0.673 | S | S | * | * | trans | -92.2 | 104.2 | -151.8 | 33.7 | -29.4 | 0 | 0 | 0 | 110.5 | ||||
| 190 | I | 41.7 | Very low | 52.7 | Low | 162 Ų | 162 | 117 Ų | 117 | 83% | 0.831 | 68% | 0.677 | S | S | * | * | trans | -137.1 | 97.1 | 161.2 | -55.7 | -178.7 | 0 | 0 | 0 | 110.5 | T188 | T188-I190 PolarHBondContact O-N 3.31Š| ||
| 191 | N | 39.9 | Very low | 51.6 | Low | 123 Ų | 123 | 117 Ų | 117 | 66% | 0.658 | 68% | 0.68 | S | S | * | * | trans | 62.2 | 87.7 | 136.7 | -147.3 | -43.8 | 0 | 0 | 0 | 117.6 | N193 | N191-N193 PolarHBondContact O-N 3.17Å; N191-N193 PolarHBondContact OD1-ND2 2.96Å | ||
| 192 | V | 40.8 | Very low | 51.3 | Low | 118 Ų | 118 | 117 Ų | 117 | 72% | 0.715 | 68% | 0.675 | S | S | * | * | trans | -66.3 | 104.4 | 162.1 | -155.7 | 0 | 0 | 0 | 0 | 108.8 | Q194 | V192-Q194 HydrophobicContact CG1-CG 3.6Š| ||
| 193 | N | 39 | Very low | 51.6 | Low | 142 Ų | 142 | 117.9 Ų | 117.9 | 76% | 0.759 | 68% | 0.68 | S | S | * | * | trans | -103.5 | 98.8 | 153.4 | -79.3 | -73 | 0 | 0 | 0 | 108.1 | N191 G195 | N191-N193 PolarHBondContact O-N 3.17Å; N191-N193 PolarHBondContact OD1-ND2 2.96Å; N193-G195 PolarHBondContact O-N 3.39Å | ||
| 194 | Q | 42.7 | Very low | 52.5 | Low | 176 Ų | 176 | 122.2 Ų | 122.2 | 82% | 0.822 | 70% | 0.7 | S | S | * | * | trans | -64.3 | 118.3 | 179 | -63.4 | 171.9 | -22.4 | 0 | 0 | 110 | V192 | V192-Q194 HydrophobicContact CG1-CG 3.6Š| ||
| 195 | G | 47.6 | Very low | 53.7 | Low | 68 Ų | 68 | 121.2 Ų | 121.2 | 70% | 0.701 | 69% | 0.693 | S | S | * | * | trans | -113.9 | 81.7 | 165.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | N193 | N193-G195 PolarHBondContact O-N 3.39Š| ||
| 196 | K | 45.9 | Very low | 55.6 | Low | 197 Ų | 197 | 118.3 Ų | 118.3 | 86% | 0.857 | 68% | 0.677 | S | S | * | * | trans | 156.1 | 106.7 | 140 | -83.4 | 158.6 | -173.4 | 177.8 | 0 | 110.6 | I198 | K196-I198 PolarHBondContact O-N 3.38Š| ||
| 197 | S | 48.9 | Very low | 58 | Low | 127 Ų | 127 | 121 Ų | 121 | 89% | 0.888 | 68% | 0.678 | S | S | * | * | trans | -60.3 | 97 | 164.9 | 175.7 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 198 | I | 56.8 | Low | 60 | Low | 144 Ų | 144 | 120 Ų | 120 | 74% | 0.738 | 66% | 0.663 | S | S | * | * | trans | -114.6 | 131.6 | 150.5 | -52.2 | 178.9 | 0 | 0 | 0 | 104.5 | K196 S200 | K196-I198 PolarHBondContact O-N 3.38Å; I198-S200 PolarHBondContact O-N 2.83Å | ||
| 199 | S | 60.5 | Low | 62.2 | Low | 63 Ų | 63 | 117.2 Ų | 117.2 | 44% | 0.441 | 65% | 0.649 | S | S | . | * | trans | -47.3 | 105.9 | -154.1 | 53.9 | 0 | 0 | 0 | 0 | 115.1 | L201 A202 D203 | S199-L201 PolarHBondContact O-N 2.97Å; S199-A202 PolarHBondContact O-N 3.4Å; S199-A202 VanDerWaalsContact OG-CB 3.24Å; S199-A202 WeakPolarHBondContact OG-CB 3.26Å; S199-D203 PolarHBondContact O-N 3.15Å | ||
| 200 | S | 60.8 | Low | 64.1 | Low | 98 Ų | 98 | 115.7 Ų | 115.7 | 69% | 0.685 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -51.2 | -26.2 | 171.6 | 57.4 | 0 | 0 | 0 | 0 | 113.6 | I198 Q204 | I198-S200 PolarHBondContact O-N 2.83Å; S200-Q204 VanDerWaalsContact O-CB 3.29Å; S200-Q204 WeakPolarHBondContact O-CB 3.47Å; S200-Q204 PolarHBondContact O-N 3.2Å |
| 201 | L | 64.4 | Low | 66.2 | Low | 110 Ų | 110 | 111.3 Ų | 111.3 | 58% | 0.576 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -71.4 | -32.5 | 177.2 | -160.8 | 113.2 | 0 | 0 | 0 | 113.3 | S199 K205 | S199-L201 PolarHBondContact O-N 2.97Å; L201-K205 WeakPolarHBondContact O-CG 3.17Å; L201-K205 PolarHBondContact O-N 3.42Å |
| 202 | A | 72.8 | Confident | 68.1 | Low | 48 Ų | 48 | 113.3 Ų | 113.3 | 40% | 0.397 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -74.2 | -41.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | S199 Q204 K205 L206 | S199-A202 PolarHBondContact O-N 3.4Å; S199-A202 VanDerWaalsContact OG-CB 3.24Å; S199-A202 WeakPolarHBondContact OG-CB 3.26Å; A202-Q204 VanDerWaalsContact C-N 3.31Å; A202-Q204 PolarHBondContact O-N 3.35Å; A202-K205 PolarHBondContact O-N 3.37Å; A202-L206 WeakPolarHBondContact O-CB 3.45Å; A202-L206 PolarHBondContact O-N 3.34Å |
| 203 | D | 77.8 | Confident | 70.2 | Confident | 105 Ų | 105 | 114.9 Ų | 114.9 | 56% | 0.561 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -66.1 | -36 | 176.2 | -70.9 | -8.4 | 0 | 0 | 0 | 111.7 | S199 L206 K207 | S199-D203 PolarHBondContact O-N 3.15Å; D203-L206 PolarHBondContact O-N 3.5Å; D203-K207 WeakPolarHBondContact O-CB 3.21Å; D203-K207 PolarHBondContact O-N 3.03Å |
| 204 | Q | 84.5 | Confident | 72.3 | Confident | 109 Ų | 109 | 116 Ų | 116 | 51% | 0.509 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -64.6 | -43.3 | 175.2 | -170.6 | 166.2 | 15.7 | 0 | 0 | 111.8 | S200 A202 K207 E208 | S200-Q204 VanDerWaalsContact O-CB 3.29Å; S200-Q204 WeakPolarHBondContact O-CB 3.47Å; S200-Q204 PolarHBondContact O-N 3.2Å; A202-Q204 VanDerWaalsContact C-N 3.31Å; A202-Q204 PolarHBondContact O-N 3.35Å; Q204-K207 PolarHBondContact O-N 3.18Å; Q204-E208 WeakPolarHBondContact O-CB 3.45Å; Q204-E208 VanDerWaalsContact O-CG 3.26Å; Q204-E208 WeakPolarHBondContact O-CG 3.28Å; Q204-E208 PolarHBondContact O-N 2.94Å |
| 205 | K | 86.4 | Confident | 74.1 | Confident | 135 Ų | 135 | 112.3 Ų | 112.3 | 59% | 0.587 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -66.7 | -39.2 | 175.3 | -74.5 | -177.4 | 177.9 | -171.5 | 0 | 113 | L201 A202 E208 S209 | L201-K205 WeakPolarHBondContact O-CG 3.17Å; L201-K205 PolarHBondContact O-N 3.42Å; A202-K205 PolarHBondContact O-N 3.37Å; K205-E208 PolarHBondContact O-N 2.96Å; K205-S209 VanDerWaalsContact O-CB 3.32Å; K205-S209 WeakPolarHBondContact O-CB 3.29Å; K205-S209 PolarHBondContact O-N 2.97Å |
| 206 | L | 87.8 | Confident | 75.3 | Confident | 103 Ų | 103 | 117.7 Ų | 117.7 | 54% | 0.539 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -64.9 | -43.7 | 176.4 | -179.7 | 60.5 | 0 | 0 | 0 | 110.6 | A202 D203 S209 I210 | A202-L206 WeakPolarHBondContact O-CB 3.45Å; A202-L206 PolarHBondContact O-N 3.34Å; D203-L206 PolarHBondContact O-N 3.5Å; L206-S209 PolarHBondContact O-N 3.38Å; L206-I210 HydrophobicContact CD1-CD1 4.01Å; L206-I210 HydrophobicContact CD1-CG1 4.3Å; L206-I210 HydrophobicContact CG-CD1 3.91Å; L206-I210 VanDerWaalsContact O-CG1 3.26Å; L206-I210 WeakPolarHBondContact O-CG1 3.47Å; L206-I210 PolarHBondContact O-N 2.89Å |
| 207 | K | 88.5 | Confident | 76.4 | Confident | 139 Ų | 139 | 111.1 Ų | 111.1 | 60% | 0.604 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -59.5 | -48.5 | 174.3 | 178.6 | 174.5 | 178.5 | -178.6 | 0 | 111.5 | D203 Q204 S209 I210 L211 | D203-K207 WeakPolarHBondContact O-CB 3.21Å; D203-K207 PolarHBondContact O-N 3.03Å; Q204-K207 PolarHBondContact O-N 3.18Å; K207-S209 VanDerWaalsContact C-N 3.34Å; K207-S209 PolarHBondContact O-N 2.84Å; K207-I210 PolarHBondContact O-N 3.18Å; K207-L211 HydrophobicContact CG-CD1 3.71Å; K207-L211 WeakPolarHBondContact O-CB 3.24Å; K207-L211 WeakPolarHBondContact O-CD1 3.26Å; K207-L211 WeakPolarHBondContact O-CG 3.29Å; K207-L211 PolarHBondContact O-N 2.99Å |
| 208 | E | 85.3 | Confident | 77.5 | Confident | 109 Ų | 109 | 108.8 Ų | 108.8 | 51% | 0.509 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -59.2 | -42.9 | 175.9 | -74.9 | 168 | -169.9 | 0 | 0 | 111.7 | Q204 K205 L211 E212 | Q204-E208 WeakPolarHBondContact O-CB 3.45Å; Q204-E208 VanDerWaalsContact O-CG 3.26Å; Q204-E208 WeakPolarHBondContact O-CG 3.28Å; Q204-E208 PolarHBondContact O-N 2.94Å; K205-E208 PolarHBondContact O-N 2.96Å; E208-L211 PolarHBondContact O-N 3.18Å; E208-E212 WeakPolarHBondContact O-CB 3.25Å; E208-E212 PolarHBondContact O-N 2.89Å |
| 209 | S | 84.1 | Confident | 78.2 | Confident | 65 Ų | 65 | 105.1 Ų | 105.1 | 46% | 0.455 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -66.7 | -38.9 | 178.4 | 179.4 | 0 | 0 | 0 | 0 | 113.4 | K205 L206 K207 K213 | K205-S209 VanDerWaalsContact O-CB 3.32Å; K205-S209 WeakPolarHBondContact O-CB 3.29Å; K205-S209 PolarHBondContact O-N 2.97Å; L206-S209 PolarHBondContact O-N 3.38Å; K207-S209 VanDerWaalsContact C-N 3.34Å; K207-S209 PolarHBondContact O-N 2.84Å; S209-K213 VanDerWaalsContact O-CB 3.25Å; S209-K213 WeakPolarHBondContact O-CB 3.45Å; S209-K213 PolarHBondContact O-N 3.1Å |
| 210 | I | 89.2 | Confident | 78.9 | Confident | 88 Ų | 88 | 109.3 Ų | 109.3 | 45% | 0.451 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -68.2 | -43.8 | 175.7 | -67.3 | 166.7 | 0 | 0 | 0 | 109.7 | L206 K207 K213 Y214 | L206-I210 HydrophobicContact CD1-CD1 4.01Å; L206-I210 HydrophobicContact CD1-CG1 4.3Å; L206-I210 HydrophobicContact CG-CD1 3.91Å; L206-I210 VanDerWaalsContact O-CG1 3.26Å; L206-I210 WeakPolarHBondContact O-CG1 3.47Å; L206-I210 PolarHBondContact O-N 2.89Å; K207-I210 PolarHBondContact O-N 3.18Å; I210-K213 PolarHBondContact O-N 2.69Å; I210-Y214 HydrophobicContact CG2-CD2 3.99Å; I210-Y214 HydrophobicContact CG2-CE2 4.49Å; I210-Y214 VanDerWaalsContact O-CD2 3.26Å; I210-Y214 WeakPolarHBondContact O-CD2 3.26Å; I210-Y214 PolarHBondContact O-N 3.07Å; I210-Y214 VanDerWaalsContact O-N 3.11Å |
| 211 | L | 86.1 | Confident | 79.3 | Confident | 70 Ų | 70 | 111.1 Ų | 111.1 | 37% | 0.366 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -61.7 | -48.1 | 176.5 | -80.5 | 152 | 0 | 0 | 0 | 111.3 | K207 E208 K213 Y214 M215 | K207-L211 HydrophobicContact CG-CD1 3.71Å; K207-L211 WeakPolarHBondContact O-CB 3.24Å; K207-L211 WeakPolarHBondContact O-CD1 3.26Å; K207-L211 WeakPolarHBondContact O-CG 3.29Å; K207-L211 PolarHBondContact O-N 2.99Å; E208-L211 PolarHBondContact O-N 3.18Å; L211-K213 VanDerWaalsContact C-N 3.32Å; L211-K213 PolarHBondContact O-N 2.95Å; L211-Y214 PolarHBondContact O-N 3.33Å; L211-M215 HydrophobicContact CB-CE 4.39Å; L211-M215 HydrophobicContact CD2-CE 3.51Å; L211-M215 HydrophobicContact CD2-SD 3.55Å; L211-M215 VanDerWaalsContact CD2-SD 3.55Å; L211-M215 WeakPolarHBondContact O-CA 3.31Å; L211-M215 WeakPolarHBondContact O-CB 3.25Å; L211-M215 PolarHBondContact O-N 2.87Å |
| 212 | E | 80.3 | Confident | 79.7 | Confident | 166 Ų | 166 | 112.3 Ų | 112.3 | 78% | 0.776 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -60.6 | -38.8 | 177.8 | -175.9 | 178.9 | -154.8 | 0 | 0 | 112.7 | E208 | E208-E212 WeakPolarHBondContact O-CB 3.25Å; E208-E212 PolarHBondContact O-N 2.89Å |
| 213 | K | 85.9 | Confident | 79.8 | Confident | 150 Ų | 150 | 116.5 Ų | 116.5 | 65% | 0.652 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -73.3 | -33.7 | -176.8 | -176.1 | 176 | 176.9 | -161.7 | 0 | 113.6 | S209 I210 L211 | S209-K213 VanDerWaalsContact O-CB 3.25Å; S209-K213 WeakPolarHBondContact O-CB 3.45Å; S209-K213 PolarHBondContact O-N 3.1Å; I210-K213 PolarHBondContact O-N 2.69Å; L211-K213 VanDerWaalsContact C-N 3.32Å; L211-K213 PolarHBondContact O-N 2.95Å |
| 214 | Y | 83 | Confident | 79.8 | Confident | 167 Ų | 167 | 119.5 Ų | 119.5 | 66% | 0.655 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -115.4 | -17 | -170.3 | -64.9 | -77.5 | 0 | 0 | 0 | 113.9 | I210 L211 | I210-Y214 HydrophobicContact CG2-CD2 3.99Å; I210-Y214 HydrophobicContact CG2-CE2 4.49Å; I210-Y214 VanDerWaalsContact O-CD2 3.26Å; I210-Y214 WeakPolarHBondContact O-CD2 3.26Å; I210-Y214 PolarHBondContact O-N 3.07Å; I210-Y214 VanDerWaalsContact O-N 3.11Å; L211-Y214 PolarHBondContact O-N 3.33Å |
| 215 | M | 78.8 | Confident | 79.4 | Confident | 97 Ų | 97 | 119.3 Ų | 119.3 | 48% | 0.478 | 59% | 0.592 | S | S | . | * | S | Bend | trans | -98.7 | 118.6 | 176.6 | -157.3 | 163.6 | 70.9 | 0 | 0 | 108.1 | L211 V217 | L211-M215 HydrophobicContact CB-CE 4.39Å; L211-M215 HydrophobicContact CD2-CE 3.51Å; L211-M215 HydrophobicContact CD2-SD 3.55Å; L211-M215 VanDerWaalsContact CD2-SD 3.55Å; L211-M215 WeakPolarHBondContact O-CA 3.31Å; L211-M215 WeakPolarHBondContact O-CB 3.25Å; L211-M215 PolarHBondContact O-N 2.87Å; M215-V217 HydrophobicContact CB-CG2 3.75Å; M215-V217 HydrophobicContact CE-CB 4.48Å; M215-V217 HydrophobicContact CE-CG2 3.06Å; M215-V217 HydrophobicContact CG-CG2 3.54Å; M215-V217 PolarHBondContact O-N 3.3Å; M215-V217 HydrophobicContact SD-CG2 4.03Å |
| 216 | L | 74.6 | Confident | 79 | Confident | 181 Ų | 181 | 120.6 Ų | 120.6 | 95% | 0.948 | 60% | 0.6 | S | S | * | * | trans | -71 | 77.2 | 165.8 | -89.7 | 87.6 | 0 | 0 | 0 | 108.1 | D218 | L216-D218 PolarHBondContact O-N 3.31Š| ||
| 217 | V | 67.7 | Low | 78.4 | Confident | 60 Ų | 60 | 125.6 Ų | 125.6 | 36% | 0.364 | 61% | 0.612 | S | S | . | * | trans | -86.6 | 106.5 | 171.4 | -169 | 0 | 0 | 0 | 0 | 107.1 | M215 S219 | M215-V217 HydrophobicContact CB-CG2 3.75Å; M215-V217 HydrophobicContact CE-CB 4.48Å; M215-V217 HydrophobicContact CE-CG2 3.06Å; M215-V217 HydrophobicContact CG-CG2 3.54Å; M215-V217 PolarHBondContact O-N 3.3Å; M215-V217 HydrophobicContact SD-CG2 4.03Å; V217-S219 PolarHBondContact O-N 2.7Å; V217-S219 PolarHBondContact O-OG 3.4Å | ||
| 218 | D | 72.6 | Confident | 77.9 | Confident | 77 Ų | 77 | 123.9 Ų | 123.9 | 41% | 0.412 | 61% | 0.614 | S | S | . | * | trans | -73.8 | 79.5 | 167.7 | -158.9 | -11.1 | 0 | 0 | 0 | 109.6 | L216 E220 E221 D222 | L216-D218 PolarHBondContact O-N 3.31Å; D218-E220 PolarHBondContact O-N 3.42Å; D218-E220 VanDerWaalsContact O-N 3.14Å; D218-E220 WeakPolarHBondContact OD1-CG 3.27Å; D218-E220 PolarHBondContact OD1-N 3.19Å; D218-E221 HydrophobicContact CB-CB 4.38Å; D218-E221 PolarHBondContact O-N 2.97Å; D218-E221 VanDerWaalsContact O-N 3.15Å; D218-D222 PolarHBondContact O-N 3.38Å | ||
| 219 | S | 70.9 | Confident | 77.4 | Confident | 67 Ų | 67 | 124.8 Ų | 124.8 | 47% | 0.469 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -62.7 | -19.6 | -178.4 | -56.6 | 0 | 0 | 0 | 0 | 111.1 | V217 N223 | V217-S219 PolarHBondContact O-N 2.7Å; V217-S219 PolarHBondContact O-OG 3.4Å; S219-N223 PolarHBondContact O-N 2.92Å; S219-N223 PolarHBondContact O-ND2 3.24Å |
| 220 | E | 74.6 | Confident | 77 | Confident | 152 Ų | 152 | 125.2 Ų | 125.2 | 71% | 0.71 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -72.7 | -34.5 | 178.2 | 100.3 | -174.1 | 167.7 | 0 | 0 | 111.9 | D218 | D218-E220 PolarHBondContact O-N 3.42Å; D218-E220 VanDerWaalsContact O-N 3.14Å; D218-E220 WeakPolarHBondContact OD1-CG 3.27Å; D218-E220 PolarHBondContact OD1-N 3.19Å |
| 221 | E | 69.2 | Low | 76.4 | Confident | 136 Ų | 136 | 126.9 Ų | 126.9 | 64% | 0.636 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -75.9 | -41.3 | 178.6 | -127.1 | -173.9 | 170.1 | 0 | 0 | 111.6 | D218 N223 K224 | D218-E221 HydrophobicContact CB-CB 4.38Å; D218-E221 PolarHBondContact O-N 2.97Å; D218-E221 VanDerWaalsContact O-N 3.15Å; E221-N223 VanDerWaalsContact C-N 3.32Å; E221-N223 PolarHBondContact O-N 2.91Å; E221-K224 WeakPolarHBondContact O-CA 3.46Å; E221-K224 VanDerWaalsContact O-CB 3.26Å; E221-K224 WeakPolarHBondContact O-CB 3.21Å; E221-K224 PolarHBondContact O-N 3.3Å |
| 222 | D | 74.3 | Confident | 75.9 | Confident | 134 Ų | 134 | 132.8 Ų | 132.8 | 72% | 0.717 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -65.3 | -33.5 | 179 | -93.3 | -1.3 | 0 | 0 | 0 | 112.9 | D218 K224 | D218-D222 PolarHBondContact O-N 3.38Å; D222-K224 PolarHBondContact O-N 3.16Å |
| 223 | N | 73.9 | Confident | 75.6 | Confident | 136 Ų | 136 | 132 Ų | 132 | 73% | 0.727 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.2 | -16 | 173.4 | -77.6 | -55.9 | 0 | 0 | 0 | 112.7 | S219 E221 T225 | S219-N223 PolarHBondContact O-N 2.92Å; S219-N223 PolarHBondContact O-ND2 3.24Å; E221-N223 VanDerWaalsContact C-N 3.32Å; E221-N223 PolarHBondContact O-N 2.91Å; N223-T225 PolarHBondContact O-N 2.94Å; N223-T225 VanDerWaalsContact O-N 3.17Å |
| 224 | K | 77.8 | Confident | 75.1 | Confident | 168 Ų | 168 | 128.7 Ų | 128.7 | 73% | 0.73 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -89.5 | 79.9 | 180 | -162.2 | 177.5 | -177.5 | -179.4 | 0 | 109.7 | E221 D222 H226 | E221-K224 WeakPolarHBondContact O-CA 3.46Å; E221-K224 VanDerWaalsContact O-CB 3.26Å; E221-K224 WeakPolarHBondContact O-CB 3.21Å; E221-K224 PolarHBondContact O-N 3.3Å; D222-K224 PolarHBondContact O-N 3.16Å; K224-H226 PolarHBondContact O-N 3.09Å |
| 225 | T | 76.3 | Confident | 74.9 | Confident | 105 Ų | 105 | 126.7 Ų | 126.7 | 64% | 0.644 | 68% | 0.683 | S | S | * | * | trans | -60.9 | 104.8 | 172.9 | -46 | 0 | 0 | 0 | 0 | 110.2 | N223 R227 | N223-T225 PolarHBondContact O-N 2.94Å; N223-T225 VanDerWaalsContact O-N 3.17Å; T225-R227 HydrophobicContact CG2-CG 4.33Å; T225-R227 PolarHBondContact O-N 3Å | ||
| 226 | H | 77.6 | Confident | 74.8 | Confident | 163 Ų | 163 | 130.3 Ų | 130.3 | 76% | 0.755 | 70% | 0.696 | S | S | * | * | trans | -65.7 | 97.1 | 171.1 | 179.2 | -90.4 | 0 | 0 | 0 | 108.8 | K224 P228 | K224-H226 PolarHBondContact O-N 3.09Å; H226-P228 WeakPolarHBondContact O-CD 3.18Å | ||
| 227 | R | 76.8 | Confident | 75 | Confident | 208 Ų | 208 | 131.2 Ų | 131.2 | 79% | 0.785 | 69% | 0.692 | S | S | * | * | trans | -81.5 | 108.4 | 173.3 | -63.9 | -172.3 | -176.8 | -156.3 | 0.1 | 107.3 | T225 V229 | T225-R227 HydrophobicContact CG2-CG 4.33Å; T225-R227 PolarHBondContact O-N 3Å; R227-V229 PolarHBondContact O-N 2.9Å; R227-V229 VanDerWaalsContact O-N 3.16Å | ||
| 228 | P | 76.4 | Confident | 75.7 | Confident | 102 Ų | 102 | 132.1 Ų | 132.1 | 66% | 0.662 | 70% | 0.695 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 128.2 | 172.9 | 24.4 | -32.2 | 0 | 0 | 0 | 107.7 | H226 A230 | H226-P228 WeakPolarHBondContact O-CD 3.18Å; P228-A230 PolarHBondContact O-N 2.96Å; P228-A230 VanDerWaalsContact O-N 3.09Å |
| 229 | V | 75 | Confident | 76.2 | Confident | 128 Ų | 128 | 131.7 Ų | 131.7 | 78% | 0.776 | 70% | 0.695 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 120.8 | 178 | 178.7 | 0 | 0 | 0 | 0 | 107.1 | R227 | R227-V229 PolarHBondContact O-N 2.9Å; R227-V229 VanDerWaalsContact O-N 3.16Å |
| 230 | A | 76.2 | Confident | 76.8 | Confident | 75 Ų | 75 | 134.8 Ų | 134.8 | 62% | 0.62 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -51 | 136.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 109.1 | P228 K232 | P228-A230 PolarHBondContact O-N 2.96Å; P228-A230 VanDerWaalsContact O-N 3.09Å; A230-K232 PolarHBondContact O-N 3.04Å |
| 231 | P | 76.5 | Confident | 77.3 | Confident | 122 Ų | 122 | 135 Ų | 135 | 79% | 0.792 | 69% | 0.692 | S | S | * | * | P | Polyproline II helix | trans | -48.3 | 121.8 | 177 | -27.4 | 34.5 | 0 | 0 | 0 | 109.1 | D233 | P231-D233 PolarHBondContact O-N 3.36Š|
| 232 | K | 75.2 | Confident | 77.9 | Confident | 195 Ų | 195 | 134.8 Ų | 134.8 | 85% | 0.848 | 69% | 0.691 | S | S | * | * | trans | -57.1 | 114.1 | -179.1 | -77.6 | -177.5 | 175.7 | 176 | 0 | 107.9 | A230 A234 | A230-K232 PolarHBondContact O-N 3.04Å; K232-A234 PolarHBondContact O-N 3.13Å; K232-A234 VanDerWaalsContact O-N 3.17Å | ||
| 233 | D | 74.1 | Confident | 78.1 | Confident | 148 Ų | 148 | 131.6 Ų | 131.6 | 79% | 0.791 | 69% | 0.689 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 124 | 175.3 | -87.7 | -27.9 | 0 | 0 | 0 | 108.9 | P231 | P231-D233 PolarHBondContact O-N 3.36Š|
| 234 | A | 75.3 | Confident | 78.5 | Confident | 82 Ų | 82 | 133 Ų | 133 | 68% | 0.678 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 138.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | K232 K236 | K232-A234 PolarHBondContact O-N 3.13Å; K232-A234 VanDerWaalsContact O-N 3.17Å; A234-K236 PolarHBondContact O-N 3.17Å; A234-K236 VanDerWaalsContact O-N 3.13Å |
| 235 | P | 78.3 | Confident | 78.6 | Confident | 124 Ų | 124 | 131.8 Ų | 131.8 | 81% | 0.805 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 124.5 | -176.2 | 21.3 | -32 | 0 | 0 | 0 | 110 | K237 | P235-K237 PolarHBondContact O-N 3.23Š|
| 236 | K | 78.3 | Confident | 78.9 | Confident | 173 Ų | 173 | 130 Ų | 130 | 75% | 0.752 | 68% | 0.682 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 131.8 | -176.5 | -67.6 | -180 | -179 | 175.5 | 0 | 109.4 | A234 L238 | A234-K236 PolarHBondContact O-N 3.17Å; A234-K236 VanDerWaalsContact O-N 3.13Å; K236-L238 HydrophobicContact CB-CD2 4.45Å; K236-L238 PolarHBondContact O-N 3.02Å |
| 237 | K | 77.3 | Confident | 78.9 | Confident | 200 Ų | 200 | 124 Ų | 124 | 87% | 0.87 | 66% | 0.657 | S | S | * | * | trans | -69.5 | 102 | 171.9 | -66 | -174.4 | 178.3 | -179.2 | 0 | 108.8 | P235 | P235-K237 PolarHBondContact O-N 3.23Š| ||
| 238 | L | 82.8 | Confident | 79 | Confident | 79 Ų | 79 | 114.4 Ų | 114.4 | 41% | 0.414 | 62% | 0.622 | S | S | . | * | trans | -83.9 | -17.3 | -178.3 | -61.6 | 177.1 | 0 | 0 | 0 | 113.4 | K236 T249 G251 | K236-L238 HydrophobicContact CB-CD2 4.45Å; K236-L238 PolarHBondContact O-N 3.02Å; L238-T249 WeakPolarHBondContact CB-O 3.31Å; L238-T249 CarbonylContact O-C 3.55Å; L238-G251 PolarHBondContact O-N 3.06Å | ||
| 239 | V | 84.3 | Confident | 79 | Confident | 69 Ų | 69 | 113.3 Ų | 113.3 | 42% | 0.418 | 61% | 0.613 | S | S | . | * | trans | -85.5 | 123.3 | -176.7 | -174.6 | 0 | 0 | 0 | 0 | 110.3 | Y241 V246 T248 | V239-Y241 HydrophobicContact CG1-CD2 4.4Å; V239-Y241 HydrophobicContact CG1-CE2 3.7Å; V239-V246 HydrophobicContact CG1-CG1 3.9Å; V239-V246 HydrophobicContact CG1-CG2 4.31Å; V239-T248 CarbonylContact C-O 3.56Å; V239-T248 WeakPolarHBondContact CA-O 3.38Å | ||
| 240 | R | 83.4 | Confident | 79.2 | Confident | 132 Ų | 132 | 114.6 Ų | 114.6 | 50% | 0.498 | 61% | 0.608 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -123.3 | 143.9 | 174.9 | -54.6 | -177.4 | 175.1 | -172.5 | -4.8 | 111.1 | V247 T248 | R240-V247 PolarHBondContact O-N 2.9Å; R240-T248 VanDerWaalsContact CB-OG1 3.32Å; R240-T248 WeakPolarHBondContact CB-OG1 3.32Å; R240-T248 WeakPolarHBondContact CG-OG1 3.22Å; R240-T248 PolarHBondContact N-O 3.12Å |
| 241 | Y | 85 | Confident | 79.2 | Confident | 155 Ų | 155 | 112.4 Ų | 112.4 | 61% | 0.608 | 59% | 0.593 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -113.3 | 145.5 | -178.4 | -64.8 | -96.6 | 0 | 0 | 0 | 111.3 | V239 Q245 V246 | V239-Y241 HydrophobicContact CG1-CD2 4.4Å; V239-Y241 HydrophobicContact CG1-CE2 3.7Å; Y241-Q245 VanDerWaalsContact CA-O 3.31Å; Y241-Q245 WeakPolarHBondContact CA-O 3.18Å; Y241-V246 HydrophobicContact CD1-CG2 3.93Å; Y241-V246 HydrophobicContact CE1-CB 4.46Å; Y241-V246 HydrophobicContact CE1-CG2 3.34Å |
| 242 | H | 81.8 | Confident | 79.4 | Confident | 133 Ų | 133 | 112 Ų | 112 | 62% | 0.616 | 58% | 0.58 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -141.9 | 123.7 | 167.6 | -177.5 | -89.6 | 0 | 0 | 0 | 107.8 | N244 Q245 V247 | H242-N244 PolarHBondContact O-N 2.99Å; H242-Q245 PolarHBondContact N-O 3.34Å; H242-Q245 PolarHBondContact O-N 2.84Å; H242-V247 HydrophobicContact CB-CG2 3.57Å |
| 243 | G | 79.1 | Confident | 79.4 | Confident | 66 Ų | 66 | 112.6 Ų | 112.6 | 68% | 0.68 | 58% | 0.577 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 57.1 | 46.9 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q245 | G243-Q245 PolarHBondContact O-N 2.94Š|
| 244 | N | 81.7 | Confident | 79.6 | Confident | 165 Ų | 165 | 115.2 Ų | 115.2 | 88% | 0.882 | 58% | 0.577 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 59.3 | 5.7 | -178.4 | -59.9 | 76.8 | 0 | 0 | 0 | 115.6 | H242 | H242-N244 PolarHBondContact O-N 2.99Š|
| 245 | Q | 79.9 | Confident | 79.4 | Confident | 143 Ų | 143 | 115.6 Ų | 115.6 | 67% | 0.668 | 57% | 0.565 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -104.3 | 140.9 | 175.9 | -167.4 | 170.8 | 25.5 | 0 | 0 | 110.6 | Y241 H242 G243 V247 | Y241-Q245 VanDerWaalsContact CA-O 3.31Å; Y241-Q245 WeakPolarHBondContact CA-O 3.18Å; H242-Q245 PolarHBondContact N-O 3.34Å; H242-Q245 PolarHBondContact O-N 2.84Å; G243-Q245 PolarHBondContact O-N 2.94Å; Q245-V247 PolarHBondContact O-N 3.37Å |
| 246 | V | 81.7 | Confident | 79.3 | Confident | 67 Ų | 67 | 116.6 Ų | 116.6 | 41% | 0.406 | 56% | 0.563 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -70.3 | 120.7 | 173.1 | 177.1 | 0 | 0 | 0 | 0 | 108.5 | V239 Y241 T249 | V239-V246 HydrophobicContact CG1-CG1 3.9Å; V239-V246 HydrophobicContact CG1-CG2 4.31Å; Y241-V246 HydrophobicContact CD1-CG2 3.93Å; Y241-V246 HydrophobicContact CE1-CB 4.46Å; Y241-V246 HydrophobicContact CE1-CG2 3.34Å; V246-T249 HydrophobicContact CG1-CG2 3.61Å |
| 247 | V | 77.8 | Confident | 79.1 | Confident | 38 Ų | 38 | 113 Ų | 113 | 23% | 0.23 | 56% | 0.555 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -101 | -55.3 | -178.3 | 178 | 0 | 0 | 0 | 0 | 110.5 | R240 H242 Q245 Q255 | R240-V247 PolarHBondContact O-N 2.9Å; H242-V247 HydrophobicContact CB-CG2 3.57Å; Q245-V247 PolarHBondContact O-N 3.37Å; V247-Q255 HydrophobicContact CG1-CB 3.34Å; V247-Q255 HydrophobicContact CG1-CG 3.41Å; V247-Q255 VanDerWaalsContact CG1-CG 3.41Å; V247-Q255 PolarHBondContact O-NE2 3.23Å; V247-Q255 PolarHBondContact O-OE1 3.05Å |
| 248 | T | 78.6 | Confident | 78.8 | Confident | 7 Ų | 7 | 111.3 Ų | 111.3 | 4% | 0.043 | 55% | 0.548 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.8 | 140.5 | 176.6 | 56.7 | 0 | 0 | 0 | 0 | 110.4 | V239 R240 E252 | V239-T248 CarbonylContact C-O 3.56Å; V239-T248 WeakPolarHBondContact CA-O 3.38Å; R240-T248 VanDerWaalsContact CB-OG1 3.32Å; R240-T248 WeakPolarHBondContact CB-OG1 3.32Å; R240-T248 WeakPolarHBondContact CG-OG1 3.22Å; R240-T248 PolarHBondContact N-O 3.12Å; T248-E252 HydrophobicContact CG2-CB 3.96Å |
| 249 | T | 77.2 | Confident | 78.2 | Confident | 78 Ų | 78 | 116 Ų | 116 | 48% | 0.479 | 57% | 0.565 | S | S | . | * | S | Bend | trans | -116.1 | -8.7 | 172.9 | 56.7 | 0 | 0 | 0 | 0 | 112.5 | L238 V246 | L238-T249 WeakPolarHBondContact CB-O 3.31Å; L238-T249 CarbonylContact O-C 3.55Å; V246-T249 HydrophobicContact CG1-CG2 3.61Å |
| 250 | K | 79.2 | Confident | 77.1 | Confident | 156 Ų | 156 | 120.3 Ų | 120.3 | 68% | 0.678 | 59% | 0.585 | S | S | * | * | S | Bend | trans | -117.2 | 7.7 | -174.7 | -56.6 | -60.7 | -178.5 | -179.5 | 0 | 113.6 | ||
| 251 | G | 76 | Confident | 75.9 | Confident | 28 Ų | 28 | 119 Ų | 119 | 29% | 0.289 | 59% | 0.585 | S | S | . | * | trans | 77.9 | 19.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | L238 | L238-G251 PolarHBondContact O-N 3.06Š| ||
| 252 | E | 81.4 | Confident | 74.7 | Confident | 113 Ų | 113 | 115.9 Ų | 115.9 | 53% | 0.528 | 58% | 0.583 | S | S | . | * | trans | -60.5 | 144.9 | 176.6 | -62.1 | 176.8 | 172.6 | 0 | 0 | 111.8 | T248 | T248-E252 HydrophobicContact CG2-CB 3.96Š| ||
| 253 | R | 73.8 | Confident | 73.7 | Confident | 208 Ų | 208 | 114.7 Ų | 114.7 | 79% | 0.785 | 58% | 0.58 | S | S | * | * | S | Bend | trans | -79.8 | -27.7 | -173.2 | -69.9 | -167 | -70.7 | -165 | -1.9 | 113.9 | ||
| 254 | Y | 79 | Confident | 72.8 | Confident | 203 Ų | 203 | 116 Ų | 116 | 80% | 0.796 | 57% | 0.572 | S | S | * | * | trans | -140.1 | 137.2 | -177.3 | -57.4 | -75.8 | 0 | 0 | 0 | 109.5 | ||||
| 255 | Q | 71.9 | Confident | 71.8 | Confident | 90 Ų | 90 | 114 Ų | 114 | 42% | 0.421 | 56% | 0.559 | S | S | . | * | trans | -120 | 130.4 | 171.8 | -167.2 | 116.9 | -6.5 | 0 | 0 | 109.2 | V247 V257 | V247-Q255 HydrophobicContact CG1-CB 3.34Å; V247-Q255 HydrophobicContact CG1-CG 3.41Å; V247-Q255 VanDerWaalsContact CG1-CG 3.41Å; V247-Q255 PolarHBondContact O-NE2 3.23Å; V247-Q255 PolarHBondContact O-OE1 3.05Å; Q255-V257 PolarHBondContact O-N 3.02Å | ||
| 256 | L | 74.6 | Confident | 70.9 | Confident | 145 Ų | 145 | 113.4 Ų | 113.4 | 76% | 0.759 | 55% | 0.554 | S | S | * | * | trans | -72.2 | 100.4 | 170.8 | -176.3 | 66.1 | 0 | 0 | 0 | 109 | K258 | L256-K258 HydrophobicContact CD2-CG 4.47Å; L256-K258 HydrophobicContact CG-CG 4.48Å; L256-K258 PolarHBondContact O-N 3.25Å | ||
| 257 | V | 73.9 | Confident | 70 | Confident | 97 Ų | 97 | 117.3 Ų | 117.3 | 59% | 0.588 | 57% | 0.565 | S | S | * | * | trans | -74.3 | 95.9 | 171.2 | -177.5 | 0 | 0 | 0 | 0 | 107.8 | Q255 K259 | Q255-V257 PolarHBondContact O-N 3.02Å; V257-K259 PolarHBondContact O-N 2.92Å | ||
| 258 | K | 72.4 | Confident | 69.2 | Low | 165 Ų | 165 | 121 Ų | 121 | 72% | 0.717 | 59% | 0.588 | S | S | * | * | trans | -68.5 | 114.8 | 166.2 | -72.1 | -176.4 | 179.6 | 178.4 | 0 | 107.3 | L256 N260 | L256-K258 HydrophobicContact CD2-CG 4.47Å; L256-K258 HydrophobicContact CG-CG 4.48Å; L256-K258 PolarHBondContact O-N 3.25Å; K258-N260 PolarHBondContact O-N 2.81Å; K258-N260 VanDerWaalsContact O-N 3.12Å | ||
| 259 | K | 69.4 | Low | 68.4 | Low | 179 Ų | 179 | 129 Ų | 129 | 78% | 0.778 | 62% | 0.619 | S | S | * | * | trans | -62.8 | 114.2 | 164.7 | -66.5 | -177 | 178.9 | 178.1 | 0 | 106.1 | V257 E261 | V257-K259 PolarHBondContact O-N 2.92Å; K259-E261 HydrophobicContact CB-CG 4.48Å; K259-E261 PolarHBondContact O-N 3.45Å | ||
| 260 | N | 61.1 | Low | 68 | Low | 158 Ų | 158 | 130.9 Ų | 130.9 | 85% | 0.845 | 63% | 0.63 | S | S | * | * | trans | -67.8 | 79.9 | 163.6 | -73.8 | -30.3 | 0 | 0 | 0 | 106.2 | K258 T262 | K258-N260 PolarHBondContact O-N 2.81Å; K258-N260 VanDerWaalsContact O-N 3.12Å; N260-T262 PolarHBondContact O-N 3.11Å; N260-T262 VanDerWaalsContact O-N 3.11Å | ||
| 261 | E | 57.7 | Low | 67.4 | Low | 104 Ų | 104 | 129.4 Ų | 129.4 | 49% | 0.486 | 63% | 0.63 | S | S | . | * | trans | -63.5 | 111.4 | 162.1 | -75 | -177.6 | 169.7 | 0 | 0 | 105.7 | K259 D263 | K259-E261 HydrophobicContact CB-CG 4.48Å; K259-E261 PolarHBondContact O-N 3.45Å; E261-D263 PolarHBondContact O-N 3.23Å | ||
| 262 | T | 60.5 | Low | 67 | Low | 91 Ų | 91 | 135.6 Ų | 135.6 | 56% | 0.558 | 66% | 0.655 | S | S | * | * | trans | -49.4 | 128.6 | 174.3 | -35.2 | 0 | 0 | 0 | 0 | 107.5 | N260 D264 M265 | N260-T262 PolarHBondContact O-N 3.11Å; N260-T262 VanDerWaalsContact O-N 3.11Å; T262-D264 PolarHBondContact O-N 3.38Å; T262-M265 PolarHBondContact O-N 3.38Å | ||
| 263 | D | 61.1 | Low | 66.8 | Low | 107 Ų | 107 | 139.6 Ų | 139.6 | 57% | 0.572 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.2 | -9.9 | -172.3 | -143.6 | 16.3 | 0 | 0 | 0 | 113.3 | E261 | E261-D263 PolarHBondContact O-N 3.23Š|
| 264 | D | 59.7 | Low | 66.7 | Low | 95 Ų | 95 | 135.5 Ų | 135.5 | 51% | 0.508 | 67% | 0.671 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -70.2 | -30 | 172.1 | -63.7 | -37.5 | 0 | 0 | 0 | 114.1 | T262 K266 K267 | T262-D264 PolarHBondContact O-N 3.38Å; D264-K266 VanDerWaalsContact C-N 3.26Å; D264-K266 PolarHBondContact O-N 3.34Å; D264-K267 PolarHBondContact O-N 2.91Å; D264-K267 IonicContact OD1-NZ 3.8Å; D264-K267 PolarHBondContact OD1-NZ 2.79Å |
| 265 | M | 60.8 | Low | 66.2 | Low | 123 Ų | 123 | 130.3 Ų | 130.3 | 61% | 0.606 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.9 | -25.2 | 178.5 | -73.5 | 175.3 | 61.1 | 0 | 0 | 112.7 | T262 | T262-M265 PolarHBondContact O-N 3.38Š|
| 266 | K | 61.5 | Low | 66.2 | Low | 130 Ų | 130 | 137.5 Ų | 137.5 | 57% | 0.565 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.6 | -21.8 | -179.8 | -65.7 | 179.1 | -174.9 | 166 | 0 | 113.3 | D264 | D264-K266 VanDerWaalsContact C-N 3.26Å; D264-K266 PolarHBondContact O-N 3.34Å |
| 267 | K | 62.4 | Low | 66.1 | Low | 148 Ų | 148 | 140.1 Ų | 140.1 | 64% | 0.643 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.4 | -23.9 | -179.2 | -61.1 | 173.1 | -168 | 160.2 | 0 | 112.7 | D264 Y269 | D264-K267 PolarHBondContact O-N 2.91Å; D264-K267 IonicContact OD1-NZ 3.8Å; D264-K267 PolarHBondContact OD1-NZ 2.79Å; K267-Y269 VanDerWaalsContact C-N 3.3Å; K267-Y269 PolarHBondContact O-N 2.86Å |
| 268 | T | 61.4 | Low | 65.6 | Low | 116 Ų | 116 | 144.8 Ų | 144.8 | 71% | 0.712 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.6 | -3.6 | -177.5 | -42.7 | 0 | 0 | 0 | 0 | 113 | V270 | T268-V270 PolarHBondContact O-N 3.08Š|
| 269 | Y | 61.6 | Low | 65.1 | Low | 175 Ų | 175 | 147.3 Ų | 147.3 | 69% | 0.686 | 71% | 0.712 | S | S | * | * | trans | -79.4 | 86.5 | -177.6 | -158.7 | -101 | 0 | 0 | 0 | 111.5 | K267 N271 | K267-Y269 VanDerWaalsContact C-N 3.3Å; K267-Y269 PolarHBondContact O-N 2.86Å; Y269-N271 WeakPolarHBondContact CE1-OD1 3.14Å; Y269-N271 PolarHBondContact O-N 3.47Å | ||
| 270 | V | 68.6 | Low | 64.7 | Low | 117 Ų | 117 | 147.5 Ų | 147.5 | 71% | 0.709 | 71% | 0.714 | S | S | * | * | trans | -81.3 | 106.6 | 172.3 | -179.5 | 0 | 0 | 0 | 0 | 109.2 | T268 L272 | T268-V270 PolarHBondContact O-N 3.08Å; V270-L272 HydrophobicContact CG1-CG 4.39Å; V270-L272 PolarHBondContact O-N 2.97Å; V270-L272 VanDerWaalsContact O-N 3.08Å | ||
| 271 | N | 65.8 | Low | 64.6 | Low | 126 Ų | 126 | 151.7 Ų | 151.7 | 67% | 0.674 | 73% | 0.728 | S | S | * | * | trans | -72.4 | 94.8 | 172.6 | -78.4 | -68 | 0 | 0 | 0 | 110.6 | Y269 K273 | Y269-N271 WeakPolarHBondContact CE1-OD1 3.14Å; Y269-N271 PolarHBondContact O-N 3.47Å; N271-K273 PolarHBondContact O-N 3.49Å | ||
| 272 | L | 68.8 | Low | 64.9 | Low | 157 Ų | 157 | 154.1 Ų | 154.1 | 82% | 0.822 | 74% | 0.74 | S | S | * | * | P | Polyproline II helix | trans | -75 | 120.8 | 171.3 | -73.1 | 162.8 | 0 | 0 | 0 | 109.8 | V270 | V270-L272 HydrophobicContact CG1-CG 4.39Å; V270-L272 PolarHBondContact O-N 2.97Å; V270-L272 VanDerWaalsContact O-N 3.08Å |
| 273 | K | 76.7 | Confident | 65.2 | Low | 197 Ų | 197 | 157.4 Ų | 157.4 | 86% | 0.857 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -64.2 | 141.6 | 175.8 | -72.2 | -176.2 | 178.3 | 175.9 | 0 | 110.3 | N271 | N271-K273 PolarHBondContact O-N 3.49Š|
| 274 | P | 72.9 | Confident | 65.4 | Low | 123 Ų | 123 | 160.2 Ų | 160.2 | 80% | 0.799 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 138.4 | 175.5 | -20.4 | 30.8 | 0 | 0 | 0 | 111.8 | R276 | P274-R276 PolarHBondContact O-N 3.47Š|
| 275 | A | 68.3 | Low | 65.7 | Low | 94 Ų | 94 | 164.1 Ų | 164.1 | 78% | 0.777 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 128.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | K277 | A275-K277 PolarHBondContact O-N 3.26Š|
| 276 | R | 72.2 | Confident | 66 | Low | 240 Ų | 240 | 166.6 Ų | 166.6 | 91% | 0.906 | 79% | 0.785 | S | S | * | * | trans | -64.5 | 113.7 | 173.7 | -93.6 | 178.5 | 161.4 | 168.6 | -6.3 | 109.3 | P274 Y278 | P274-R276 PolarHBondContact O-N 3.47Å; R276-Y278 PolarHBondContact O-N 3.18Å | ||
| 277 | K | 71.8 | Confident | 66.3 | Low | 200 Ų | 200 | 169.1 Ų | 169.1 | 87% | 0.87 | 80% | 0.799 | S | S | * | * | trans | -73.2 | 109.7 | 170.4 | -64 | -169.8 | 178.8 | -174.3 | 0 | 108.8 | A275 R279 | A275-K277 PolarHBondContact O-N 3.26Å; K277-R279 PolarHBondContact O-N 3.4Å | ||
| 278 | Y | 63.2 | Low | 66.6 | Low | 195 Ų | 195 | 170.6 Ų | 170.6 | 77% | 0.765 | 81% | 0.81 | S | S | * | * | trans | -69 | 122.5 | 167 | -111.3 | -98.3 | 0 | 0 | 0 | 108.5 | R276 F280 | R276-Y278 PolarHBondContact O-N 3.18Å; Y278-F280 HydrophobicContact CD1-CE2 4.13Å; Y278-F280 HydrophobicContact CD1-CZ 4.21Å | ||
| 279 | R | 61.5 | Low | 67 | Low | 218 Ų | 218 | 174.8 Ų | 174.8 | 82% | 0.823 | 82% | 0.818 | S | S | * | * | trans | -95.5 | 109.9 | 166.9 | -82.3 | -174.7 | 164.9 | 171.3 | -4.2 | 107.4 | K277 | K277-R279 PolarHBondContact O-N 3.4Š| ||
| 280 | F | 61.9 | Low | 67.5 | Low | 184 Ų | 184 | 174.8 Ų | 174.8 | 81% | 0.807 | 83% | 0.829 | S | S | * | * | trans | -79.9 | 124.7 | 163.3 | -75.5 | -86.6 | 0 | 0 | 0 | 107.5 | Y278 | Y278-F280 HydrophobicContact CD1-CE2 4.13Å; Y278-F280 HydrophobicContact CD1-CZ 4.21Å | ||
| 281 | H | 58.2 | Low | 67.4 | Low | 246 Ų | 246 | 180 Ų | 180 | 100% | 1.139 | 84% | 0.84 | S | S | * | * | trans | -86.8 | 0 | 169.3 | -77.7 | -69 | 0 | 0 | 0 | 109.5 |
Retrieved 281 of 281 residues in 259.9 ms
(Link to these results)