| 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 | 84.1 | Confident | 90.8 | Very high | 128 Ų | 128 | 89.4 Ų | 89.4 | 63% | 0.631 | 48% | 0.479 | S | S | * | . | 0 | -42.8 | 0 | -71.4 | -57.5 | -74.5 | 0 | 0 | 113.1 | A3 L4 R5 | M1-A3 PolarHBondContact O-N 3.38Å; M1-L4 PolarHBondContact O-N 3.17Å; M1-R5 PolarHBondContact O-N 3.27Å | |||
| 2 | L | 88.1 | Confident | 91.3 | Very high | 131 Ų | 131 | 83.4 Ų | 83.4 | 69% | 0.686 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -55 | -49.6 | 179.8 | -175.6 | 63.9 | 0 | 0 | 0 | 113.8 | L4 R5 L6 | L2-L4 VanDerWaalsContact C-N 3.32Å; L2-L4 PolarHBondContact O-N 2.71Å; L2-R5 PolarHBondContact O-N 2.58Å; L2-R5 VanDerWaalsContact O-N 3.08Å; L2-L6 HydrophobicContact CG-CD1 4.17Å; L2-L6 PolarHBondContact O-N 3.35Å |
| 3 | A | 90.3 | Very high | 91.7 | Very high | 75 Ų | 75 | 80.6 Ų | 80.6 | 62% | 0.62 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -57.2 | -40.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | M1 R5 L6 L7 | M1-A3 PolarHBondContact O-N 3.38Å; A3-R5 VanDerWaalsContact C-N 3.35Å; A3-L6 PolarHBondContact O-N 3.15Å; A3-L7 WeakPolarHBondContact O-CB 2.87Å; A3-L7 PolarHBondContact O-N 3.44Å |
| 4 | L | 88.6 | Confident | 92.1 | Very high | 73 Ų | 73 | 81.7 Ų | 81.7 | 38% | 0.382 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -68.8 | -34.7 | 178.2 | -62.6 | 175 | 0 | 0 | 0 | 112 | M1 L2 N8 V99 F112 | M1-L4 PolarHBondContact O-N 3.17Å; L2-L4 VanDerWaalsContact C-N 3.32Å; L2-L4 PolarHBondContact O-N 2.71Å; L4-N8 PolarHBondContact O-N 2.81Å; L4-V99 HydrophobicContact CB-CG2 4.32Å; L4-V99 HydrophobicContact CD1-CG2 4.39Å; L4-F112 HydrophobicContact CD2-CE1 4.42Å; L4-F112 HydrophobicContact CD2-CZ 3.92Å |
| 5 | R | 87.1 | Confident | 92.4 | Very high | 166 Ų | 166 | 77.5 Ų | 77.5 | 63% | 0.626 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -70.5 | -40.9 | 175.1 | -69.5 | -176.5 | 176.2 | 179.3 | -1.7 | 111.5 | M1 L2 A3 L7 N8 | M1-R5 PolarHBondContact O-N 3.27Å; L2-R5 PolarHBondContact O-N 2.58Å; L2-R5 VanDerWaalsContact O-N 3.08Å; A3-R5 VanDerWaalsContact C-N 3.35Å; R5-L7 VanDerWaalsContact C-N 3.34Å; R5-N8 VanDerWaalsContact O-CB 3.29Å; R5-N8 WeakPolarHBondContact O-CB 3.07Å; R5-N8 PolarHBondContact O-N 2.06Å |
| 6 | L | 91.6 | Very high | 92.7 | Very high | 98 Ų | 98 | 77.8 Ų | 77.8 | 51% | 0.513 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -60.3 | -45.3 | 173.3 | -72.1 | 172.2 | 0 | 0 | 0 | 111.1 | L2 A3 N8 V9 V10 | L2-L6 HydrophobicContact CG-CD1 4.17Å; L2-L6 PolarHBondContact O-N 3.35Å; A3-L6 PolarHBondContact O-N 3.15Å; L6-N8 PolarHBondContact O-N 3.03Å; L6-V9 PolarHBondContact O-N 3.26Å; L6-V10 WeakPolarHBondContact O-CG2 3.12Å; L6-V10 PolarHBondContact O-N 3.5Å |
| 7 | L | 92.7 | Very high | 93.1 | Very high | 73 Ų | 73 | 77.6 Ų | 77.6 | 38% | 0.382 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -61.1 | -30.4 | 177.9 | -169.5 | 61.4 | 0 | 0 | 0 | 112.3 | A3 R5 V9 A11 F112 | A3-L7 WeakPolarHBondContact O-CB 2.87Å; A3-L7 PolarHBondContact O-N 3.44Å; R5-L7 VanDerWaalsContact C-N 3.34Å; L7-V9 PolarHBondContact O-N 3.31Å; L7-A11 HydrophobicContact CD1-CB 4.29Å; L7-A11 WeakPolarHBondContact O-CB 3.28Å; L7-A11 PolarHBondContact O-N 3.32Å; L7-A11 VanDerWaalsContact O-N 3.14Å; L7-F112 HydrophobicContact CB-CD1 3.86Å; L7-F112 HydrophobicContact CB-CE1 4.18Å; L7-F112 HydrophobicContact CB-CG 4.39Å; L7-F112 HydrophobicContact CD2-CB 4.19Å; L7-F112 HydrophobicContact CD2-CD1 3.72Å; L7-F112 HydrophobicContact CD2-CD2 3.59Å; L7-F112 HydrophobicContact CD2-CE1 3.94Å; L7-F112 HydrophobicContact CD2-CE2 3.83Å; L7-F112 HydrophobicContact CD2-CG 3.54Å; L7-F112 HydrophobicContact CD2-CZ 4Å; L7-F112 HydrophobicContact CG-CB 3.89Å; L7-F112 HydrophobicContact CG-CD1 3.64Å; L7-F112 HydrophobicContact CG-CD2 4.22Å; L7-F112 HydrophobicContact CG-CE1 4.22Å; L7-F112 HydrophobicContact CG-CG 3.64Å |
| 8 | N | 91.7 | Very high | 93.3 | Very high | 43 Ų | 43 | 74.7 Ų | 74.7 | 23% | 0.23 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -68.6 | -10.1 | 175.6 | -150.2 | 58.4 | 0 | 0 | 0 | 114.3 | L4 R5 L6 P12 H110 G115 | L4-N8 PolarHBondContact O-N 2.81Å; R5-N8 VanDerWaalsContact O-CB 3.29Å; R5-N8 WeakPolarHBondContact O-CB 3.07Å; R5-N8 PolarHBondContact O-N 2.06Å; L6-N8 PolarHBondContact O-N 3.03Å; N8-P12 WeakPolarHBondContact O-CG 3.5Å; N8-H110 PolarHBondContact OD1-CE1 3.39Å; N8-H110 VanDerWaalsContact OD1-CE1 3.28Å; N8-H110 PolarHBondContact OD1-NE2 2.87Å; N8-G115 PolarHBondContact ND2-O 3.4Å; N8-G115 VanDerWaalsContact OD1-CA 3.24Å; N8-G115 WeakPolarHBondContact OD1-CA 3.5Å; N8-G115 PolarHBondContact OD1-O 3.27Å |
| 9 | V | 92.3 | Very high | 93.5 | Very high | 100 Ų | 100 | 72.4 Ų | 72.4 | 61% | 0.606 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -113.3 | -42.8 | 177.4 | -179.7 | 0 | 0 | 0 | 0 | 110.7 | L6 L7 P12 A13 | L6-V9 PolarHBondContact O-N 3.26Å; L7-V9 PolarHBondContact O-N 3.31Å; V9-P12 WeakPolarHBondContact O-CD 3.4Å; V9-A13 VanDerWaalsContact O-CB 3.31Å; V9-A13 WeakPolarHBondContact O-CB 3.42Å; V9-A13 PolarHBondContact O-N 3.08Å; V9-A13 VanDerWaalsContact O-N 3.14Å |
| 10 | V | 96.3 | Very high | 93.8 | Very high | 89 Ų | 89 | 74.5 Ų | 74.5 | 54% | 0.539 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -67 | -43 | -178.1 | 173.9 | 0 | 0 | 0 | 0 | 111.7 | L6 A13 Y14 | L6-V10 WeakPolarHBondContact O-CG2 3.12Å; L6-V10 PolarHBondContact O-N 3.5Å; V10-A13 PolarHBondContact O-N 3.29Å; V10-Y14 VanDerWaalsContact O-CB 3.3Å; V10-Y14 WeakPolarHBondContact O-CB 3.41Å; V10-Y14 PolarHBondContact O-N 3.03Å |
| 11 | A | 96.2 | Very high | 94 | Very high | 7 Ų | 7 | 73 Ų | 73 | 6% | 0.058 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -67.9 | -42.7 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | L7 Y14 F15 F112 F113 | L7-A11 HydrophobicContact CD1-CB 4.29Å; L7-A11 WeakPolarHBondContact O-CB 3.28Å; L7-A11 PolarHBondContact O-N 3.32Å; L7-A11 VanDerWaalsContact O-N 3.14Å; A11-Y14 PolarHBondContact O-N 2.77Å; A11-F15 PolarHBondContact O-N 3.41Å; A11-F112 HydrophobicContact CB-CB 3.99Å; A11-F113 HydrophobicContact CB-CD1 3.99Å; A11-F113 HydrophobicContact CB-CE1 4.26Å; A11-F113 HydrophobicContact CB-CG 4.33Å |
| 12 | P | 96.8 | Very high | 94.6 | Very high | 18 Ų | 18 | 67.6 Ų | 67.6 | 12% | 0.117 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -61.2 | -45 | 170.9 | -27.5 | 38.9 | 0 | 0 | 0 | 112.8 | N8 V9 Y14 F15 L16 Y65 F112 F113 | N8-P12 WeakPolarHBondContact O-CG 3.5Å; V9-P12 WeakPolarHBondContact O-CD 3.4Å; P12-Y14 PolarHBondContact O-N 2.93Å; P12-F15 PolarHBondContact O-N 2.98Å; P12-L16 WeakPolarHBondContact O-CG 3.44Å; P12-L16 PolarHBondContact O-N 3.45Å; P12-Y65 WeakPolarHBondContact CB-OH 3.29Å; P12-F112 WeakPolarHBondContact CD-O 3.29Å; P12-F112 VanDerWaalsContact CG-O 3.23Å; P12-F112 WeakPolarHBondContact CG-O 3.39Å; P12-F113 WeakPolarHBondContact CA-O 3.42Å |
| 13 | A | 97 | Very high | 95.1 | Very high | 47 Ų | 47 | 64.7 Ų | 64.7 | 39% | 0.388 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -60.3 | -45.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | V9 V10 F15 L16 C17 | V9-A13 VanDerWaalsContact O-CB 3.31Å; V9-A13 WeakPolarHBondContact O-CB 3.42Å; V9-A13 PolarHBondContact O-N 3.08Å; V9-A13 VanDerWaalsContact O-N 3.14Å; V10-A13 PolarHBondContact O-N 3.29Å; A13-F15 PolarHBondContact O-N 3.26Å; A13-L16 PolarHBondContact O-N 3.31Å; A13-C17 WeakPolarHBondContact O-CB 3.24Å; A13-C17 PolarHBondContact O-N 3.5Å; A13-C17 PolarHBondContact O-SG 3.36Å |
| 14 | Y | 97.2 | Very high | 95.4 | Very high | 96 Ų | 96 | 64.3 Ų | 64.3 | 38% | 0.376 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -56.1 | -49.6 | 174.3 | 170.9 | -99.8 | 0 | 0 | 0 | 111.9 | V10 A11 P12 L16 C17 I18 F113 I195 | V10-Y14 VanDerWaalsContact O-CB 3.3Å; V10-Y14 WeakPolarHBondContact O-CB 3.41Å; V10-Y14 PolarHBondContact O-N 3.03Å; A11-Y14 PolarHBondContact O-N 2.77Å; P12-Y14 PolarHBondContact O-N 2.93Å; Y14-L16 PolarHBondContact O-N 3.42Å; Y14-C17 PolarHBondContact O-N 3.41Å; Y14-I18 HydrophobicContact CD2-CG1 4.11Å; Y14-I18 HydrophobicContact CE1-CG1 4.22Å; Y14-I18 HydrophobicContact CE2-CD1 4.06Å; Y14-I18 HydrophobicContact CE2-CG1 3.68Å; Y14-I18 WeakPolarHBondContact O-CG1 3.44Å; Y14-I18 PolarHBondContact O-N 3.47Å; Y14-F113 HydrophobicContact CD1-CE1 4.16Å; Y14-I195 HydrophobicContact CE1-CD1 4.41Å |
| 15 | F | 96.8 | Very high | 95.8 | Very high | 18 Ų | 18 | 61.6 Ų | 61.6 | 8% | 0.079 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -59.9 | -45.9 | 179.4 | 170.6 | -101.6 | 0 | 0 | 0 | 112.5 | A11 P12 A13 I18 S19 L62 Y65 F113 F129 T133 | A11-F15 PolarHBondContact O-N 3.41Å; P12-F15 PolarHBondContact O-N 2.98Å; A13-F15 PolarHBondContact O-N 3.26Å; F15-I18 PolarHBondContact O-N 3.46Å; F15-S19 WeakPolarHBondContact O-CB 3.47Å; F15-S19 PolarHBondContact O-N 2.7Å; F15-S19 PolarHBondContact O-OG 2.63Å; F15-L62 HydrophobicContact CE1-CD2 4.1Å; F15-L62 HydrophobicContact CZ-CD2 4.34Å; F15-Y65 AromaticContact CD1-CD2 3.84Å; F15-Y65 HydrophobicContact CD1-CD2 3.84Å; F15-Y65 HydrophobicContact CD1-CE1 4.39Å; F15-Y65 AromaticContact CD1-CE2 3.52Å; F15-Y65 HydrophobicContact CD1-CE2 3.52Å; F15-Y65 HydrophobicContact CD1-CG 4.39Å; F15-Y65 AromaticContact CD1-CZ 3.83Å; F15-Y65 HydrophobicContact CE1-CD1 4.21Å; F15-Y65 AromaticContact CE1-CD2 3.51Å; F15-Y65 HydrophobicContact CE1-CD2 3.51Å; F15-Y65 HydrophobicContact CE1-CE1 4.39Å; F15-Y65 AromaticContact CE1-CE2 3.71Å; F15-Y65 HydrophobicContact CE1-CE2 3.71Å; F15-Y65 AromaticContact CE1-CG 3.78Å; F15-Y65 HydrophobicContact CE1-CG 3.78Å; F15-Y65 HydrophobicContact CG-CE2 4.4Å; F15-Y65 HydrophobicContact CZ-CD2 4.27Å; F15-F113 HydrophobicContact CB-CD1 4.45Å; F15-F129 HydrophobicContact CD2-CZ 4.5Å; F15-F129 HydrophobicContact CE1-CE2 4.08Å; F15-F129 AromaticContact CE2-CE2 3.73Å; F15-F129 HydrophobicContact CE2-CE2 3.73Å; F15-F129 HydrophobicContact CE2-CZ 4.09Å; F15-F129 HydrophobicContact CZ-CD2 4.48Å; F15-F129 AromaticContact CZ-CE2 3.49Å; F15-F129 HydrophobicContact CZ-CE2 3.49Å; F15-F129 VanDerWaalsContact CZ-CE2 3.49Å; F15-F129 HydrophobicContact CZ-CZ 4.18Å; F15-T133 HydrophobicContact CE2-CG2 4.09Å |
| 16 | L | 97.4 | Very high | 96.2 | Very high | 82 Ų | 82 | 53.7 Ų | 53.7 | 43% | 0.429 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -67.2 | -40.7 | 179.2 | -67.4 | 174.3 | 0 | 0 | 0 | 111.9 | P12 A13 Y14 S19 L20 L62 Y65 | P12-L16 WeakPolarHBondContact O-CG 3.44Å; P12-L16 PolarHBondContact O-N 3.45Å; A13-L16 PolarHBondContact O-N 3.31Å; Y14-L16 PolarHBondContact O-N 3.42Å; L16-S19 PolarHBondContact O-N 3.5Å; L16-L20 WeakPolarHBondContact O-CB 3.37Å; L16-L20 PolarHBondContact O-N 3.4Å; L16-L62 HydrophobicContact CD2-CD2 4.45Å; L16-Y65 HydrophobicContact CD2-CE1 4.04Å |
| 17 | C | 98.1 | Very high | 96.2 | Very high | 76 Ų | 76 | 52 Ų | 52 | 51% | 0.514 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -61.3 | -48.3 | 175 | -74.7 | 0 | 0 | 0 | 0 | 111.7 | A13 Y14 S19 L20 V21 | A13-C17 WeakPolarHBondContact O-CB 3.24Å; A13-C17 PolarHBondContact O-N 3.5Å; A13-C17 PolarHBondContact O-SG 3.36Å; Y14-C17 PolarHBondContact O-N 3.41Å; C17-S19 VanDerWaalsContact C-N 3.3Å; C17-S19 PolarHBondContact O-N 2.93Å; C17-L20 PolarHBondContact O-N 3.18Å; C17-V21 WeakPolarHBondContact O-CG2 3.42Å; C17-V21 PolarHBondContact O-N 3.28Å |
| 18 | I | 97.7 | Very high | 96.2 | Very high | 24 Ų | 24 | 55.9 Ų | 55.9 | 12% | 0.123 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -62.7 | -39.2 | 177.2 | -67.5 | -62.1 | 0 | 0 | 0 | 111 | Y14 F15 V21 T22 M188 L191 I195 | Y14-I18 HydrophobicContact CD2-CG1 4.11Å; Y14-I18 HydrophobicContact CE1-CG1 4.22Å; Y14-I18 HydrophobicContact CE2-CD1 4.06Å; Y14-I18 HydrophobicContact CE2-CG1 3.68Å; Y14-I18 WeakPolarHBondContact O-CG1 3.44Å; Y14-I18 PolarHBondContact O-N 3.47Å; F15-I18 PolarHBondContact O-N 3.46Å; I18-V21 PolarHBondContact O-N 2.9Å; I18-T22 VanDerWaalsContact O-CB 3.32Å; I18-T22 WeakPolarHBondContact O-CB 3.31Å; I18-T22 PolarHBondContact O-N 2.85Å; I18-T22 PolarHBondContact O-OG1 2.94Å; I18-M188 HydrophobicContact CD1-SD 4.34Å; I18-M188 HydrophobicContact CG2-CE 4.35Å; I18-L191 HydrophobicContact CD1-CD1 4.09Å; I18-I195 HydrophobicContact CG2-CD1 3.93Å |
| 19 | S | 97.6 | Very high | 96.3 | Very high | 32 Ų | 32 | 56.1 Ų | 56.1 | 22% | 0.224 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -62.6 | -43.8 | 176.6 | -60.2 | 0 | 0 | 0 | 0 | 111.7 | F15 L16 C17 T22 F23 | F15-S19 WeakPolarHBondContact O-CB 3.47Å; F15-S19 PolarHBondContact O-N 2.7Å; F15-S19 PolarHBondContact O-OG 2.63Å; L16-S19 PolarHBondContact O-N 3.5Å; C17-S19 VanDerWaalsContact C-N 3.3Å; C17-S19 PolarHBondContact O-N 2.93Å; S19-T22 PolarHBondContact O-N 3.44Å; S19-F23 WeakPolarHBondContact O-CB 3.37Å; S19-F23 PolarHBondContact O-N 3.26Å |
| 20 | L | 98.1 | Very high | 96.3 | Very high | 113 Ų | 113 | 51.4 Ų | 51.4 | 59% | 0.592 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -63.3 | -48.7 | 176.3 | 177.4 | 62.4 | 0 | 0 | 0 | 111.7 | L16 C17 T22 F23 V24 | L16-L20 WeakPolarHBondContact O-CB 3.37Å; L16-L20 PolarHBondContact O-N 3.4Å; C17-L20 PolarHBondContact O-N 3.18Å; L20-T22 VanDerWaalsContact C-N 3.28Å; L20-T22 PolarHBondContact O-N 3.44Å; L20-F23 WeakPolarHBondContact O-CB 3.13Å; L20-F23 PolarHBondContact O-N 3.14Å; L20-F23 VanDerWaalsContact O-N 3.16Å; L20-V24 HydrophobicContact CD1-CG2 4.4Å; L20-V24 WeakPolarHBondContact O-CG2 3.4Å; L20-V24 PolarHBondContact O-N 3Å |
| 21 | V | 98.3 | Very high | 96 | Very high | 45 Ų | 45 | 48 Ų | 48 | 27% | 0.273 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -57.8 | -44.4 | 176.6 | 168 | 0 | 0 | 0 | 0 | 110.7 | C17 I18 F23 V24 L25 F184 M188 | C17-V21 WeakPolarHBondContact O-CG2 3.42Å; C17-V21 PolarHBondContact O-N 3.28Å; I18-V21 PolarHBondContact O-N 2.9Å; V21-F23 VanDerWaalsContact C-N 3.33Å; V21-F23 PolarHBondContact O-N 3.07Å; V21-V24 PolarHBondContact O-N 2.86Å; V21-L25 HydrophobicContact CG1-CD1 4.04Å; V21-L25 HydrophobicContact CG1-CG 4.42Å; V21-L25 WeakPolarHBondContact O-CG 3.23Å; V21-L25 PolarHBondContact O-N 3.27Å; V21-F184 HydrophobicContact CG1-CE1 3.97Å; V21-F184 HydrophobicContact CG1-CZ 3.55Å; V21-M188 HydrophobicContact CG1-CE 3.83Å; V21-M188 HydrophobicContact CG1-CG 4.42Å; V21-M188 HydrophobicContact CG1-SD 3.84Å |
| 22 | T | 98 | Very high | 95.7 | Very high | 14 Ų | 14 | 50.6 Ų | 50.6 | 9% | 0.086 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -61.1 | -43.5 | 177.4 | -55.8 | 0 | 0 | 0 | 0 | 111.2 | I18 S19 L20 L25 Q26 F54 S140 W192 | I18-T22 VanDerWaalsContact O-CB 3.32Å; I18-T22 WeakPolarHBondContact O-CB 3.31Å; I18-T22 PolarHBondContact O-N 2.85Å; I18-T22 PolarHBondContact O-OG1 2.94Å; S19-T22 PolarHBondContact O-N 3.44Å; L20-T22 VanDerWaalsContact C-N 3.28Å; L20-T22 PolarHBondContact O-N 3.44Å; T22-L25 PolarHBondContact O-N 3.48Å; T22-Q26 WeakPolarHBondContact O-CB 3.35Å; T22-Q26 PolarHBondContact O-N 3.07Å; T22-F54 HydrophobicContact CG2-CE2 4.18Å; T22-F54 HydrophobicContact CG2-CZ 4.25Å; T22-S140 WeakPolarHBondContact CG2-OG 3.4Å; T22-W192 HydrophobicContact CG2-CZ2 3.89Å; T22-W192 PolarHBondContact OG1-NE1 3.47Å |
| 23 | F | 97.3 | Very high | 95.2 | Very high | 70 Ų | 70 | 52.3 Ų | 52.3 | 31% | 0.307 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -61.9 | -43.6 | 176.9 | -164.2 | -91.5 | 0 | 0 | 0 | 112 | S19 L20 V21 Q26 L27 F54 L55 | S19-F23 WeakPolarHBondContact O-CB 3.37Å; S19-F23 PolarHBondContact O-N 3.26Å; L20-F23 WeakPolarHBondContact O-CB 3.13Å; L20-F23 PolarHBondContact O-N 3.14Å; L20-F23 VanDerWaalsContact O-N 3.16Å; V21-F23 VanDerWaalsContact C-N 3.33Å; V21-F23 PolarHBondContact O-N 3.07Å; F23-Q26 PolarHBondContact O-N 3.34Å; F23-L27 HydrophobicContact CD1-CD1 3.74Å; F23-L27 HydrophobicContact CD1-CG 4.17Å; F23-L27 HydrophobicContact CE1-CD1 3.24Å; F23-L27 HydrophobicContact CE1-CG 3.98Å; F23-L27 HydrophobicContact CZ-CD1 3.95Å; F23-L27 HydrophobicContact CZ-CG 4.48Å; F23-L27 WeakPolarHBondContact O-CG 3.1Å; F23-L27 PolarHBondContact O-N 3.21Å; F23-F54 HydrophobicContact CB-CE1 4.47Å; F23-F54 HydrophobicContact CD2-CD1 4.49Å; F23-F54 AromaticContact CD2-CE1 3.51Å; F23-F54 HydrophobicContact CD2-CE1 3.51Å; F23-F54 HydrophobicContact CD2-CZ 4.15Å; F23-F54 HydrophobicContact CE2-CE1 4.01Å; F23-F54 HydrophobicContact CG-CE1 4.19Å; F23-L55 HydrophobicContact CE2-CD2 3.72Å; F23-L55 HydrophobicContact CZ-CD2 3.84Å |
| 24 | V | 97.4 | Very high | 94.5 | Very high | 66 Ų | 66 | 52.4 Ų | 52.4 | 40% | 0.4 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -62.5 | -48.8 | 175.7 | 170.6 | 0 | 0 | 0 | 0 | 111 | L20 V21 Q26 L27 F28 | L20-V24 HydrophobicContact CD1-CG2 4.4Å; L20-V24 WeakPolarHBondContact O-CG2 3.4Å; L20-V24 PolarHBondContact O-N 3Å; V21-V24 PolarHBondContact O-N 2.86Å; V24-Q26 VanDerWaalsContact C-N 3.29Å; V24-Q26 PolarHBondContact O-N 3.46Å; V24-L27 PolarHBondContact O-N 2.78Å; V24-F28 HydrophobicContact CB-CD2 4.44Å; V24-F28 HydrophobicContact CG1-CD2 3.9Å; V24-F28 WeakPolarHBondContact O-CB 3.25Å; V24-F28 WeakPolarHBondContact O-CD2 3.48Å; V24-F28 PolarHBondContact O-N 3.49Å |
| 25 | L | 96.6 | Very high | 93.5 | Very high | 16 Ų | 16 | 57 Ų | 57 | 8% | 0.084 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -59.2 | -41.3 | 177.4 | -72 | 174.3 | 0 | 0 | 0 | 111.7 | V21 T22 L29 F30 F184 M188 W192 | V21-L25 HydrophobicContact CG1-CD1 4.04Å; V21-L25 HydrophobicContact CG1-CG 4.42Å; V21-L25 WeakPolarHBondContact O-CG 3.23Å; V21-L25 PolarHBondContact O-N 3.27Å; T22-L25 PolarHBondContact O-N 3.48Å; L25-L29 HydrophobicContact CD2-CB 4.44Å; L25-L29 HydrophobicContact CD2-CD2 3.88Å; L25-L29 WeakPolarHBondContact O-CA 3.45Å; L25-L29 WeakPolarHBondContact O-CB 3.21Å; L25-L29 PolarHBondContact O-N 3.3Å; L25-F30 HydrophobicContact CB-CE2 4.36Å; L25-F30 PolarHBondContact O-N 3.28Å; L25-F184 HydrophobicContact CD1-CE1 4.05Å; L25-F184 HydrophobicContact CD2-CE1 4.18Å; L25-F184 HydrophobicContact CG-CE1 4.44Å; L25-M188 HydrophobicContact CD1-CB 4.18Å; L25-M188 HydrophobicContact CD1-CE 4.41Å; L25-M188 HydrophobicContact CD1-CG 3.89Å; L25-W192 HydrophobicContact CD1-CH2 3.81Å; L25-W192 HydrophobicContact CD1-CZ2 3.84Å |
| 26 | Q | 95.1 | Very high | 91.9 | Very high | 0 Ų | 0 | 64.9 Ų | 64.9 | 0% | 0 | 33% | 0.333 | C | S | . | . | I | π-helix | trans | -64 | -47.7 | 177.6 | -171.4 | 68.1 | 30.3 | 0 | 0 | 111.9 | T22 F23 V24 L31 F54 | T22-Q26 WeakPolarHBondContact O-CB 3.35Å; T22-Q26 PolarHBondContact O-N 3.07Å; F23-Q26 PolarHBondContact O-N 3.34Å; V24-Q26 VanDerWaalsContact C-N 3.29Å; V24-Q26 PolarHBondContact O-N 3.46Å; Q26-L31 HydrophobicContact CG-CD1 4.26Å; Q26-L31 HydrophobicContact CG-CG 4.14Å; Q26-L31 WeakPolarHBondContact O-CB 3.24Å; Q26-L31 VanDerWaalsContact O-CG 3.24Å; Q26-L31 WeakPolarHBondContact O-CG 3.47Å; Q26-L31 PolarHBondContact O-N 3.28Å; Q26-F54 HydrophobicContact CB-CD1 3.97Å; Q26-F54 HydrophobicContact CB-CD2 4.37Å; Q26-F54 HydrophobicContact CB-CE1 3.65Å; Q26-F54 HydrophobicContact CB-CE2 4.11Å; Q26-F54 HydrophobicContact CB-CG 4.3Å; Q26-F54 HydrophobicContact CB-CZ 3.74Å; Q26-F54 HydrophobicContact CG-CB 4.13Å; Q26-F54 HydrophobicContact CG-CD1 3.55Å; Q26-F54 HydrophobicContact CG-CD2 3.92Å; Q26-F54 HydrophobicContact CG-CE1 3.8Å; Q26-F54 HydrophobicContact CG-CE2 4.18Å; Q26-F54 HydrophobicContact CG-CG 3.59Å; Q26-F54 HydrophobicContact CG-CZ 4.12Å |
| 27 | L | 92.5 | Very high | 89.9 | Confident | 64 Ų | 64 | 65.6 Ų | 65.6 | 34% | 0.335 | 34% | 0.337 | S | S | . | . | I | π-helix | trans | -72.3 | -38.4 | -175.1 | -70.7 | -169.2 | 0 | 0 | 0 | 113.7 | F23 V24 L31 P32 | F23-L27 HydrophobicContact CD1-CD1 3.74Å; F23-L27 HydrophobicContact CD1-CG 4.17Å; F23-L27 HydrophobicContact CE1-CD1 3.24Å; F23-L27 HydrophobicContact CE1-CG 3.98Å; F23-L27 HydrophobicContact CZ-CD1 3.95Å; F23-L27 HydrophobicContact CZ-CG 4.48Å; F23-L27 WeakPolarHBondContact O-CG 3.1Å; F23-L27 PolarHBondContact O-N 3.21Å; V24-L27 PolarHBondContact O-N 2.78Å; L27-L31 HydrophobicContact CD2-CD1 3.91Å; L27-P32 VanDerWaalsContact O-CD 3.28Å; L27-P32 WeakPolarHBondContact O-CD 3.38Å; L27-P32 WeakPolarHBondContact O-CG 3.33Å |
| 28 | F | 92.9 | Very high | 87.9 | Confident | 154 Ų | 154 | 68.6 Ų | 68.6 | 68% | 0.675 | 36% | 0.355 | S | S | * | . | I | π-helix | trans | -107.4 | -15.4 | -169.1 | -64 | -75.6 | 0 | 0 | 0 | 114 | V24 | V24-F28 HydrophobicContact CB-CD2 4.44Å; V24-F28 HydrophobicContact CG1-CD2 3.9Å; V24-F28 WeakPolarHBondContact O-CB 3.25Å; V24-F28 WeakPolarHBondContact O-CD2 3.48Å; V24-F28 PolarHBondContact O-N 3.49Å |
| 29 | L | 92.9 | Very high | 85.9 | Confident | 47 Ų | 47 | 71.4 Ų | 71.4 | 25% | 0.246 | 38% | 0.382 | C | S | . | . | I | π-helix | trans | -115.2 | -59 | 179.5 | -162.6 | 66.7 | 0 | 0 | 0 | 111.8 | L25 S33 Y147 V185 | L25-L29 HydrophobicContact CD2-CB 4.44Å; L25-L29 HydrophobicContact CD2-CD2 3.88Å; L25-L29 WeakPolarHBondContact O-CA 3.45Å; L25-L29 WeakPolarHBondContact O-CB 3.21Å; L25-L29 PolarHBondContact O-N 3.3Å; L29-S33 PolarHBondContact O-N 2.88Å; L29-Y147 HydrophobicContact CD1-CE2 3.92Å; L29-Y147 WeakPolarHBondContact CD1-OH 3.21Å; L29-Y147 HydrophobicContact CD2-CD1 4.49Å; L29-Y147 HydrophobicContact CD2-CE1 4.04Å; L29-Y147 HydrophobicContact CD2-CE2 4.36Å; L29-Y147 HydrophobicContact CG-CD2 4.29Å; L29-Y147 HydrophobicContact CG-CE1 4.3Å; L29-Y147 HydrophobicContact CG-CE2 3.73Å; L29-V185 HydrophobicContact CD2-CG2 3.6Å |
| 30 | F | 92.8 | Very high | 83.8 | Confident | 1 Ų | 1 | 72.1 Ų | 72.1 | 0% | 0.004 | 39% | 0.39 | C | S | . | . | I | π-helix | trans | -78.9 | -45.8 | -171 | -56.7 | -26.7 | 0 | 0 | 0 | 113.5 | L25 S33 M34 A143 Y147 V185 W192 | L25-F30 HydrophobicContact CB-CE2 4.36Å; L25-F30 PolarHBondContact O-N 3.28Å; F30-S33 PolarHBondContact O-N 2.94Å; F30-S33 PolarHBondContact O-OG 3.38Å; F30-M34 HydrophobicContact CB-CE 4.02Å; F30-M34 WeakPolarHBondContact O-CE 3.14Å; F30-M34 WeakPolarHBondContact O-CG 3.06Å; F30-M34 PolarHBondContact O-N 3.41Å; F30-A143 HydrophobicContact CB-CB 4.41Å; F30-A143 HydrophobicContact CD2-CB 3.81Å; F30-A143 HydrophobicContact CE2-CB 4.33Å; F30-A143 HydrophobicContact CG-CB 4.25Å; F30-Y147 HydrophobicContact CD1-CD1 4.45Å; F30-Y147 AromaticContact CD1-CD2 3.94Å; F30-Y147 HydrophobicContact CD1-CD2 3.94Å; F30-Y147 AromaticContact CD1-CG 3.77Å; F30-Y147 HydrophobicContact CD1-CG 3.77Å; F30-Y147 HydrophobicContact CE1-CD1 4.04Å; F30-Y147 HydrophobicContact CE1-CD2 4.34Å; F30-Y147 AromaticContact CE1-CG 3.77Å; F30-Y147 HydrophobicContact CE1-CG 3.77Å; F30-V185 HydrophobicContact CE1-CG1 4.34Å; F30-V185 HydrophobicContact CZ-CG1 4.34Å; F30-W192 AromaticContact CE2-CH2 3.55Å; F30-W192 HydrophobicContact CE2-CH2 3.55Å; F30-W192 AromaticContact CE2-CZ3 3.92Å; F30-W192 HydrophobicContact CE2-CZ3 3.92Å; F30-W192 AromaticContact CZ-CH2 3.74Å; F30-W192 HydrophobicContact CZ-CH2 3.74Å; F30-W192 AromaticContact CZ-CZ3 3.98Å; F30-W192 HydrophobicContact CZ-CZ3 3.98Å |
| 31 | L | 90.2 | Very high | 81.8 | Confident | 18 Ų | 18 | 71.6 Ų | 71.6 | 9% | 0.094 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -64.7 | -40.9 | 179 | -71.8 | 176.4 | 0 | 0 | 0 | 113.3 | Q26 L27 S33 M34 A47 H50 | Q26-L31 HydrophobicContact CG-CD1 4.26Å; Q26-L31 HydrophobicContact CG-CG 4.14Å; Q26-L31 WeakPolarHBondContact O-CB 3.24Å; Q26-L31 VanDerWaalsContact O-CG 3.24Å; Q26-L31 WeakPolarHBondContact O-CG 3.47Å; Q26-L31 PolarHBondContact O-N 3.28Å; L27-L31 HydrophobicContact CD2-CD1 3.91Å; L31-S33 VanDerWaalsContact C-N 3.32Å; L31-S33 PolarHBondContact O-N 3.46Å; L31-M34 HydrophobicContact CD2-SD 4.42Å; L31-M34 PolarHBondContact O-N 3.22Å; L31-A47 WeakPolarHBondContact CD2-O 3.2Å; L31-H50 HydrophobicContact CD2-CB 3.81Å |
| 32 | P | 88.8 | Confident | 80.2 | Confident | 62 Ų | 62 | 79 Ų | 79 | 40% | 0.403 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -62.8 | -37.4 | 175 | -26.5 | 38.5 | 0 | 0 | 0 | 112.7 | L27 M34 R35 | L27-P32 VanDerWaalsContact O-CD 3.28Å; L27-P32 WeakPolarHBondContact O-CD 3.38Å; L27-P32 WeakPolarHBondContact O-CG 3.33Å; P32-M34 PolarHBondContact O-N 3.15Å; P32-R35 PolarHBondContact O-N 3.32Å; P32-R35 VanDerWaalsContact O-N 3.13Å |
| 33 | S | 86.3 | Confident | 78.5 | Confident | 54 Ų | 54 | 85.1 Ų | 85.1 | 38% | 0.378 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -67.7 | -15.4 | 177.9 | 74.3 | 0 | 0 | 0 | 0 | 113.8 | L29 F30 L31 | L29-S33 PolarHBondContact O-N 2.88Å; F30-S33 PolarHBondContact O-N 2.94Å; F30-S33 PolarHBondContact O-OG 3.38Å; L31-S33 VanDerWaalsContact C-N 3.32Å; L31-S33 PolarHBondContact O-N 3.46Å |
| 34 | M | 82.4 | Confident | 77 | Confident | 48 Ų | 48 | 90.3 Ų | 90.3 | 24% | 0.236 | 48% | 0.479 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -92.2 | -5.6 | 175.8 | -61.5 | 175 | -146.6 | 0 | 0 | 113.3 | F30 L31 P32 E36 A47 H50 A143 | F30-M34 HydrophobicContact CB-CE 4.02Å; F30-M34 WeakPolarHBondContact O-CE 3.14Å; F30-M34 WeakPolarHBondContact O-CG 3.06Å; F30-M34 PolarHBondContact O-N 3.41Å; L31-M34 HydrophobicContact CD2-SD 4.42Å; L31-M34 PolarHBondContact O-N 3.22Å; P32-M34 PolarHBondContact O-N 3.15Å; M34-E36 PolarHBondContact O-N 2.89Å; M34-A47 HydrophobicContact CB-CB 4.44Å; M34-H50 HydrophobicContact SD-CB 3.9Å; M34-A143 HydrophobicContact CE-CB 4.4Å |
| 35 | R | 76.6 | Confident | 76 | Confident | 193 Ų | 193 | 88.6 Ų | 88.6 | 73% | 0.728 | 47% | 0.471 | S | S | * | . | trans | -85.9 | 88.4 | -179.8 | -70.8 | -176.8 | -177.8 | -142.2 | 2.5 | 109.6 | P32 A47 | P32-R35 PolarHBondContact O-N 3.32Å; P32-R35 VanDerWaalsContact O-N 3.13Å; R35-A47 HydrophobicContact CG-CB 3.68Å | ||
| 36 | E | 62.9 | Low | 75.3 | Confident | 183 Ų | 183 | 92 Ų | 92 | 86% | 0.855 | 49% | 0.494 | S | S | * | . | trans | -82.5 | -9.2 | -178.5 | -73.6 | -98.6 | 136.8 | 0 | 0 | 114.4 | M34 | M34-E36 PolarHBondContact O-N 2.89Š| ||
| 37 | D | 56.2 | Low | 74.7 | Confident | 97 Ų | 97 | 92.4 Ų | 92.4 | 52% | 0.519 | 50% | 0.497 | S | S | . | . | trans | -155.6 | 119 | -178 | -160.9 | -19.7 | 0 | 0 | 0 | 114.1 | A39 A40 | D37-A39 PolarHBondContact O-N 2.96Å; D37-A39 WeakPolarHBondContact OD1-CB 3.31Å; D37-A39 PolarHBondContact OD1-N 3.21Å; D37-A40 HydrophobicContact CB-CB 4.32Å; D37-A40 PolarHBondContact O-N 3.14Å | ||
| 38 | P | 56.3 | Low | 74.4 | Confident | 139 Ų | 139 | 93.7 Ų | 93.7 | 90% | 0.903 | 50% | 0.504 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.1 | -15.6 | 173.8 | 25.3 | -32 | 0 | 0 | 0 | 114 | ||
| 39 | A | 55.3 | Low | 74.2 | Confident | 83 Ų | 83 | 92.1 Ų | 92.1 | 69% | 0.686 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.3 | -12.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114 | D37 A41 | D37-A39 PolarHBondContact O-N 2.96Å; D37-A39 WeakPolarHBondContact OD1-CB 3.31Å; D37-A39 PolarHBondContact OD1-N 3.21Å; A39-A41 VanDerWaalsContact C-N 3.27Å; A39-A41 PolarHBondContact O-N 3.2Å |
| 40 | A | 53.3 | Low | 74.1 | Confident | 47 Ų | 47 | 93.3 Ų | 93.3 | 39% | 0.388 | 51% | 0.506 | S | S | . | . | trans | -84.9 | 60.4 | -177.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | D37 R42 | D37-A40 HydrophobicContact CB-CB 4.32Å; D37-A40 PolarHBondContact O-N 3.14Å; A40-R42 PolarHBondContact O-N 3.22Å | ||
| 41 | A | 55.6 | Low | 74.1 | Confident | 103 Ų | 103 | 93.8 Ų | 93.8 | 85% | 0.851 | 51% | 0.511 | S | S | * | . | trans | -72.9 | 55.4 | 166.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | A39 | A39-A41 VanDerWaalsContact C-N 3.27Å; A39-A41 PolarHBondContact O-N 3.2Å | ||
| 42 | R | 63.9 | Low | 74.3 | Confident | 201 Ų | 201 | 95.4 Ų | 95.4 | 76% | 0.758 | 53% | 0.527 | S | S | * | . | trans | -106.8 | 136.6 | 173.9 | -64.5 | -173.9 | -177.6 | 176.2 | 2.3 | 108.7 | A40 F44 S45 | A40-R42 PolarHBondContact O-N 3.22Å; R42-F44 PolarHBondContact O-N 3.17Å; R42-S45 PolarHBondContact O-N 3.48Å | ||
| 43 | L | 62.4 | Low | 74.6 | Confident | 142 Ų | 142 | 96.1 Ų | 96.1 | 74% | 0.743 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.8 | -3.4 | 174.4 | -155.2 | 79.2 | 0 | 0 | 0 | 114.1 | L48 | L43-L48 VanDerWaalsContact O-CD2 3.27Å; L43-L48 WeakPolarHBondContact O-CD2 3.24Å |
| 44 | F | 66.6 | Low | 75.1 | Confident | 178 Ų | 178 | 93.8 Ų | 93.8 | 78% | 0.781 | 51% | 0.51 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -126.5 | 25.4 | -178.4 | -58.7 | -75.5 | 0 | 0 | 0 | 112.9 | R42 | R42-F44 PolarHBondContact O-N 3.17Š|
| 45 | S | 76.6 | Confident | 75.7 | Confident | 31 Ų | 31 | 95.6 Ų | 95.6 | 22% | 0.217 | 52% | 0.52 | C | S | . | . | trans | -59.2 | 140 | 172.7 | 65.3 | 0 | 0 | 0 | 0 | 110.1 | R42 A47 L48 L49 | R42-S45 PolarHBondContact O-N 3.48Å; S45-A47 PolarHBondContact O-N 3.05Å; S45-L48 WeakPolarHBondContact O-CB 3.37Å; S45-L48 PolarHBondContact O-N 3.1Å; S45-L48 WeakPolarHBondContact OG-CB 3.44Å; S45-L48 PolarHBondContact OG-N 3.33Å; S45-L49 PolarHBondContact O-N 3.38Å; S45-L49 VanDerWaalsContact O-N 3.11Å | ||
| 46 | P | 80.8 | Confident | 76.7 | Confident | 87 Ų | 87 | 90.3 Ų | 90.3 | 57% | 0.565 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -52.2 | -44.5 | 179 | -28.7 | 35.1 | 0 | 0 | 0 | 112.1 | L48 L49 H50 | P46-L48 VanDerWaalsContact C-N 3.31Å; P46-L48 PolarHBondContact O-N 3.45Å; P46-L49 PolarHBondContact O-N 2.73Å; P46-L49 VanDerWaalsContact O-N 3.16Å; P46-H50 WeakPolarHBondContact O-CB 3.43Å; P46-H50 PolarHBondContact O-CD2 2.76Å; P46-H50 PolarHBondContact O-N 2.91Å |
| 47 | A | 83.4 | Confident | 78.4 | Confident | 8 Ų | 8 | 82.1 Ų | 82.1 | 7% | 0.066 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -58.4 | -38.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | L31 M34 R35 S45 G51 | L31-A47 WeakPolarHBondContact CD2-O 3.2Å; M34-A47 HydrophobicContact CB-CB 4.44Å; R35-A47 HydrophobicContact CG-CB 3.68Å; S45-A47 PolarHBondContact O-N 3.05Å; A47-G51 PolarHBondContact O-N 3.19Å |
| 48 | L | 85.7 | Confident | 80.3 | Confident | 92 Ų | 92 | 78.2 Ų | 78.2 | 48% | 0.482 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -68.3 | -44.1 | 176.1 | -173.3 | 77.7 | 0 | 0 | 0 | 111.4 | L43 S45 P46 G51 A52 | L43-L48 VanDerWaalsContact O-CD2 3.27Å; L43-L48 WeakPolarHBondContact O-CD2 3.24Å; S45-L48 WeakPolarHBondContact O-CB 3.37Å; S45-L48 PolarHBondContact O-N 3.1Å; S45-L48 WeakPolarHBondContact OG-CB 3.44Å; S45-L48 PolarHBondContact OG-N 3.33Å; P46-L48 VanDerWaalsContact C-N 3.31Å; P46-L48 PolarHBondContact O-N 3.45Å; L48-G51 PolarHBondContact O-N 3.46Å; L48-A52 VanDerWaalsContact O-CB 3.32Å; L48-A52 WeakPolarHBondContact O-CB 3.38Å; L48-A52 PolarHBondContact O-N 3.26Å |
| 49 | L | 89.1 | Confident | 82.2 | Confident | 121 Ų | 121 | 74.4 Ų | 74.4 | 63% | 0.634 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -62.7 | -45.6 | 178.2 | -179.9 | 63.9 | 0 | 0 | 0 | 111.4 | S45 P46 A52 L53 | S45-L49 PolarHBondContact O-N 3.38Å; S45-L49 VanDerWaalsContact O-N 3.11Å; P46-L49 PolarHBondContact O-N 2.73Å; P46-L49 VanDerWaalsContact O-N 3.16Å; L49-A52 PolarHBondContact O-N 2.98Å; L49-L53 WeakPolarHBondContact O-CB 3.3Å; L49-L53 PolarHBondContact O-N 3.46Å |
| 50 | H | 91.4 | Very high | 84.3 | Confident | 72 Ų | 72 | 70.6 Ų | 70.6 | 33% | 0.333 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -60.7 | -44.8 | 175.3 | -84.8 | -92.2 | 0 | 0 | 0 | 111.2 | L31 M34 P46 L53 F54 Y139 | L31-H50 HydrophobicContact CD2-CB 3.81Å; M34-H50 HydrophobicContact SD-CB 3.9Å; P46-H50 WeakPolarHBondContact O-CB 3.43Å; P46-H50 PolarHBondContact O-CD2 2.76Å; P46-H50 PolarHBondContact O-N 2.91Å; H50-L53 PolarHBondContact O-N 2.93Å; H50-F54 WeakPolarHBondContact O-CB 3.28Å; H50-F54 PolarHBondContact O-N 2.82Å; H50-Y139 VanDerWaalsContact CA-OH 3.31Å; H50-Y139 WeakPolarHBondContact CA-OH 3.34Å; H50-Y139 WeakPolarHBondContact CB-OH 3.42Å; H50-Y139 AromaticContact ND1-CE2 3.86Å; H50-Y139 AromaticContact ND1-CZ 3.78Å; H50-Y139 PolarHBondContact ND1-OH 3.36Å; H50-Y139 PolarHBondContact O-OH 3.39Å |
| 51 | G | 92.6 | Very high | 86.4 | Confident | 10 Ų | 10 | 68.7 Ų | 68.7 | 10% | 0.103 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -62 | -46.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | A47 L48 L53 F54 L55 | A47-G51 PolarHBondContact O-N 3.19Å; L48-G51 PolarHBondContact O-N 3.46Å; G51-L53 PolarHBondContact O-N 3.02Å; G51-F54 PolarHBondContact O-N 3.31Å; G51-L55 WeakPolarHBondContact O-CB 3.15Å; G51-L55 VanDerWaalsContact O-CG 3.27Å; G51-L55 WeakPolarHBondContact O-CG 3.49Å; G51-L55 PolarHBondContact O-N 3.3Å |
| 52 | A | 94 | Very high | 88.4 | Confident | 53 Ų | 53 | 66.9 Ų | 66.9 | 44% | 0.438 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -62.1 | -44 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112 | L48 L49 L55 F56 | L48-A52 VanDerWaalsContact O-CB 3.32Å; L48-A52 WeakPolarHBondContact O-CB 3.38Å; L48-A52 PolarHBondContact O-N 3.26Å; L49-A52 PolarHBondContact O-N 2.98Å; A52-L55 PolarHBondContact O-N 3.3Å; A52-F56 WeakPolarHBondContact O-CB 3.4Å; A52-F56 PolarHBondContact O-N 3.04Å |
| 53 | L | 95.3 | Very high | 90 | Very high | 77 Ų | 77 | 58.3 Ų | 58.3 | 40% | 0.403 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -61.4 | -47.1 | 175.8 | 177.1 | 58.3 | 0 | 0 | 0 | 111.3 | L49 H50 G51 L55 F56 L57 Y139 | L49-L53 WeakPolarHBondContact O-CB 3.3Å; L49-L53 PolarHBondContact O-N 3.46Å; H50-L53 PolarHBondContact O-N 2.93Å; G51-L53 PolarHBondContact O-N 3.02Å; L53-L55 PolarHBondContact O-N 2.92Å; L53-F56 WeakPolarHBondContact O-CB 3.5Å; L53-F56 PolarHBondContact O-N 3.2Å; L53-L57 HydrophobicContact CD1-CD1 4.22Å; L53-L57 HydrophobicContact CD1-CG 4.2Å; L53-L57 HydrophobicContact CG-CD1 4.24Å; L53-L57 WeakPolarHBondContact O-CG 3.4Å; L53-L57 PolarHBondContact O-N 3.28Å; L53-Y139 HydrophobicContact CD2-CD2 3.87Å; L53-Y139 HydrophobicContact CD2-CE2 3.7Å; L53-Y139 HydrophobicContact CG-CD2 4.33Å; L53-Y139 HydrophobicContact CG-CE2 4.19Å |
| 54 | F | 95.8 | Very high | 91.6 | Very high | 4 Ų | 4 | 51.6 Ų | 51.6 | 2% | 0.018 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -62.6 | -42.4 | 178.4 | 177.7 | -103.3 | 0 | 0 | 0 | 112.5 | T22 F23 Q26 H50 G51 F56 L57 S58 Y139 | T22-F54 HydrophobicContact CG2-CE2 4.18Å; T22-F54 HydrophobicContact CG2-CZ 4.25Å; F23-F54 HydrophobicContact CB-CE1 4.47Å; F23-F54 HydrophobicContact CD2-CD1 4.49Å; F23-F54 AromaticContact CD2-CE1 3.51Å; F23-F54 HydrophobicContact CD2-CE1 3.51Å; F23-F54 HydrophobicContact CD2-CZ 4.15Å; F23-F54 HydrophobicContact CE2-CE1 4.01Å; F23-F54 HydrophobicContact CG-CE1 4.19Å; Q26-F54 HydrophobicContact CB-CD1 3.97Å; Q26-F54 HydrophobicContact CB-CD2 4.37Å; Q26-F54 HydrophobicContact CB-CE1 3.65Å; Q26-F54 HydrophobicContact CB-CE2 4.11Å; Q26-F54 HydrophobicContact CB-CG 4.3Å; Q26-F54 HydrophobicContact CB-CZ 3.74Å; Q26-F54 HydrophobicContact CG-CB 4.13Å; Q26-F54 HydrophobicContact CG-CD1 3.55Å; Q26-F54 HydrophobicContact CG-CD2 3.92Å; Q26-F54 HydrophobicContact CG-CE1 3.8Å; Q26-F54 HydrophobicContact CG-CE2 4.18Å; Q26-F54 HydrophobicContact CG-CG 3.59Å; Q26-F54 HydrophobicContact CG-CZ 4.12Å; H50-F54 WeakPolarHBondContact O-CB 3.28Å; H50-F54 PolarHBondContact O-N 2.82Å; G51-F54 PolarHBondContact O-N 3.31Å; F54-F56 VanDerWaalsContact C-N 3.33Å; F54-F56 PolarHBondContact O-N 3.19Å; F54-L57 PolarHBondContact O-N 3.08Å; F54-S58 WeakPolarHBondContact CE1-OG 3.27Å; F54-S58 WeakPolarHBondContact CZ-OG 3.46Å; F54-S58 VanDerWaalsContact O-CB 3.28Å; F54-S58 WeakPolarHBondContact O-CB 3.35Å; F54-S58 PolarHBondContact O-N 3.35Å; F54-S58 PolarHBondContact O-OG 3.28Å; F54-Y139 HydrophobicContact CB-CD1 4.36Å; F54-Y139 HydrophobicContact CB-CE1 3.8Å; F54-Y139 AromaticContact CD2-CD1 3.84Å; F54-Y139 HydrophobicContact CD2-CD1 3.84Å; F54-Y139 AromaticContact CD2-CE1 3.92Å; F54-Y139 HydrophobicContact CD2-CE1 3.92Å; F54-Y139 HydrophobicContact CG-CE1 4.27Å |
| 55 | L | 96.3 | Very high | 93.1 | Very high | 87 Ų | 87 | 43.7 Ų | 43.7 | 46% | 0.455 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -62.4 | -42.1 | 176.1 | -72.6 | 174.5 | 0 | 0 | 0 | 111.3 | F23 G51 A52 L53 S58 A59 | F23-L55 HydrophobicContact CE2-CD2 3.72Å; F23-L55 HydrophobicContact CZ-CD2 3.84Å; G51-L55 WeakPolarHBondContact O-CB 3.15Å; G51-L55 VanDerWaalsContact O-CG 3.27Å; G51-L55 WeakPolarHBondContact O-CG 3.49Å; G51-L55 PolarHBondContact O-N 3.3Å; A52-L55 PolarHBondContact O-N 3.3Å; L53-L55 PolarHBondContact O-N 2.92Å; L55-S58 PolarHBondContact O-N 2.9Å; L55-A59 WeakPolarHBondContact O-CB 3.36Å; L55-A59 PolarHBondContact O-N 3.45Å |
| 56 | F | 97.3 | Very high | 94 | Very high | 81 Ų | 81 | 45.3 Ų | 45.3 | 36% | 0.355 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -60.3 | -47.3 | 175.5 | 170.2 | -98.6 | 0 | 0 | 0 | 112.1 | A52 L53 F54 N60 Y132 L247 | A52-F56 WeakPolarHBondContact O-CB 3.4Å; A52-F56 PolarHBondContact O-N 3.04Å; L53-F56 WeakPolarHBondContact O-CB 3.5Å; L53-F56 PolarHBondContact O-N 3.2Å; F54-F56 VanDerWaalsContact C-N 3.33Å; F54-F56 PolarHBondContact O-N 3.19Å; F56-N60 VanDerWaalsContact CE2-ND2 3.25Å; F56-N60 WeakPolarHBondContact CE2-ND2 3.38Å; F56-N60 WeakPolarHBondContact O-CB 3.45Å; F56-N60 PolarHBondContact O-N 3.06Å; F56-N60 PolarHBondContact O-ND2 3.49Å; F56-N60 VanDerWaalsContact O-ND2 3.08Å; F56-Y132 AromaticContact CE1-CE1 3.78Å; F56-Y132 HydrophobicContact CE1-CE1 3.78Å; F56-Y132 HydrophobicContact CZ-CE1 4.16Å; F56-L247 VanDerWaalsContact CE2-O 3.31Å; F56-L247 WeakPolarHBondContact CE2-O 3.34Å; F56-L247 HydrophobicContact CZ-CD2 4.47Å |
| 57 | L | 97.8 | Very high | 94.7 | Very high | 12 Ų | 12 | 41.7 Ų | 41.7 | 6% | 0.063 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -64 | -45.3 | 178.3 | -66.9 | 175.7 | 0 | 0 | 0 | 111.4 | L53 F54 N60 A61 Y132 L135 A136 Y139 | L53-L57 HydrophobicContact CD1-CD1 4.22Å; L53-L57 HydrophobicContact CD1-CG 4.2Å; L53-L57 HydrophobicContact CG-CD1 4.24Å; L53-L57 WeakPolarHBondContact O-CG 3.4Å; L53-L57 PolarHBondContact O-N 3.28Å; F54-L57 PolarHBondContact O-N 3.08Å; L57-N60 PolarHBondContact O-N 3.33Å; L57-A61 WeakPolarHBondContact O-CB 3.2Å; L57-A61 PolarHBondContact O-N 3.27Å; L57-Y132 HydrophobicContact CD2-CD1 3.88Å; L57-Y132 HydrophobicContact CD2-CE1 4.14Å; L57-L135 HydrophobicContact CD2-CB 3.88Å; L57-L135 HydrophobicContact CD2-CD1 4.33Å; L57-A136 HydrophobicContact CB-CB 4.13Å; L57-Y139 HydrophobicContact CD1-CG 4.2Å |
| 58 | S | 96.9 | Very high | 95.3 | Very high | 15 Ų | 15 | 41.3 Ų | 41.3 | 11% | 0.105 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -66.2 | -44 | -179.6 | -61.3 | 0 | 0 | 0 | 0 | 112.1 | F54 L55 N60 A61 L62 | F54-S58 WeakPolarHBondContact CE1-OG 3.27Å; F54-S58 WeakPolarHBondContact CZ-OG 3.46Å; F54-S58 VanDerWaalsContact O-CB 3.28Å; F54-S58 WeakPolarHBondContact O-CB 3.35Å; F54-S58 PolarHBondContact O-N 3.35Å; F54-S58 PolarHBondContact O-OG 3.28Å; L55-S58 PolarHBondContact O-N 2.9Å; S58-N60 VanDerWaalsContact C-N 3.31Å; S58-N60 PolarHBondContact O-N 2.96Å; S58-A61 PolarHBondContact O-N 2.93Å; S58-L62 WeakPolarHBondContact O-CB 3.37Å; S58-L62 WeakPolarHBondContact O-CG 3.13Å; S58-L62 PolarHBondContact O-N 2.87Å |
| 59 | A | 97 | Very high | 95.6 | Very high | 58 Ų | 58 | 40.1 Ų | 40.1 | 48% | 0.479 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -61.6 | -41.2 | 176 | 0 | 0 | 0 | 0 | 0 | 111.2 | L55 G63 | L55-A59 WeakPolarHBondContact O-CB 3.36Å; L55-A59 PolarHBondContact O-N 3.45Å; A59-G63 WeakPolarHBondContact O-CA 3.46Å; A59-G63 PolarHBondContact O-N 3.46Å |
| 60 | N | 97.6 | Very high | 95.7 | Very high | 4 Ų | 4 | 40 Ų | 40 | 2% | 0.021 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -70.4 | -40.7 | 176.6 | -88.8 | -76.1 | 0 | 0 | 0 | 113.1 | F56 L57 S58 N64 Y132 L246 L247 P249 | F56-N60 VanDerWaalsContact CE2-ND2 3.25Å; F56-N60 WeakPolarHBondContact CE2-ND2 3.38Å; F56-N60 WeakPolarHBondContact O-CB 3.45Å; F56-N60 PolarHBondContact O-N 3.06Å; F56-N60 PolarHBondContact O-ND2 3.49Å; F56-N60 VanDerWaalsContact O-ND2 3.08Å; L57-N60 PolarHBondContact O-N 3.33Å; S58-N60 VanDerWaalsContact C-N 3.31Å; S58-N60 PolarHBondContact O-N 2.96Å; N60-N64 VanDerWaalsContact O-CB 3.28Å; N60-N64 WeakPolarHBondContact O-CB 3.34Å; N60-N64 PolarHBondContact O-N 3.14Å; N60-N64 PolarHBondContact O-ND2 2.96Å; N60-Y132 HydrophobicContact CB-CD1 3.46Å; N60-Y132 VanDerWaalsContact CB-CD1 3.46Å; N60-Y132 HydrophobicContact CB-CD2 3.61Å; N60-Y132 HydrophobicContact CB-CE1 3.75Å; N60-Y132 HydrophobicContact CB-CE2 3.89Å; N60-Y132 HydrophobicContact CB-CG 3.41Å; N60-Y132 VanDerWaalsContact CB-CG 3.41Å; N60-L246 PolarHBondContact OD1-O 2.98Å; N60-L247 PolarHBondContact ND2-O 3.35Å; N60-L247 PolarHBondContact OD1-O 3.02Å; N60-P249 WeakPolarHBondContact OD1-CD 3.35Å |
| 61 | A | 97.8 | Very high | 95.5 | Very high | 6 Ų | 6 | 37.5 Ų | 37.5 | 5% | 0.05 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -62.7 | -53.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | L57 S58 Y65 | L57-A61 WeakPolarHBondContact O-CB 3.2Å; L57-A61 PolarHBondContact O-N 3.27Å; S58-A61 PolarHBondContact O-N 2.93Å; A61-Y65 VanDerWaalsContact O-CB 3.31Å; A61-Y65 WeakPolarHBondContact O-CB 3.11Å; A61-Y65 PolarHBondContact O-N 3.24Å |
| 62 | L | 97.7 | Very high | 94.9 | Very high | 65 Ų | 65 | 38.9 Ų | 38.9 | 34% | 0.34 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -70.9 | -39.3 | -178.5 | -67.7 | 175.5 | 0 | 0 | 0 | 112.5 | F15 L16 S58 Y65 V66 | F15-L62 HydrophobicContact CE1-CD2 4.1Å; F15-L62 HydrophobicContact CZ-CD2 4.34Å; L16-L62 HydrophobicContact CD2-CD2 4.45Å; S58-L62 WeakPolarHBondContact O-CB 3.37Å; S58-L62 WeakPolarHBondContact O-CG 3.13Å; S58-L62 PolarHBondContact O-N 2.87Å; L62-Y65 WeakPolarHBondContact O-CB 3.31Å; L62-Y65 PolarHBondContact O-N 3.36Å; L62-V66 WeakPolarHBondContact O-CG2 3.43Å; L62-V66 PolarHBondContact O-N 2.95Å |
| 63 | G | 97 | Very high | 93.8 | Very high | 22 Ų | 22 | 36.4 Ų | 36.4 | 23% | 0.227 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -65 | -44.4 | 178 | 0 | 0 | 0 | 0 | 0 | 111.8 | A59 Y65 V66 L67 | A59-G63 WeakPolarHBondContact O-CA 3.46Å; A59-G63 PolarHBondContact O-N 3.46Å; G63-Y65 VanDerWaalsContact C-N 3.34Å; G63-Y65 PolarHBondContact O-N 3.41Å; G63-V66 PolarHBondContact O-N 3.39Å; G63-L67 WeakPolarHBondContact O-CB 3.45Å; G63-L67 VanDerWaalsContact O-CG 3.27Å; G63-L67 WeakPolarHBondContact O-CG 3.47Å; G63-L67 PolarHBondContact O-N 2.89Å |
| 64 | N | 97.1 | Very high | 92.4 | Very high | 1 Ų | 1 | 36 Ų | 36 | 1% | 0.005 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -66.4 | -36.8 | 174.1 | -79.2 | -72.9 | 0 | 0 | 0 | 112 | N60 L67 V68 L128 F129 | N60-N64 VanDerWaalsContact O-CB 3.28Å; N60-N64 WeakPolarHBondContact O-CB 3.34Å; N60-N64 PolarHBondContact O-N 3.14Å; N60-N64 PolarHBondContact O-ND2 2.96Å; N64-L67 PolarHBondContact O-N 2.89Å; N64-V68 WeakPolarHBondContact O-CG2 3.07Å; N64-V68 PolarHBondContact O-N 3.13Å; N64-L128 HydrophobicContact CB-CB 4.28Å; N64-L128 WeakPolarHBondContact OD1-CB 3.37Å; N64-F129 HydrophobicContact CB-CB 3.96Å |
| 65 | Y | 97.5 | Very high | 91 | Very high | 12 Ų | 12 | 40 Ų | 40 | 5% | 0.047 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -55.9 | -50.8 | 172.1 | 176 | -93.4 | 0 | 0 | 0 | 111.9 | P12 F15 L16 A61 L62 G63 L67 V68 I69 F113 T114 F129 | P12-Y65 WeakPolarHBondContact CB-OH 3.29Å; F15-Y65 AromaticContact CD1-CD2 3.84Å; F15-Y65 HydrophobicContact CD1-CD2 3.84Å; F15-Y65 HydrophobicContact CD1-CE1 4.39Å; F15-Y65 AromaticContact CD1-CE2 3.52Å; F15-Y65 HydrophobicContact CD1-CE2 3.52Å; F15-Y65 HydrophobicContact CD1-CG 4.39Å; F15-Y65 AromaticContact CD1-CZ 3.83Å; F15-Y65 HydrophobicContact CE1-CD1 4.21Å; F15-Y65 AromaticContact CE1-CD2 3.51Å; F15-Y65 HydrophobicContact CE1-CD2 3.51Å; F15-Y65 HydrophobicContact CE1-CE1 4.39Å; F15-Y65 AromaticContact CE1-CE2 3.71Å; F15-Y65 HydrophobicContact CE1-CE2 3.71Å; F15-Y65 AromaticContact CE1-CG 3.78Å; F15-Y65 HydrophobicContact CE1-CG 3.78Å; F15-Y65 HydrophobicContact CG-CE2 4.4Å; F15-Y65 HydrophobicContact CZ-CD2 4.27Å; L16-Y65 HydrophobicContact CD2-CE1 4.04Å; A61-Y65 VanDerWaalsContact O-CB 3.31Å; A61-Y65 WeakPolarHBondContact O-CB 3.11Å; A61-Y65 PolarHBondContact O-N 3.24Å; L62-Y65 WeakPolarHBondContact O-CB 3.31Å; L62-Y65 PolarHBondContact O-N 3.36Å; G63-Y65 VanDerWaalsContact C-N 3.34Å; G63-Y65 PolarHBondContact O-N 3.41Å; Y65-L67 VanDerWaalsContact C-N 3.34Å; Y65-L67 PolarHBondContact O-N 2.84Å; Y65-V68 WeakPolarHBondContact O-CB 3.5Å; Y65-V68 PolarHBondContact O-N 2.87Å; Y65-I69 HydrophobicContact CD1-CD1 4.1Å; Y65-I69 HydrophobicContact CE1-CD1 3.54Å; Y65-I69 PolarHBondContact O-N 3.15Å; Y65-F113 VanDerWaalsContact CE2-O 3.24Å; Y65-F113 WeakPolarHBondContact CE2-O 3.36Å; Y65-F113 PolarHBondContact OH-O 3.46Å; Y65-T114 HydrophobicContact CD2-CG2 4.01Å; Y65-T114 HydrophobicContact CE2-CG2 3.91Å; Y65-F129 HydrophobicContact CD2-CD2 4.13Å; Y65-F129 AromaticContact CD2-CE2 3.74Å; Y65-F129 HydrophobicContact CD2-CE2 3.74Å; Y65-F129 AromaticContact CD2-CZ 3.95Å; Y65-F129 HydrophobicContact CD2-CZ 3.95Å; Y65-F129 HydrophobicContact CG-CE2 4.41Å |
| 66 | V | 96.7 | Very high | 89.4 | Confident | 64 Ų | 64 | 39.4 Ų | 39.4 | 39% | 0.388 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -60.9 | -44.1 | 176.7 | 170.6 | 0 | 0 | 0 | 0 | 110.9 | L62 G63 V68 I69 Q70 | L62-V66 WeakPolarHBondContact O-CG2 3.43Å; L62-V66 PolarHBondContact O-N 2.95Å; G63-V66 PolarHBondContact O-N 3.39Å; V66-V68 VanDerWaalsContact C-N 3.27Å; V66-V68 PolarHBondContact O-N 3.03Å; V66-I69 WeakPolarHBondContact O-CB 3.32Å; V66-I69 PolarHBondContact O-N 3.18Å; V66-Q70 HydrophobicContact CG1-CG 4.09Å; V66-Q70 WeakPolarHBondContact O-CG 3.18Å; V66-Q70 PolarHBondContact O-N 3.48Å |
| 67 | L | 95.2 | Very high | 87.2 | Confident | 12 Ų | 12 | 37.6 Ų | 37.6 | 6% | 0.063 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -66.7 | -25.1 | 178.6 | -70.7 | 176.3 | 0 | 0 | 0 | 113.4 | G63 N64 Y65 I69 N71 N125 P249 M250 F251 | G63-L67 WeakPolarHBondContact O-CB 3.45Å; G63-L67 VanDerWaalsContact O-CG 3.27Å; G63-L67 WeakPolarHBondContact O-CG 3.47Å; G63-L67 PolarHBondContact O-N 2.89Å; N64-L67 PolarHBondContact O-N 2.89Å; Y65-L67 VanDerWaalsContact C-N 3.34Å; Y65-L67 PolarHBondContact O-N 2.84Å; L67-I69 VanDerWaalsContact C-N 3.32Å; L67-N71 WeakPolarHBondContact O-CB 3.47Å; L67-N71 PolarHBondContact O-N 3.05Å; L67-N71 PolarHBondContact O-ND2 3.02Å; L67-N125 HydrophobicContact CB-CB 4.2Å; L67-P249 VanDerWaalsContact CD1-C 3.43Å; L67-P249 HydrophobicContact CD1-CB 3.61Å; L67-M250 VanDerWaalsContact CD1-N 3.28Å; L67-F251 HydrophobicContact CD2-CD1 4.24Å; L67-F251 HydrophobicContact CD2-CD2 3.96Å; L67-F251 HydrophobicContact CD2-CE1 3.84Å; L67-F251 HydrophobicContact CD2-CE2 3.54Å; L67-F251 HydrophobicContact CD2-CG 4.28Å; L67-F251 HydrophobicContact CD2-CZ 3.46Å; L67-F251 VanDerWaalsContact CD2-CZ 3.46Å |
| 68 | V | 94.8 | Very high | 84.9 | Confident | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -65.4 | -39.2 | 170.6 | 168.6 | 0 | 0 | 0 | 0 | 111 | N64 Y65 V66 T114 N116 I118 N122 N125 F126 | N64-V68 WeakPolarHBondContact O-CG2 3.07Å; N64-V68 PolarHBondContact O-N 3.13Å; Y65-V68 WeakPolarHBondContact O-CB 3.5Å; Y65-V68 PolarHBondContact O-N 2.87Å; V66-V68 VanDerWaalsContact C-N 3.27Å; V66-V68 PolarHBondContact O-N 3.03Å; V68-T114 HydrophobicContact CB-CG2 4.45Å; V68-T114 HydrophobicContact CG1-CG2 3.87Å; V68-N116 PolarHBondContact O-ND2 3.12Å; V68-I118 HydrophobicContact CG1-CD1 3.44Å; V68-I118 VanDerWaalsContact CG1-CD1 3.44Å; V68-N122 HydrophobicContact CG1-CB 4.47Å; V68-N122 PolarHBondContact O-ND2 2.89Å; V68-N125 VanDerWaalsContact CG2-C 3.46Å; V68-N125 HydrophobicContact CG2-CB 3.61Å; V68-F126 HydrophobicContact CG2-CB 4.05Å; V68-F126 VanDerWaalsContact CG2-N 3.3Å |
| 69 | I | 93.5 | Very high | 82.6 | Confident | 67 Ų | 67 | 42 Ų | 42 | 34% | 0.344 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -73.8 | -48.7 | -179.5 | -60 | 172.6 | 0 | 0 | 0 | 110.2 | Y65 V66 L67 N71 S72 T114 N116 | Y65-I69 HydrophobicContact CD1-CD1 4.1Å; Y65-I69 HydrophobicContact CE1-CD1 3.54Å; Y65-I69 PolarHBondContact O-N 3.15Å; V66-I69 WeakPolarHBondContact O-CB 3.32Å; V66-I69 PolarHBondContact O-N 3.18Å; L67-I69 VanDerWaalsContact C-N 3.32Å; I69-N71 PolarHBondContact O-N 3.3Å; I69-S72 PolarHBondContact O-N 3.35Å; I69-S72 PolarHBondContact O-OG 3.22Å; I69-T114 WeakPolarHBondContact CG1-O 3.27Å; I69-N116 PolarHBondContact O-ND2 2.85Å |
| 70 | Q | 91.6 | Very high | 80.1 | Confident | 119 Ų | 119 | 44.5 Ų | 44.5 | 56% | 0.556 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -65 | -39.3 | -179.6 | -69.9 | 179.7 | -17.8 | 0 | 0 | 112.3 | V66 S72 F251 | V66-Q70 HydrophobicContact CG1-CG 4.09Å; V66-Q70 WeakPolarHBondContact O-CG 3.18Å; V66-Q70 PolarHBondContact O-N 3.48Å; Q70-S72 PolarHBondContact O-N 3.07Å; Q70-F251 HydrophobicContact CB-CE1 4.49Å; Q70-F251 HydrophobicContact CB-CZ 4.48Å |
| 71 | N | 86.1 | Confident | 77.4 | Confident | 18 Ų | 18 | 53 Ų | 53 | 10% | 0.096 | 30% | 0.303 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -85.7 | 44.8 | 173.8 | -66.9 | -63 | 0 | 0 | 0 | 112.5 | L67 I69 N122 N125 F251 | L67-N71 WeakPolarHBondContact O-CB 3.47Å; L67-N71 PolarHBondContact O-N 3.05Å; L67-N71 PolarHBondContact O-ND2 3.02Å; I69-N71 PolarHBondContact O-N 3.3Å; N71-N122 HydrophobicContact CB-CB 4.05Å; N71-N122 WeakPolarHBondContact O-CB 3.5Å; N71-N122 PolarHBondContact O-ND2 2.69Å; N71-N125 PolarHBondContact ND2-ND2 2.81Å; N71-F251 WeakPolarHBondContact ND2-CD1 3.27Å; N71-F251 WeakPolarHBondContact ND2-CE1 3.47Å; N71-F251 WeakPolarHBondContact OD1-CD1 3.45Å; N71-F251 WeakPolarHBondContact OD1-CE1 3.39Å |
| 72 | S | 79.3 | Confident | 74.7 | Confident | 39 Ų | 39 | 54.6 Ų | 54.6 | 27% | 0.273 | 32% | 0.316 | S | S | . | . | P | Polyproline II helix | trans | -50.8 | 134.4 | 172.6 | -83.1 | 0 | 0 | 0 | 0 | 110.9 | I69 Q70 D74 R102 N116 | I69-S72 PolarHBondContact O-N 3.35Å; I69-S72 PolarHBondContact O-OG 3.22Å; Q70-S72 PolarHBondContact O-N 3.07Å; S72-D74 PolarHBondContact O-N 3.12Å; S72-R102 PolarHBondContact OG-NH2 3.36Å; S72-N116 PolarHBondContact OG-ND2 3.29Å; S72-N116 PolarHBondContact OG-OD1 2.91Å |
| 73 | P | 71.2 | Confident | 72.3 | Confident | 1 Ų | 1 | 57.4 Ų | 57.4 | 1% | 0.006 | 34% | 0.341 | C | S | . | . | P | Polyproline II helix | trans | -56.1 | 140.8 | 174.5 | -21.9 | 31.3 | 0 | 0 | 0 | 110.3 | D75 R102 T104 C117 | P73-D75 PolarHBondContact O-N 3.36Å; P73-R102 PolarHBondContact O-NH1 3.3Å; P73-T104 HydrophobicContact CB-CG2 3.84Å; P73-T104 HydrophobicContact CG-CG2 4.2Å; P73-C117 VanDerWaalsContact CD-O 3.31Å; P73-C117 WeakPolarHBondContact CD-O 3.48Å; P73-C117 HydrophobicContact CG-CB 4.16Å; P73-C117 WeakPolarHBondContact CG-O 3.07Å |
| 74 | D | 66.8 | Low | 69.9 | Low | 69 Ų | 69 | 62.8 Ų | 62.8 | 37% | 0.369 | 37% | 0.37 | S | S | . | . | P | Polyproline II helix | trans | -52.2 | 134.8 | 180 | -65.6 | -50.4 | 0 | 0 | 0 | 110.6 | S72 L76 R121 | S72-D74 PolarHBondContact O-N 3.12Å; D74-L76 PolarHBondContact O-N 3.05Å; D74-R121 IonicContact OD1-CZ 3.32Å; D74-R121 IonicContact OD1-NH1 2.69Å; D74-R121 PolarHBondContact OD1-NH1 3.48Å; D74-R121 WeakPolarHBondContact OD2-CD 3.43Å; D74-R121 IonicContact OD2-CZ 3.97Å; D74-R121 IonicContact OD2-NE 2.7Å; D74-R121 IonicContact OD2-NH1 3.56Å; D74-R121 PolarHBondContact OD2-NH1 2.89Å |
| 75 | D | 65.3 | Low | 67.3 | Low | 89 Ų | 89 | 72.2 Ų | 72.2 | 48% | 0.476 | 41% | 0.406 | S | S | . | . | trans | -78.8 | 101.8 | 164.3 | -173.2 | 2.6 | 0 | 0 | 0 | 107.7 | P73 G77 R102 | P73-D75 PolarHBondContact O-N 3.36Å; D75-G77 PolarHBondContact O-N 3.25Å; D75-G77 PolarHBondContact OD1-N 3.29Å; D75-G77 VanDerWaalsContact OD1-N 3.15Å; D75-R102 HydrophobicContact CB-CB 4.08Å; D75-R102 WeakPolarHBondContact OD1-CB 3.34Å | ||
| 76 | L | 63.3 | Low | 64.7 | Low | 74 Ų | 74 | 81.7 Ų | 81.7 | 39% | 0.387 | 45% | 0.447 | S | S | . | . | trans | -68 | 1.6 | -179.3 | -75.7 | 173.4 | 0 | 0 | 0 | 113.6 | D74 A78 T94 V103 | D74-L76 PolarHBondContact O-N 3.05Å; L76-A78 PolarHBondContact O-N 3.5Å; L76-T94 HydrophobicContact CD1-CG2 3.92Å; L76-V103 HydrophobicContact CB-CB 4.39Å; L76-V103 HydrophobicContact CB-CG1 4.45Å; L76-V103 HydrophobicContact CD1-CG1 4.46Å; L76-V103 PolarHBondContact N-O 3.49Å | ||
| 77 | G | 51.2 | Low | 62.4 | Low | 42 Ų | 42 | 83 Ų | 83 | 43% | 0.433 | 45% | 0.454 | S | S | . | . | trans | 52.9 | -51.6 | 159.3 | 0 | 0 | 0 | 0 | 0 | 118.2 | D75 C79 | D75-G77 PolarHBondContact O-N 3.25Å; D75-G77 PolarHBondContact OD1-N 3.29Å; D75-G77 VanDerWaalsContact OD1-N 3.15Å; G77-C79 PolarHBondContact O-N 2.95Å | ||
| 78 | A | 48.8 | Very low | 60.1 | Low | 83 Ų | 83 | 87.4 Ų | 87.4 | 69% | 0.686 | 48% | 0.484 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.7 | -5.2 | -177.8 | 0 | 0 | 0 | 0 | 0 | 115.8 | L76 | L76-A78 PolarHBondContact O-N 3.5Š|
| 79 | C | 49.6 | Very low | 58.1 | Low | 37 Ų | 37 | 90 Ų | 90 | 25% | 0.25 | 50% | 0.501 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -84.9 | -8 | 174.5 | -91.4 | 0 | 0 | 0 | 0 | 113.7 | G77 C89 V103 | G77-C79 PolarHBondContact O-N 2.95Å; C79-C89 WeakPolarHBondContact CB-SG 3.32Å; C79-C89 WeakPolarHBondContact SG-CA 3.37Å; C79-C89 WeakPolarHBondContact SG-CB 3.41Å; C79-C89 CovalentContact SG-SG 2.06Å; C79-C89 PolarHBondContact SG-SG 2.92Å; C79-V103 HydrophobicContact CB-CG2 3.95Å |
| 80 | Q | 43.7 | Very low | 56.1 | Low | 110 Ų | 110 | 92.4 Ų | 92.4 | 51% | 0.514 | 52% | 0.522 | S | S | . | . | S | Bend | trans | -99 | -18.8 | -170.5 | -112.9 | 179.2 | -21.9 | 0 | 0 | 115.6 | F96 | Q80-F96 HydrophobicContact CG-CE2 4.41Š|
| 81 | E | 41 | Very low | 54.4 | Low | 183 Ų | 183 | 88.4 Ų | 88.4 | 86% | 0.855 | 51% | 0.507 | S | S | * | . | S | Bend | trans | -98.5 | 5.3 | -173.7 | -89.1 | -173.5 | 170.7 | 0 | 0 | 116.2 | S83 | E81-S83 PolarHBondContact O-N 3.27Š|
| 82 | A | 41.6 | Very low | 53.1 | Low | 39 Ų | 39 | 93.8 Ų | 93.8 | 32% | 0.322 | 54% | 0.543 | S | S | . | . | trans | -100.2 | 57.7 | -177 | 0 | 0 | 0 | 0 | 0 | 112.2 | T84 R85 V87 | A82-T84 PolarHBondContact O-N 3.41Å; A82-R85 HydrophobicContact CB-CB 4.5Å; A82-R85 WeakPolarHBondContact CB-O 3.4Å; A82-R85 VanDerWaalsContact O-O 3.06Å; A82-V87 HydrophobicContact CB-CB 4.49Å; A82-V87 HydrophobicContact CB-CG2 4.12Å | ||
| 83 | S | 46.3 | Very low | 52.6 | Low | 124 Ų | 124 | 93.5 Ų | 93.5 | 87% | 0.867 | 54% | 0.541 | S | S | * | . | S | Bend | trans | -64.8 | -5.4 | 164.2 | -174.8 | 0 | 0 | 0 | 0 | 112.6 | E81 | E81-S83 PolarHBondContact O-N 3.27Š|
| 84 | T | 46.9 | Very low | 52.8 | Low | 135 Ų | 135 | 94.9 Ų | 94.9 | 83% | 0.828 | 55% | 0.549 | S | S | * | . | S | Bend | trans | -126.2 | -4 | -179.7 | 45.5 | 0 | 0 | 0 | 0 | 114.2 | A82 | A82-T84 PolarHBondContact O-N 3.41Š|
| 85 | R | 42.8 | Very low | 53.5 | Low | 200 Ų | 200 | 96 Ų | 96 | 76% | 0.755 | 55% | 0.552 | S | S | * | * | S | Bend | trans | -143.1 | 122 | 167.9 | -98.1 | 178.6 | -170.6 | 166.1 | 4.6 | 108.9 | A82 V87 | A82-R85 HydrophobicContact CB-CB 4.5Å; A82-R85 WeakPolarHBondContact CB-O 3.4Å; A82-R85 VanDerWaalsContact O-O 3.06Å; R85-V87 HydrophobicContact CB-CG2 4.34Å; R85-V87 PolarHBondContact O-N 3.37Å |
| 86 | K | 44 | Very low | 54.4 | Low | 211 Ų | 211 | 95.4 Ų | 95.4 | 92% | 0.917 | 55% | 0.545 | S | S | * | . | trans | -62.4 | 84.2 | 166.5 | -70.7 | 175.2 | 179 | 175 | 0 | 108.9 | P88 | K86-P88 VanDerWaalsContact O-CD 3.28Å; K86-P88 WeakPolarHBondContact O-CD 3.45Å | ||
| 87 | V | 46.7 | Very low | 55.6 | Low | 90 Ų | 90 | 92.2 Ų | 92.2 | 55% | 0.545 | 53% | 0.529 | S | S | . | . | trans | -81.5 | 109.8 | 164.4 | -177.6 | 0 | 0 | 0 | 0 | 105.1 | A82 R85 C89 | A82-V87 HydrophobicContact CB-CB 4.49Å; A82-V87 HydrophobicContact CB-CG2 4.12Å; R85-V87 HydrophobicContact CB-CG2 4.34Å; R85-V87 PolarHBondContact O-N 3.37Å; V87-C89 PolarHBondContact O-N 2.9Å | ||
| 88 | P | 48.2 | Very low | 57.2 | Low | 106 Ų | 106 | 99.6 Ų | 99.6 | 69% | 0.688 | 54% | 0.544 | S | S | * | . | trans | -64.2 | 130.2 | -179.6 | -14 | 29.1 | 0 | 0 | 0 | 108.4 | K86 | K86-P88 VanDerWaalsContact O-CD 3.28Å; K86-P88 WeakPolarHBondContact O-CD 3.45Å | ||
| 89 | C | 52.4 | Low | 59.1 | Low | 53 Ų | 53 | 97.2 Ų | 97.2 | 36% | 0.358 | 52% | 0.52 | S | S | . | . | trans | -57.5 | 131.6 | 171.1 | -72.8 | 0 | 0 | 0 | 0 | 108.9 | C79 V87 S91 | C79-C89 WeakPolarHBondContact CB-SG 3.32Å; C79-C89 WeakPolarHBondContact SG-CA 3.37Å; C79-C89 WeakPolarHBondContact SG-CB 3.41Å; C79-C89 CovalentContact SG-SG 2.06Å; C79-C89 PolarHBondContact SG-SG 2.92Å; V87-C89 PolarHBondContact O-N 2.9Å; C89-S91 PolarHBondContact O-N 3.32Å | ||
| 90 | P | 50.9 | Low | 60.9 | Low | 119 Ų | 119 | 97.1 Ų | 97.1 | 77% | 0.773 | 52% | 0.52 | S | S | * | . | S | Bend | trans | -77.5 | 1.6 | -153.3 | -15.8 | 31.3 | 0 | 0 | 0 | 115 | ||
| 91 | S | 55.8 | Low | 62.9 | Low | 35 Ų | 35 | 94.6 Ų | 94.6 | 25% | 0.245 | 52% | 0.518 | C | S | . | . | trans | -148.1 | 146.8 | 173.4 | 83.5 | 0 | 0 | 0 | 0 | 113.4 | C89 S93 T94 | C89-S91 PolarHBondContact O-N 3.32Å; S91-S93 PolarHBondContact O-N 2.95Å; S91-S93 PolarHBondContact OG-N 3.45Å; S91-S93 PolarHBondContact OG-OG 2.77Å; S91-T94 PolarHBondContact O-N 3.47Å; S91-T94 PolarHBondContact O-OG1 2.98Å | ||
| 92 | P | 58.5 | Low | 64.9 | Low | 131 Ų | 131 | 87.8 Ų | 87.8 | 85% | 0.851 | 48% | 0.484 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.4 | 5.3 | 174.4 | 25.3 | -33.2 | 0 | 0 | 0 | 114.1 | ||
| 93 | S | 68.9 | Low | 66.8 | Low | 32 Ų | 32 | 86.3 Ų | 86.3 | 22% | 0.224 | 47% | 0.471 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -108.2 | 1 | -179.6 | 75.6 | 0 | 0 | 0 | 0 | 114.1 | S91 L105 R106 H107 | S91-S93 PolarHBondContact O-N 2.95Å; S91-S93 PolarHBondContact OG-N 3.45Å; S91-S93 PolarHBondContact OG-OG 2.77Å; S93-L105 WeakPolarHBondContact OG-CD1 3.49Å; S93-R106 WeakPolarHBondContact O-CA 3.32Å; S93-R106 PolarHBondContact O-N 3Å; S93-H107 PolarHBondContact O-N 2.77Å |
| 94 | T | 75.9 | Confident | 68.4 | Low | 30 Ų | 30 | 80.4 Ų | 80.4 | 18% | 0.184 | 43% | 0.43 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92 | 146.1 | 179.1 | 57.2 | 0 | 0 | 0 | 0 | 112 | L76 S91 V103 T104 L105 | L76-T94 HydrophobicContact CD1-CG2 3.92Å; S91-T94 PolarHBondContact O-N 3.47Å; S91-T94 PolarHBondContact O-OG1 2.98Å; T94-V103 HydrophobicContact CG2-CG1 4.41Å; T94-T104 WeakPolarHBondContact CA-O 3.28Å; T94-L105 HydrophobicContact CG2-CD1 3.78Å |
| 95 | H | 82.3 | Confident | 69.9 | Low | 92 Ų | 92 | 76.8 Ų | 76.8 | 43% | 0.426 | 41% | 0.405 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -145.6 | 138 | 177.7 | 178.9 | -92 | 0 | 0 | 0 | 111 | V103 T104 H107 | H95-V103 WeakPolarHBondContact O-CA 3.28Å; H95-T104 PolarHBondContact N-O 2.91Å; H95-T104 PolarHBondContact O-N 3.38Å; H95-T104 PolarHBondContact O-OG1 3.41Å; H95-H107 HydrophobicContact CB-CB 3.55Å; H95-H107 AromaticContact CE1-CE1 3.97Å; H95-H107 AromaticContact CG-ND1 3.69Å; H95-H107 AromaticContact ND1-CE1 3.47Å; H95-H107 PolarHBondContact ND1-CE1 3.27Å; H95-H107 AromaticContact ND1-CG 3.85Å; H95-H107 AromaticContact ND1-ND1 3.51Å; H95-H107 AromaticContact ND1-NE2 3.79Å |
| 96 | F | 84.6 | Confident | 71.6 | Confident | 78 Ų | 78 | 72.5 Ų | 72.5 | 34% | 0.342 | 39% | 0.389 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.8 | 112.4 | 174.2 | -178.8 | -106.5 | 0 | 0 | 0 | 111 | Q80 R98 V103 | Q80-F96 HydrophobicContact CG-CE2 4.41Å; F96-R98 HydrophobicContact CD1-CG 4.17Å; F96-R98 HydrophobicContact CE1-CG 4.04Å; F96-V103 HydrophobicContact CB-CG2 4.28Å; F96-V103 HydrophobicContact CD2-CG2 3.89Å |
| 97 | C | 86.8 | Confident | 73.6 | Confident | 6 Ų | 6 | 63.6 Ų | 63.6 | 4% | 0.041 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85 | 114.4 | 173.6 | 179.1 | 0 | 0 | 0 | 0 | 110.2 | V99 C100 A101 R102 C117 | C97-V99 VanDerWaalsContact C-N 3.25Å; C97-V99 PolarHBondContact O-N 3.48Å; C97-V99 PolarHBondContact SG-N 2.95Å; C97-C100 HydrophobicContact CB-CB 4.2Å; C97-C100 PolarHBondContact O-N 3.01Å; C97-C100 PolarHBondContact SG-N 2.81Å; C97-C100 VanDerWaalsContact SG-N 3.44Å; C97-A101 VanDerWaalsContact O-CA 3.29Å; C97-A101 WeakPolarHBondContact O-CA 3.37Å; C97-A101 PolarHBondContact O-N 3.11Å; C97-R102 PolarHBondContact N-O 3.45Å; C97-R102 PolarHBondContact O-N 3.25Å; C97-C117 WeakPolarHBondContact CB-SG 3.28Å; C97-C117 PolarHBondContact SG-SG 3.16Å |
| 98 | R | 86.2 | Confident | 75.5 | Confident | 197 Ų | 197 | 60 Ų | 60 | 74% | 0.743 | 33% | 0.328 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66 | -24.4 | 177.8 | -62.1 | -178 | -175.8 | 179.9 | 0.2 | 113.9 | F96 | F96-R98 HydrophobicContact CD1-CG 4.17Å; F96-R98 HydrophobicContact CE1-CG 4.04Å |
| 99 | V | 88.6 | Confident | 77.6 | Confident | 33 Ų | 33 | 56.4 Ų | 56.4 | 20% | 0.2 | 30% | 0.302 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.8 | -47.3 | 179.7 | -176.8 | 0 | 0 | 0 | 0 | 110.3 | L4 C97 A101 | L4-V99 HydrophobicContact CB-CG2 4.32Å; L4-V99 HydrophobicContact CD1-CG2 4.39Å; C97-V99 VanDerWaalsContact C-N 3.25Å; C97-V99 PolarHBondContact O-N 3.48Å; C97-V99 PolarHBondContact SG-N 2.95Å; V99-A101 VanDerWaalsContact C-N 3.33Å |
| 100 | C | 87.1 | Confident | 79.5 | Confident | 36 Ų | 36 | 55.1 Ų | 55.1 | 24% | 0.243 | 29% | 0.291 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -81.1 | -11.4 | 176 | -68.7 | 0 | 0 | 0 | 0 | 113.8 | C97 R102 H110 C117 | C97-C100 HydrophobicContact CB-CB 4.2Å; C97-C100 PolarHBondContact O-N 3.01Å; C97-C100 PolarHBondContact SG-N 2.81Å; C97-C100 VanDerWaalsContact SG-N 3.44Å; C100-R102 VanDerWaalsContact C-N 3.28Å; C100-R102 HydrophobicContact CB-CG 3.81Å; C100-R102 PolarHBondContact O-N 3.5Å; C100-H110 PolarHBondContact SG-CE1 3.38Å; C100-H110 PolarHBondContact SG-ND1 3.36Å; C100-C117 PolarHBondContact SG-SG 3.39Å |
| 101 | A | 85.4 | Confident | 81.6 | Confident | 57 Ų | 57 | 50 Ų | 50 | 47% | 0.471 | 26% | 0.258 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 54 | 36.8 | -175.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | C97 V99 | C97-A101 VanDerWaalsContact O-CA 3.29Å; C97-A101 WeakPolarHBondContact O-CA 3.37Å; C97-A101 PolarHBondContact O-N 3.11Å; V99-A101 VanDerWaalsContact C-N 3.33Å |
| 102 | R | 82.3 | Confident | 83.6 | Confident | 39 Ų | 39 | 50.8 Ų | 50.8 | 15% | 0.147 | 26% | 0.257 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.9 | 161.1 | -179 | 66.5 | -179.9 | 179.1 | -169 | -2 | 113.4 | S72 P73 D75 C97 C100 T104 N116 | S72-R102 PolarHBondContact OG-NH2 3.36Å; P73-R102 PolarHBondContact O-NH1 3.3Å; D75-R102 HydrophobicContact CB-CB 4.08Å; D75-R102 WeakPolarHBondContact OD1-CB 3.34Å; C97-R102 PolarHBondContact N-O 3.45Å; C97-R102 PolarHBondContact O-N 3.25Å; C100-R102 VanDerWaalsContact C-N 3.28Å; C100-R102 HydrophobicContact CB-CG 3.81Å; C100-R102 PolarHBondContact O-N 3.5Å; R102-T104 HydrophobicContact CG-CG2 4.08Å; R102-N116 PolarHBondContact NH2-OD1 3.01Å |
| 103 | V | 81.8 | Confident | 85.4 | Confident | 8 Ų | 8 | 49.2 Ų | 49.2 | 5% | 0.048 | 24% | 0.237 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -91.2 | 123.4 | 173.1 | 179.2 | 0 | 0 | 0 | 0 | 109.9 | L76 C79 T94 H95 F96 | L76-V103 HydrophobicContact CB-CB 4.39Å; L76-V103 HydrophobicContact CB-CG1 4.45Å; L76-V103 HydrophobicContact CD1-CG1 4.46Å; L76-V103 PolarHBondContact N-O 3.49Å; C79-V103 HydrophobicContact CB-CG2 3.95Å; T94-V103 HydrophobicContact CG2-CG1 4.41Å; H95-V103 WeakPolarHBondContact O-CA 3.28Å; F96-V103 HydrophobicContact CB-CG2 4.28Å; F96-V103 HydrophobicContact CD2-CG2 3.89Å |
| 104 | T | 79.9 | Confident | 86.6 | Confident | 0 Ų | 0 | 47.9 Ų | 47.9 | 0% | 0 | 23% | 0.227 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -111.1 | 133.9 | -178.3 | 52.6 | 0 | 0 | 0 | 0 | 111.6 | P73 T94 H95 R102 H107 C117 | P73-T104 HydrophobicContact CB-CG2 3.84Å; P73-T104 HydrophobicContact CG-CG2 4.2Å; T94-T104 WeakPolarHBondContact CA-O 3.28Å; H95-T104 PolarHBondContact N-O 2.91Å; H95-T104 PolarHBondContact O-N 3.38Å; H95-T104 PolarHBondContact O-OG1 3.41Å; R102-T104 HydrophobicContact CG-CG2 4.08Å; T104-H107 VanDerWaalsContact OG1-CB 3.24Å; T104-H107 WeakPolarHBondContact OG1-CB 3.07Å; T104-H107 PolarHBondContact OG1-CD2 2.97Å; T104-C117 HydrophobicContact CG2-CB 3.74Å |
| 105 | L | 78.6 | Confident | 87.5 | Confident | 59 Ų | 59 | 47.3 Ų | 47.3 | 31% | 0.309 | 23% | 0.228 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -77.4 | 139 | 176.5 | -176.7 | 67.3 | 0 | 0 | 0 | 111.9 | S93 T94 H107 | S93-L105 WeakPolarHBondContact OG-CD1 3.49Å; T94-L105 HydrophobicContact CG2-CD1 3.78Å; L105-H107 PolarHBondContact O-N 3.47Å |
| 106 | R | 79.3 | Confident | 88 | Confident | 111 Ų | 111 | 43.3 Ų | 43.3 | 42% | 0.419 | 21% | 0.209 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 44.9 | 46.1 | -175.4 | -69.4 | 179.5 | 172.4 | -168.7 | -0.6 | 111.3 | S93 D108 G119 E236 | S93-R106 WeakPolarHBondContact O-CA 3.32Å; S93-R106 PolarHBondContact O-N 3Å; R106-D108 PolarHBondContact O-N 2.75Å; R106-G119 WeakPolarHBondContact O-CA 3.39Å; R106-E236 IonicContact CZ-OE1 3.73Å; R106-E236 VanDerWaalsContact CZ-OE1 3.32Å; R106-E236 IonicContact NH1-OE1 2.77Å; R106-E236 PolarHBondContact NH1-OE1 3.44Å; R106-E236 IonicContact NH2-OE1 3.02Å; R106-E236 PolarHBondContact NH2-OE1 3.41Å |
| 107 | H | 84.6 | Confident | 88.4 | Confident | 24 Ų | 24 | 39.6 Ų | 39.6 | 11% | 0.111 | 19% | 0.193 | C | C | . | . | trans | -60.2 | 129.8 | -177.3 | 176 | -93.2 | 0 | 0 | 0 | 111 | S93 H95 T104 L105 | S93-H107 PolarHBondContact O-N 2.77Å; H95-H107 HydrophobicContact CB-CB 3.55Å; H95-H107 AromaticContact CE1-CE1 3.97Å; H95-H107 AromaticContact CG-ND1 3.69Å; H95-H107 AromaticContact ND1-CE1 3.47Å; H95-H107 PolarHBondContact ND1-CE1 3.27Å; H95-H107 AromaticContact ND1-CG 3.85Å; H95-H107 AromaticContact ND1-ND1 3.51Å; H95-H107 AromaticContact ND1-NE2 3.79Å; T104-H107 VanDerWaalsContact OG1-CB 3.24Å; T104-H107 WeakPolarHBondContact OG1-CB 3.07Å; T104-H107 PolarHBondContact OG1-CD2 2.97Å; L105-H107 PolarHBondContact O-N 3.47Å | ||
| 108 | D | 88.6 | Confident | 88.7 | Confident | 13 Ų | 13 | 39.3 Ų | 39.3 | 7% | 0.07 | 19% | 0.191 | C | C | . | . | trans | -100.5 | -59.2 | 171.3 | -168.8 | 68.3 | 0 | 0 | 0 | 110.9 | R106 I118 M123 Q206 R216 | R106-D108 PolarHBondContact O-N 2.75Å; D108-I118 PolarHBondContact N-O 2.9Å; D108-M123 HydrophobicContact CB-CE 3.7Å; D108-Q206 PolarHBondContact OD2-NE2 2.98Å; D108-R216 WeakPolarHBondContact OD1-CB 3.38Å | ||
| 109 | H | 91.5 | Very high | 88.8 | Confident | 31 Ų | 31 | 29.9 Ų | 29.9 | 14% | 0.144 | 16% | 0.156 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -161.5 | 165 | 178.5 | 65.2 | -77.8 | 0 | 0 | 0 | 112.6 | I118 F126 | H109-I118 PolarHBondContact O-N 2.82Å; H109-F126 AromaticContact CE1-CE1 3.86Å; H109-F126 AromaticContact CE1-CZ 3.67Å; H109-F126 AromaticContact NE2-CE2 3.96Å; H109-F126 AromaticContact NE2-CZ 3.71Å |
| 110 | H | 92.9 | Very high | 88.6 | Confident | 27 Ų | 27 | 30.1 Ų | 30.1 | 13% | 0.125 | 16% | 0.159 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -85.4 | 119.5 | 162 | -174.8 | 88.5 | 0 | 0 | 0 | 109.1 | N8 C100 F112 | N8-H110 PolarHBondContact OD1-CE1 3.39Å; N8-H110 VanDerWaalsContact OD1-CE1 3.28Å; N8-H110 PolarHBondContact OD1-NE2 2.87Å; C100-H110 PolarHBondContact SG-CE1 3.38Å; C100-H110 PolarHBondContact SG-ND1 3.36Å; H110-F112 AromaticContact CD2-CD1 3.79Å; H110-F112 AromaticContact CD2-CE1 3.71Å; H110-F112 AromaticContact CD2-CZ 4Å; H110-F112 AromaticContact NE2-CD1 3.9Å |
| 111 | C | 95.2 | Very high | 88.5 | Confident | 11 Ų | 11 | 32.4 Ų | 32.4 | 7% | 0.074 | 16% | 0.162 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -96.6 | 113.8 | 177.4 | -176.3 | 0 | 0 | 0 | 0 | 109.3 | F113 T114 G115 N116 I118 F126 | C111-F113 VanDerWaalsContact C-N 3.32Å; C111-F113 PolarHBondContact O-N 3.33Å; C111-T114 WeakPolarHBondContact CB-OG1 3.44Å; C111-T114 PolarHBondContact O-N 3.4Å; C111-T114 PolarHBondContact O-OG1 3.22Å; C111-G115 PolarHBondContact O-N 3.06Å; C111-G115 VanDerWaalsContact O-N 3.1Å; C111-N116 PolarHBondContact N-O 3.37Å; C111-N116 PolarHBondContact O-N 3.27Å; C111-N116 VanDerWaalsContact O-N 3.17Å; C111-I118 HydrophobicContact CB-CD1 4.06Å; C111-I118 HydrophobicContact CB-CG1 3.81Å; C111-F126 HydrophobicContact CB-CE2 4.48Å |
| 112 | F | 96.1 | Very high | 88.8 | Confident | 51 Ų | 51 | 29.7 Ų | 29.7 | 22% | 0.224 | 14% | 0.14 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -66.2 | -34.7 | 178.3 | -67.5 | -74 | 0 | 0 | 0 | 112.2 | L4 L7 A11 P12 H110 T114 G115 | L4-F112 HydrophobicContact CD2-CE1 4.42Å; L4-F112 HydrophobicContact CD2-CZ 3.92Å; L7-F112 HydrophobicContact CB-CD1 3.86Å; L7-F112 HydrophobicContact CB-CE1 4.18Å; L7-F112 HydrophobicContact CB-CG 4.39Å; L7-F112 HydrophobicContact CD2-CB 4.19Å; L7-F112 HydrophobicContact CD2-CD1 3.72Å; L7-F112 HydrophobicContact CD2-CD2 3.59Å; L7-F112 HydrophobicContact CD2-CE1 3.94Å; L7-F112 HydrophobicContact CD2-CE2 3.83Å; L7-F112 HydrophobicContact CD2-CG 3.54Å; L7-F112 HydrophobicContact CD2-CZ 4Å; L7-F112 HydrophobicContact CG-CB 3.89Å; L7-F112 HydrophobicContact CG-CD1 3.64Å; L7-F112 HydrophobicContact CG-CD2 4.22Å; L7-F112 HydrophobicContact CG-CE1 4.22Å; L7-F112 HydrophobicContact CG-CG 3.64Å; A11-F112 HydrophobicContact CB-CB 3.99Å; P12-F112 WeakPolarHBondContact CD-O 3.29Å; P12-F112 VanDerWaalsContact CG-O 3.23Å; P12-F112 WeakPolarHBondContact CG-O 3.39Å; H110-F112 AromaticContact CD2-CD1 3.79Å; H110-F112 AromaticContact CD2-CE1 3.71Å; H110-F112 AromaticContact CD2-CZ 4Å; H110-F112 AromaticContact NE2-CD1 3.9Å; F112-T114 VanDerWaalsContact C-N 3.29Å; F112-T114 PolarHBondContact O-N 3.01Å; F112-G115 PolarHBondContact O-N 3.5Å |
| 113 | F | 96.5 | Very high | 89.3 | Confident | 98 Ų | 98 | 28.8 Ų | 28.8 | 43% | 0.43 | 14% | 0.138 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -65.6 | -28.7 | -179.5 | -69.2 | -79.8 | 0 | 0 | 0 | 113.7 | A11 P12 Y14 F15 Y65 C111 | A11-F113 HydrophobicContact CB-CD1 3.99Å; A11-F113 HydrophobicContact CB-CE1 4.26Å; A11-F113 HydrophobicContact CB-CG 4.33Å; P12-F113 WeakPolarHBondContact CA-O 3.42Å; Y14-F113 HydrophobicContact CD1-CE1 4.16Å; F15-F113 HydrophobicContact CB-CD1 4.45Å; Y65-F113 VanDerWaalsContact CE2-O 3.24Å; Y65-F113 WeakPolarHBondContact CE2-O 3.36Å; Y65-F113 PolarHBondContact OH-O 3.46Å; C111-F113 VanDerWaalsContact C-N 3.32Å; C111-F113 PolarHBondContact O-N 3.33Å |
| 114 | T | 95.4 | Very high | 89.9 | Confident | 4 Ų | 4 | 28.8 Ų | 28.8 | 3% | 0.025 | 14% | 0.137 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -97.1 | -3.9 | 173.4 | 64.3 | 0 | 0 | 0 | 0 | 112.5 | Y65 V68 I69 C111 F112 N116 F129 | Y65-T114 HydrophobicContact CD2-CG2 4.01Å; Y65-T114 HydrophobicContact CE2-CG2 3.91Å; V68-T114 HydrophobicContact CB-CG2 4.45Å; V68-T114 HydrophobicContact CG1-CG2 3.87Å; I69-T114 WeakPolarHBondContact CG1-O 3.27Å; C111-T114 WeakPolarHBondContact CB-OG1 3.44Å; C111-T114 PolarHBondContact O-N 3.4Å; C111-T114 PolarHBondContact O-OG1 3.22Å; F112-T114 VanDerWaalsContact C-N 3.29Å; F112-T114 PolarHBondContact O-N 3.01Å; T114-N116 PolarHBondContact O-N 2.9Å; T114-N116 VanDerWaalsContact O-N 3.15Å; T114-N116 PolarHBondContact OG1-N 2.93Å; T114-F129 HydrophobicContact CG2-CE1 4.23Å |
| 115 | G | 93.8 | Very high | 90.6 | Very high | 19 Ų | 19 | 28.8 Ų | 28.8 | 20% | 0.196 | 14% | 0.137 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 63.2 | 14.6 | -174.1 | 0 | 0 | 0 | 0 | 0 | 114 | N8 C111 F112 | N8-G115 PolarHBondContact ND2-O 3.4Å; N8-G115 VanDerWaalsContact OD1-CA 3.24Å; N8-G115 WeakPolarHBondContact OD1-CA 3.5Å; N8-G115 PolarHBondContact OD1-O 3.27Å; C111-G115 PolarHBondContact O-N 3.06Å; C111-G115 VanDerWaalsContact O-N 3.1Å; F112-G115 PolarHBondContact O-N 3.5Å |
| 116 | N | 92.5 | Very high | 91.4 | Very high | 7 Ų | 7 | 26.2 Ų | 26.2 | 4% | 0.037 | 12% | 0.123 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -140.5 | 155.3 | -163.5 | -161 | 14.9 | 0 | 0 | 0 | 113.5 | V68 I69 S72 R102 C111 T114 | V68-N116 PolarHBondContact O-ND2 3.12Å; I69-N116 PolarHBondContact O-ND2 2.85Å; S72-N116 PolarHBondContact OG-ND2 3.29Å; S72-N116 PolarHBondContact OG-OD1 2.91Å; R102-N116 PolarHBondContact NH2-OD1 3.01Å; C111-N116 PolarHBondContact N-O 3.37Å; C111-N116 PolarHBondContact O-N 3.27Å; C111-N116 VanDerWaalsContact O-N 3.17Å; T114-N116 PolarHBondContact O-N 2.9Å; T114-N116 VanDerWaalsContact O-N 3.15Å; T114-N116 PolarHBondContact OG1-N 2.93Å |
| 117 | C | 92.6 | Very high | 92.2 | Very high | 0 Ų | 0 | 21.1 Ų | 21.1 | 0% | 0 | 10% | 0.104 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -72.5 | 139.6 | 169.1 | -73.6 | 0 | 0 | 0 | 0 | 111.8 | P73 C97 C100 T104 N122 | P73-C117 VanDerWaalsContact CD-O 3.31Å; P73-C117 WeakPolarHBondContact CD-O 3.48Å; P73-C117 HydrophobicContact CG-CB 4.16Å; P73-C117 WeakPolarHBondContact CG-O 3.07Å; C97-C117 WeakPolarHBondContact CB-SG 3.28Å; C97-C117 PolarHBondContact SG-SG 3.16Å; C100-C117 PolarHBondContact SG-SG 3.39Å; T104-C117 HydrophobicContact CG2-CB 3.74Å; C117-N122 PolarHBondContact O-ND2 3.15Å |
| 118 | I | 93 | Very high | 92.8 | Very high | 0 Ų | 0 | 20.1 Ų | 20.1 | 0% | 0 | 10% | 0.1 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -99.8 | 127.2 | 171.3 | -49.1 | -53.9 | 0 | 0 | 0 | 108.8 | V68 D108 H109 C111 N122 M123 F126 | V68-I118 HydrophobicContact CG1-CD1 3.44Å; V68-I118 VanDerWaalsContact CG1-CD1 3.44Å; D108-I118 PolarHBondContact N-O 2.9Å; H109-I118 PolarHBondContact O-N 2.82Å; C111-I118 HydrophobicContact CB-CD1 4.06Å; C111-I118 HydrophobicContact CB-CG1 3.81Å; I118-N122 WeakPolarHBondContact CA-OD1 3.2Å; I118-M123 HydrophobicContact CG2-CE 3.97Å; I118-M123 HydrophobicContact CG2-SD 4.12Å; I118-F126 HydrophobicContact CD1-CB 4.19Å; I118-F126 HydrophobicContact CD1-CD2 3.61Å; I118-F126 HydrophobicContact CD1-CE2 4.3Å; I118-F126 HydrophobicContact CD1-CG 4.06Å; I118-F126 HydrophobicContact CG1-CD2 3.8Å; I118-F126 HydrophobicContact CG1-CE2 4.15Å; I118-F126 HydrophobicContact CG1-CG 4.12Å; I118-F126 HydrophobicContact CG2-CB 3.87Å; I118-F126 HydrophobicContact CG2-CD1 4.12Å; I118-F126 HydrophobicContact CG2-CD2 4.41Å; I118-F126 HydrophobicContact CG2-CG 3.86Å |
| 119 | G | 89.2 | Confident | 93.2 | Very high | 0 Ų | 0 | 19.9 Ų | 19.9 | 0% | 0 | 10% | 0.098 | C | C | . | . | trans | -154.9 | -162.1 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | R106 R121 N122 M123 | R106-G119 WeakPolarHBondContact O-CA 3.39Å; G119-R121 VanDerWaalsContact C-N 3.31Å; G119-R121 PolarHBondContact O-N 3.45Å; G119-N122 PolarHBondContact N-OD1 3.4Å; G119-N122 PolarHBondContact O-N 3.05Å; G119-N122 PolarHBondContact O-OD1 3.29Å; G119-N122 VanDerWaalsContact O-OD1 3.13Å; G119-M123 VanDerWaalsContact O-CB 3.28Å; G119-M123 WeakPolarHBondContact O-CB 3.29Å; G119-M123 PolarHBondContact O-N 3.23Å | ||
| 120 | S | 84.6 | Confident | 93.5 | Very high | 38 Ų | 38 | 18.6 Ų | 18.6 | 27% | 0.266 | 9% | 0.092 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -58.4 | -37.2 | -172.5 | 51 | 0 | 0 | 0 | 0 | 114.9 | ||
| 121 | R | 85.5 | Confident | 93.8 | Very high | 83 Ų | 83 | 20 Ų | 20 | 31% | 0.313 | 10% | 0.101 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -71.6 | -29.9 | -174.8 | -65.8 | -173 | 69.4 | 140.7 | -4.3 | 113.7 | D74 G119 | D74-R121 IonicContact OD1-CZ 3.32Å; D74-R121 IonicContact OD1-NH1 2.69Å; D74-R121 PolarHBondContact OD1-NH1 3.48Å; D74-R121 WeakPolarHBondContact OD2-CD 3.43Å; D74-R121 IonicContact OD2-CZ 3.97Å; D74-R121 IonicContact OD2-NE 2.7Å; D74-R121 IonicContact OD2-NH1 3.56Å; D74-R121 PolarHBondContact OD2-NH1 2.89Å; G119-R121 VanDerWaalsContact C-N 3.31Å; G119-R121 PolarHBondContact O-N 3.45Å |
| 122 | N | 91.9 | Very high | 93.9 | Very high | 0 Ų | 0 | 20 Ų | 20 | 0% | 0 | 10% | 0.099 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -120.6 | 3.4 | -176.3 | 58.6 | 4.5 | 0 | 0 | 0 | 114.4 | V68 N71 C117 I118 G119 R124 N125 F126 | V68-N122 HydrophobicContact CG1-CB 4.47Å; V68-N122 PolarHBondContact O-ND2 2.89Å; N71-N122 HydrophobicContact CB-CB 4.05Å; N71-N122 WeakPolarHBondContact O-CB 3.5Å; N71-N122 PolarHBondContact O-ND2 2.69Å; C117-N122 PolarHBondContact O-ND2 3.15Å; I118-N122 WeakPolarHBondContact CA-OD1 3.2Å; G119-N122 PolarHBondContact N-OD1 3.4Å; G119-N122 PolarHBondContact O-N 3.05Å; G119-N122 PolarHBondContact O-OD1 3.29Å; G119-N122 VanDerWaalsContact O-OD1 3.13Å; N122-R124 VanDerWaalsContact C-N 3.31Å; N122-R124 PolarHBondContact O-N 3.36Å; N122-N125 PolarHBondContact O-N 3.35Å; N122-N125 VanDerWaalsContact O-N 3.15Å; N122-F126 PolarHBondContact O-N 2.84Å |
| 123 | M | 92.3 | Very high | 94 | Very high | 21 Ų | 21 | 18 Ų | 18 | 10% | 0.103 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -54.9 | -44.5 | 179.1 | -176.5 | 59.5 | 73.4 | 0 | 0 | 112.5 | D108 I118 G119 N125 F126 V127 I210 V237 | D108-M123 HydrophobicContact CB-CE 3.7Å; I118-M123 HydrophobicContact CG2-CE 3.97Å; I118-M123 HydrophobicContact CG2-SD 4.12Å; G119-M123 VanDerWaalsContact O-CB 3.28Å; G119-M123 WeakPolarHBondContact O-CB 3.29Å; G119-M123 PolarHBondContact O-N 3.23Å; M123-N125 PolarHBondContact O-N 3.44Å; M123-F126 PolarHBondContact O-N 3.4Å; M123-V127 WeakPolarHBondContact O-CG2 3.45Å; M123-V127 PolarHBondContact O-N 2.87Å; M123-V127 HydrophobicContact SD-CG2 4.36Å; M123-I210 HydrophobicContact CG-CD1 4.1Å; M123-V237 HydrophobicContact CB-CG1 4.1Å; M123-V237 HydrophobicContact CG-CG1 3.85Å |
| 124 | R | 93.1 | Very high | 94.1 | Very high | 7 Ų | 7 | 14.3 Ų | 14.3 | 3% | 0.026 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -55.3 | -53.9 | 175.9 | -179.1 | -167.8 | -176.4 | -177.6 | 13.4 | 111.4 | N122 F126 V127 L128 V237 F238 W242 | N122-R124 VanDerWaalsContact C-N 3.31Å; N122-R124 PolarHBondContact O-N 3.36Å; R124-F126 VanDerWaalsContact C-N 3.25Å; R124-F126 PolarHBondContact O-N 2.88Å; R124-V127 PolarHBondContact O-N 3.31Å; R124-L128 HydrophobicContact CG-CD1 3.99Å; R124-L128 WeakPolarHBondContact O-CG 3.39Å; R124-L128 PolarHBondContact O-N 3.45Å; R124-V237 HydrophobicContact CB-CG1 4.27Å; R124-F238 HydrophobicContact CG-CD1 3.7Å; R124-F238 HydrophobicContact CG-CE1 4.08Å; R124-F238 HydrophobicContact CG-CG 4.26Å; R124-W242 PolarHBondContact NH2-O 3.47Å |
| 125 | N | 94.9 | Very high | 94.3 | Very high | 1 Ų | 1 | 17.3 Ų | 17.3 | 1% | 0.005 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -64.3 | -35.1 | -177.3 | -57.1 | -33.1 | 0 | 0 | 0 | 110.4 | L67 V68 N71 N122 M123 L128 F129 | L67-N125 HydrophobicContact CB-CB 4.2Å; V68-N125 VanDerWaalsContact CG2-C 3.46Å; V68-N125 HydrophobicContact CG2-CB 3.61Å; N71-N125 PolarHBondContact ND2-ND2 2.81Å; N122-N125 PolarHBondContact O-N 3.35Å; N122-N125 VanDerWaalsContact O-N 3.15Å; M123-N125 PolarHBondContact O-N 3.44Å; N125-L128 PolarHBondContact O-N 2.67Å; N125-F129 WeakPolarHBondContact O-CB 3.43Å; N125-F129 PolarHBondContact O-N 2.85Å |
| 126 | F | 95.8 | Very high | 94.5 | Very high | 5 Ų | 5 | 17 Ų | 17 | 2% | 0.022 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -63.4 | -47.1 | 175.3 | 177.8 | -100.1 | 0 | 0 | 0 | 112.1 | V68 H109 C111 I118 N122 M123 R124 L128 F129 C130 Q206 | V68-F126 HydrophobicContact CG2-CB 4.05Å; V68-F126 VanDerWaalsContact CG2-N 3.3Å; H109-F126 AromaticContact CE1-CE1 3.86Å; H109-F126 AromaticContact CE1-CZ 3.67Å; H109-F126 AromaticContact NE2-CE2 3.96Å; H109-F126 AromaticContact NE2-CZ 3.71Å; C111-F126 HydrophobicContact CB-CE2 4.48Å; I118-F126 HydrophobicContact CD1-CB 4.19Å; I118-F126 HydrophobicContact CD1-CD2 3.61Å; I118-F126 HydrophobicContact CD1-CE2 4.3Å; I118-F126 HydrophobicContact CD1-CG 4.06Å; I118-F126 HydrophobicContact CG1-CD2 3.8Å; I118-F126 HydrophobicContact CG1-CE2 4.15Å; I118-F126 HydrophobicContact CG1-CG 4.12Å; I118-F126 HydrophobicContact CG2-CB 3.87Å; I118-F126 HydrophobicContact CG2-CD1 4.12Å; I118-F126 HydrophobicContact CG2-CD2 4.41Å; I118-F126 HydrophobicContact CG2-CG 3.86Å; N122-F126 PolarHBondContact O-N 2.84Å; M123-F126 PolarHBondContact O-N 3.4Å; R124-F126 VanDerWaalsContact C-N 3.25Å; R124-F126 PolarHBondContact O-N 2.88Å; F126-L128 VanDerWaalsContact C-N 3.35Å; F126-L128 PolarHBondContact O-N 3.45Å; F126-F129 HydrophobicContact CD2-CD1 4.25Å; F126-F129 HydrophobicContact CE2-CD1 4.46Å; F126-F129 WeakPolarHBondContact O-CB 3.24Å; F126-F129 PolarHBondContact O-N 3.47Å; F126-C130 PolarHBondContact O-N 2.93Å; F126-C130 PolarHBondContact O-SG 2.92Å; F126-C130 VanDerWaalsContact O-SG 3.41Å; F126-Q206 HydrophobicContact CD1-CG 4.25Å; F126-Q206 HydrophobicContact CE1-CG 3.87Å |
| 127 | V | 96.1 | Very high | 94.8 | Very high | 3 Ų | 3 | 17.2 Ų | 17.2 | 2% | 0.018 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -62.7 | -43.6 | 177.9 | 176.1 | 0 | 0 | 0 | 0 | 111.1 | M123 R124 C130 L131 Q206 L207 I210 F238 | M123-V127 WeakPolarHBondContact O-CG2 3.45Å; M123-V127 PolarHBondContact O-N 2.87Å; M123-V127 HydrophobicContact SD-CG2 4.36Å; R124-V127 PolarHBondContact O-N 3.31Å; V127-C130 PolarHBondContact O-N 3.24Å; V127-L131 WeakPolarHBondContact O-CB 3.45Å; V127-L131 PolarHBondContact O-N 2.9Å; V127-Q206 HydrophobicContact CG2-CB 3.84Å; V127-L207 HydrophobicContact CG1-CD1 4.44Å; V127-L207 HydrophobicContact CG1-CD2 3.84Å; V127-L207 HydrophobicContact CG1-CG 3.89Å; V127-I210 HydrophobicContact CG2-CD1 3.91Å; V127-F238 HydrophobicContact CB-CZ 4.08Å; V127-F238 HydrophobicContact CG1-CZ 3.84Å |
| 128 | L | 96.8 | Very high | 95.1 | Very high | 3 Ų | 3 | 21.6 Ų | 21.6 | 2% | 0.016 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -67.6 | -39.6 | 177.7 | -66.9 | 174.5 | 0 | 0 | 0 | 112.3 | N64 R124 N125 F126 C130 L131 Y132 F238 G245 L246 | N64-L128 HydrophobicContact CB-CB 4.28Å; N64-L128 WeakPolarHBondContact OD1-CB 3.37Å; R124-L128 HydrophobicContact CG-CD1 3.99Å; R124-L128 WeakPolarHBondContact O-CG 3.39Å; R124-L128 PolarHBondContact O-N 3.45Å; N125-L128 PolarHBondContact O-N 2.67Å; F126-L128 VanDerWaalsContact C-N 3.35Å; F126-L128 PolarHBondContact O-N 3.45Å; L128-C130 VanDerWaalsContact C-N 3.35Å; L128-C130 PolarHBondContact O-N 3.36Å; L128-L131 HydrophobicContact CD2-CD2 4.47Å; L128-L131 PolarHBondContact O-N 2.86Å; L128-Y132 HydrophobicContact CB-CD2 4.41Å; L128-Y132 HydrophobicContact CD2-CE2 4.34Å; L128-Y132 WeakPolarHBondContact O-CB 3.29Å; L128-Y132 VanDerWaalsContact O-CD2 3.27Å; L128-Y132 WeakPolarHBondContact O-CD2 3.46Å; L128-Y132 PolarHBondContact O-N 3.28Å; L128-F238 HydrophobicContact CD2-CE1 4.13Å; L128-F238 HydrophobicContact CG-CE1 4.17Å; L128-G245 WeakPolarHBondContact CD1-O 3.5Å; L128-L246 HydrophobicContact CD2-CD1 3.85Å |
| 129 | F | 97.6 | Very high | 95.3 | Very high | 9 Ų | 9 | 22.9 Ų | 22.9 | 4% | 0.039 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -54.8 | -50.2 | 171 | 157.7 | -115.6 | 0 | 0 | 0 | 110.9 | F15 N64 Y65 T114 N125 F126 T133 | F15-F129 HydrophobicContact CD2-CZ 4.5Å; F15-F129 HydrophobicContact CE1-CE2 4.08Å; F15-F129 AromaticContact CE2-CE2 3.73Å; F15-F129 HydrophobicContact CE2-CE2 3.73Å; F15-F129 HydrophobicContact CE2-CZ 4.09Å; F15-F129 HydrophobicContact CZ-CD2 4.48Å; F15-F129 AromaticContact CZ-CE2 3.49Å; F15-F129 HydrophobicContact CZ-CE2 3.49Å; F15-F129 VanDerWaalsContact CZ-CE2 3.49Å; F15-F129 HydrophobicContact CZ-CZ 4.18Å; N64-F129 HydrophobicContact CB-CB 3.96Å; Y65-F129 HydrophobicContact CD2-CD2 4.13Å; Y65-F129 AromaticContact CD2-CE2 3.74Å; Y65-F129 HydrophobicContact CD2-CE2 3.74Å; Y65-F129 AromaticContact CD2-CZ 3.95Å; Y65-F129 HydrophobicContact CD2-CZ 3.95Å; Y65-F129 HydrophobicContact CG-CE2 4.41Å; T114-F129 HydrophobicContact CG2-CE1 4.23Å; N125-F129 WeakPolarHBondContact O-CB 3.43Å; N125-F129 PolarHBondContact O-N 2.85Å; F126-F129 HydrophobicContact CD2-CD1 4.25Å; F126-F129 HydrophobicContact CE2-CD1 4.46Å; F126-F129 WeakPolarHBondContact O-CB 3.24Å; F126-F129 PolarHBondContact O-N 3.47Å; F129-T133 WeakPolarHBondContact CD2-OG1 3.36Å; F129-T133 WeakPolarHBondContact CE2-OG1 3.38Å; F129-T133 WeakPolarHBondContact O-CB 3.28Å; F129-T133 PolarHBondContact O-N 2.97Å; F129-T133 PolarHBondContact O-OG1 2.98Å |
| 130 | C | 98.4 | Very high | 95.7 | Very high | 3 Ų | 3 | 22.9 Ų | 22.9 | 2% | 0.02 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -63.5 | -43.1 | 177.3 | -68.3 | 0 | 0 | 0 | 0 | 112.3 | F126 V127 L128 S134 C199 C203 | F126-C130 PolarHBondContact O-N 2.93Å; F126-C130 PolarHBondContact O-SG 2.92Å; F126-C130 VanDerWaalsContact O-SG 3.41Å; V127-C130 PolarHBondContact O-N 3.24Å; L128-C130 VanDerWaalsContact C-N 3.35Å; L128-C130 PolarHBondContact O-N 3.36Å; C130-S134 VanDerWaalsContact O-CB 3.29Å; C130-S134 WeakPolarHBondContact O-CB 3.36Å; C130-S134 PolarHBondContact O-N 2.7Å; C130-C199 HydrophobicContact CB-CB 4.41Å; C130-C199 WeakPolarHBondContact O-CB 3.22Å; C130-C203 HydrophobicContact CB-CB 3.87Å |
| 131 | L | 98.1 | Very high | 96.3 | Very high | 57 Ų | 57 | 22.8 Ų | 22.8 | 30% | 0.298 | 11% | 0.114 | S | C | . | . | H | α-helix | trans | -59.5 | -54.7 | 177.7 | 177.7 | 63.2 | 0 | 0 | 0 | 111.5 | V127 L128 S134 L135 L246 | V127-L131 WeakPolarHBondContact O-CB 3.45Å; V127-L131 PolarHBondContact O-N 2.9Å; L128-L131 HydrophobicContact CD2-CD2 4.47Å; L128-L131 PolarHBondContact O-N 2.86Å; L131-S134 WeakPolarHBondContact O-CB 3.3Å; L131-S134 PolarHBondContact O-N 3.21Å; L131-L135 HydrophobicContact CD1-CD1 4.2Å; L131-L135 HydrophobicContact CD1-CG 4.42Å; L131-L135 HydrophobicContact CG-CD1 4.18Å; L131-L135 WeakPolarHBondContact O-CG 3.38Å; L131-L135 PolarHBondContact O-N 3.44Å; L131-L246 HydrophobicContact CD2-CD1 4.02Å |
| 132 | Y | 98.4 | Very high | 96.8 | Very high | 12 Ų | 12 | 22.9 Ų | 22.9 | 5% | 0.047 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -70 | -34 | -176.4 | -80.3 | -72.5 | 0 | 0 | 0 | 112.9 | F56 L57 N60 L128 S134 L135 A136 L246 | F56-Y132 AromaticContact CE1-CE1 3.78Å; F56-Y132 HydrophobicContact CE1-CE1 3.78Å; F56-Y132 HydrophobicContact CZ-CE1 4.16Å; L57-Y132 HydrophobicContact CD2-CD1 3.88Å; L57-Y132 HydrophobicContact CD2-CE1 4.14Å; N60-Y132 HydrophobicContact CB-CD1 3.46Å; N60-Y132 VanDerWaalsContact CB-CD1 3.46Å; N60-Y132 HydrophobicContact CB-CD2 3.61Å; N60-Y132 HydrophobicContact CB-CE1 3.75Å; N60-Y132 HydrophobicContact CB-CE2 3.89Å; N60-Y132 HydrophobicContact CB-CG 3.41Å; N60-Y132 VanDerWaalsContact CB-CG 3.41Å; L128-Y132 HydrophobicContact CB-CD2 4.41Å; L128-Y132 HydrophobicContact CD2-CE2 4.34Å; L128-Y132 WeakPolarHBondContact O-CB 3.29Å; L128-Y132 VanDerWaalsContact O-CD2 3.27Å; L128-Y132 WeakPolarHBondContact O-CD2 3.46Å; L128-Y132 PolarHBondContact O-N 3.28Å; Y132-S134 VanDerWaalsContact C-N 3.33Å; Y132-L135 HydrophobicContact CD1-CD1 4.47Å; Y132-L135 PolarHBondContact O-N 2.97Å; Y132-A136 VanDerWaalsContact O-CB 3.23Å; Y132-A136 WeakPolarHBondContact O-CB 3.21Å; Y132-A136 PolarHBondContact O-N 3.34Å; Y132-L246 HydrophobicContact CE2-CD1 4.36Å; Y132-L246 WeakPolarHBondContact CE2-O 3.35Å; Y132-L246 VanDerWaalsContact CZ-O 3.24Å; Y132-L246 PolarHBondContact OH-O 3.14Å |
| 133 | T | 98.6 | Very high | 96.9 | Very high | 7 Ų | 7 | 23.4 Ų | 23.4 | 4% | 0.043 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -63.8 | -41.6 | 171.7 | -57.2 | 0 | 0 | 0 | 0 | 110.9 | F15 F129 A136 C137 I195 | F15-T133 HydrophobicContact CE2-CG2 4.09Å; F129-T133 WeakPolarHBondContact CD2-OG1 3.36Å; F129-T133 WeakPolarHBondContact CE2-OG1 3.38Å; F129-T133 WeakPolarHBondContact O-CB 3.28Å; F129-T133 PolarHBondContact O-N 2.97Å; F129-T133 PolarHBondContact O-OG1 2.98Å; T133-A136 PolarHBondContact O-N 3.41Å; T133-C137 WeakPolarHBondContact O-CB 3.3Å; T133-C137 PolarHBondContact O-N 3.43Å; T133-C137 PolarHBondContact O-SG 3.49Å; T133-I195 HydrophobicContact CG2-CG2 4.08Å |
| 134 | S | 98.6 | Very high | 97.1 | Very high | 21 Ų | 21 | 22.4 Ų | 22.4 | 15% | 0.147 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -62.6 | -46.1 | 176.1 | -173.4 | 0 | 0 | 0 | 0 | 111.9 | C130 L131 Y132 C137 L138 G196 A200 | C130-S134 VanDerWaalsContact O-CB 3.29Å; C130-S134 WeakPolarHBondContact O-CB 3.36Å; C130-S134 PolarHBondContact O-N 2.7Å; L131-S134 WeakPolarHBondContact O-CB 3.3Å; L131-S134 PolarHBondContact O-N 3.21Å; Y132-S134 VanDerWaalsContact C-N 3.33Å; S134-C137 PolarHBondContact O-N 2.81Å; S134-L138 WeakPolarHBondContact O-CB 3.37Å; S134-L138 PolarHBondContact O-N 2.89Å; S134-G196 PolarHBondContact OG-O 3.23Å; S134-A200 WeakPolarHBondContact OG-CB 3.17Å |
| 135 | L | 98.6 | Very high | 97.2 | Very high | 68 Ų | 68 | 23.8 Ų | 23.8 | 36% | 0.356 | 13% | 0.132 | S | C | . | . | H | α-helix | trans | -65.1 | -41.4 | 176.9 | -67.5 | 174.8 | 0 | 0 | 0 | 112.6 | L57 L131 Y132 L138 Y139 | L57-L135 HydrophobicContact CD2-CB 3.88Å; L57-L135 HydrophobicContact CD2-CD1 4.33Å; L131-L135 HydrophobicContact CD1-CD1 4.2Å; L131-L135 HydrophobicContact CD1-CG 4.42Å; L131-L135 HydrophobicContact CG-CD1 4.18Å; L131-L135 WeakPolarHBondContact O-CG 3.38Å; L131-L135 PolarHBondContact O-N 3.44Å; Y132-L135 HydrophobicContact CD1-CD1 4.47Å; Y132-L135 PolarHBondContact O-N 2.97Å; L135-L138 PolarHBondContact O-N 3.46Å; L135-Y139 WeakPolarHBondContact O-CB 3.44Å; L135-Y139 PolarHBondContact O-N 3.3Å |
| 136 | A | 98.4 | Very high | 97.1 | Very high | 12 Ų | 12 | 26.5 Ų | 26.5 | 10% | 0.099 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -64 | -40.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | L57 Y132 T133 Y139 S140 | L57-A136 HydrophobicContact CB-CB 4.13Å; Y132-A136 VanDerWaalsContact O-CB 3.23Å; Y132-A136 WeakPolarHBondContact O-CB 3.21Å; Y132-A136 PolarHBondContact O-N 3.34Å; T133-A136 PolarHBondContact O-N 3.41Å; A136-Y139 PolarHBondContact O-N 2.86Å; A136-S140 WeakPolarHBondContact O-CB 3.14Å; A136-S140 PolarHBondContact O-N 3.04Å; A136-S140 PolarHBondContact O-OG 2.87Å |
| 137 | C | 98.6 | Very high | 96.9 | Very high | 11 Ų | 11 | 28.3 Ų | 28.3 | 7% | 0.074 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -65.5 | -44.8 | 174.7 | -71.3 | 0 | 0 | 0 | 0 | 111.6 | T133 S134 Y139 S140 M141 W192 | T133-C137 WeakPolarHBondContact O-CB 3.3Å; T133-C137 PolarHBondContact O-N 3.43Å; T133-C137 PolarHBondContact O-SG 3.49Å; S134-C137 PolarHBondContact O-N 2.81Å; C137-Y139 VanDerWaalsContact C-N 3.34Å; C137-Y139 PolarHBondContact O-N 2.9Å; C137-S140 PolarHBondContact O-N 2.99Å; C137-M141 VanDerWaalsContact O-CB 3.29Å; C137-M141 WeakPolarHBondContact O-CB 3.42Å; C137-M141 PolarHBondContact O-N 3.37Å; C137-W192 HydrophobicContact CB-CB 4.23Å; C137-W192 WeakPolarHBondContact CB-O 3.33Å |
| 138 | L | 98.4 | Very high | 96.8 | Very high | 92 Ų | 92 | 28.2 Ų | 28.2 | 48% | 0.482 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -59.9 | -46.3 | 176.1 | 177.8 | 61.4 | 0 | 0 | 0 | 111.1 | S134 L135 M141 V142 | S134-L138 WeakPolarHBondContact O-CB 3.37Å; S134-L138 PolarHBondContact O-N 2.89Å; L135-L138 PolarHBondContact O-N 3.46Å; L138-M141 HydrophobicContact CD1-CE 3.82Å; L138-M141 PolarHBondContact O-N 3.43Å; L138-V142 HydrophobicContact CD1-CG2 4.45Å; L138-V142 WeakPolarHBondContact O-CG2 3.27Å; L138-V142 PolarHBondContact O-N 3.32Å |
| 139 | Y | 98.1 | Very high | 96.6 | Very high | 28 Ų | 28 | 30.2 Ų | 30.2 | 11% | 0.11 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -59.5 | -48.1 | 176.2 | 177.3 | -87.8 | 0 | 0 | 0 | 111.8 | H50 L53 F54 L57 L135 A136 C137 M141 V142 A143 | H50-Y139 VanDerWaalsContact CA-OH 3.31Å; H50-Y139 WeakPolarHBondContact CA-OH 3.34Å; H50-Y139 WeakPolarHBondContact CB-OH 3.42Å; H50-Y139 AromaticContact ND1-CE2 3.86Å; H50-Y139 AromaticContact ND1-CZ 3.78Å; H50-Y139 PolarHBondContact ND1-OH 3.36Å; H50-Y139 PolarHBondContact O-OH 3.39Å; L53-Y139 HydrophobicContact CD2-CD2 3.87Å; L53-Y139 HydrophobicContact CD2-CE2 3.7Å; L53-Y139 HydrophobicContact CG-CD2 4.33Å; L53-Y139 HydrophobicContact CG-CE2 4.19Å; F54-Y139 HydrophobicContact CB-CD1 4.36Å; F54-Y139 HydrophobicContact CB-CE1 3.8Å; F54-Y139 AromaticContact CD2-CD1 3.84Å; F54-Y139 HydrophobicContact CD2-CD1 3.84Å; F54-Y139 AromaticContact CD2-CE1 3.92Å; F54-Y139 HydrophobicContact CD2-CE1 3.92Å; F54-Y139 HydrophobicContact CG-CE1 4.27Å; L57-Y139 HydrophobicContact CD1-CG 4.2Å; L135-Y139 WeakPolarHBondContact O-CB 3.44Å; L135-Y139 PolarHBondContact O-N 3.3Å; A136-Y139 PolarHBondContact O-N 2.86Å; C137-Y139 VanDerWaalsContact C-N 3.34Å; C137-Y139 PolarHBondContact O-N 2.9Å; Y139-M141 VanDerWaalsContact C-N 3.31Å; Y139-M141 PolarHBondContact O-N 2.86Å; Y139-V142 PolarHBondContact O-N 3.49Å; Y139-A143 PolarHBondContact O-N 2.96Å |
| 140 | S | 98.1 | Very high | 96.2 | Very high | 0 Ų | 0 | 33.6 Ų | 33.6 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -64.8 | -36.1 | 179.9 | -53.4 | 0 | 0 | 0 | 0 | 111.8 | T22 A136 C137 A143 G144 W192 | T22-S140 WeakPolarHBondContact CG2-OG 3.4Å; A136-S140 WeakPolarHBondContact O-CB 3.14Å; A136-S140 PolarHBondContact O-N 3.04Å; A136-S140 PolarHBondContact O-OG 2.87Å; C137-S140 PolarHBondContact O-N 2.99Å; S140-A143 PolarHBondContact O-N 3.37Å; S140-G144 PolarHBondContact O-N 3.47Å; S140-W192 WeakPolarHBondContact O-CZ3 3.49Å |
| 141 | M | 96.6 | Very high | 95.8 | Very high | 35 Ų | 35 | 37.1 Ų | 37.1 | 17% | 0.172 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -63.8 | -45.9 | 173.5 | -173.5 | -169.4 | 80.3 | 0 | 0 | 111.4 | C137 L138 Y139 G144 V145 L189 W192 F193 | C137-M141 VanDerWaalsContact O-CB 3.29Å; C137-M141 WeakPolarHBondContact O-CB 3.42Å; C137-M141 PolarHBondContact O-N 3.37Å; L138-M141 HydrophobicContact CD1-CE 3.82Å; L138-M141 PolarHBondContact O-N 3.43Å; Y139-M141 VanDerWaalsContact C-N 3.31Å; Y139-M141 PolarHBondContact O-N 2.86Å; M141-G144 PolarHBondContact O-N 3.48Å; M141-V145 WeakPolarHBondContact O-CB 3.35Å; M141-V145 WeakPolarHBondContact O-CG2 3.45Å; M141-V145 PolarHBondContact O-N 2.93Å; M141-L189 HydrophobicContact CG-CG 4.34Å; M141-W192 HydrophobicContact CB-CB 4.35Å; M141-F193 HydrophobicContact SD-CB 3.97Å; M141-F193 HydrophobicContact SD-CD2 3.75Å; M141-F193 HydrophobicContact SD-CG 4.31Å |
| 142 | V | 95.6 | Very high | 95.2 | Very high | 86 Ų | 86 | 36.3 Ų | 36.3 | 52% | 0.521 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -63.5 | -43.6 | 176.9 | 171.9 | 0 | 0 | 0 | 0 | 111.1 | L138 Y139 G144 V145 A146 | L138-V142 HydrophobicContact CD1-CG2 4.45Å; L138-V142 WeakPolarHBondContact O-CG2 3.27Å; L138-V142 PolarHBondContact O-N 3.32Å; Y139-V142 PolarHBondContact O-N 3.49Å; V142-G144 VanDerWaalsContact C-N 3.35Å; V142-V145 PolarHBondContact O-N 2.88Å; V142-A146 WeakPolarHBondContact O-CB 3.28Å; V142-A146 PolarHBondContact O-N 3.39Å |
| 143 | A | 95 | Very high | 94.7 | Very high | 10 Ų | 10 | 40.8 Ų | 40.8 | 8% | 0.083 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -62.2 | -42.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | F30 M34 Y139 S140 A146 Y147 | F30-A143 HydrophobicContact CB-CB 4.41Å; F30-A143 HydrophobicContact CD2-CB 3.81Å; F30-A143 HydrophobicContact CE2-CB 4.33Å; F30-A143 HydrophobicContact CG-CB 4.25Å; M34-A143 HydrophobicContact CE-CB 4.4Å; Y139-A143 PolarHBondContact O-N 2.96Å; S140-A143 PolarHBondContact O-N 3.37Å; A143-A146 PolarHBondContact O-N 2.83Å; A143-Y147 WeakPolarHBondContact O-CB 3.43Å; A143-Y147 PolarHBondContact O-N 3.47Å |
| 144 | G | 95.1 | Very high | 94.3 | Very high | 0 Ų | 0 | 42.6 Ų | 42.6 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -63.7 | -44.1 | 176 | 0 | 0 | 0 | 0 | 0 | 112.9 | S140 M141 V142 Y147 I148 | S140-G144 PolarHBondContact O-N 3.47Å; M141-G144 PolarHBondContact O-N 3.48Å; V142-G144 VanDerWaalsContact C-N 3.35Å; G144-Y147 PolarHBondContact O-N 3.35Å; G144-I148 WeakPolarHBondContact O-CG1 3.34Å; G144-I148 PolarHBondContact O-N 3.27Å |
| 145 | V | 94.8 | Very high | 94 | Very high | 37 Ų | 37 | 45.6 Ų | 45.6 | 22% | 0.224 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -59.9 | -47.6 | 173.6 | 167 | 0 | 0 | 0 | 0 | 110.8 | M141 V142 Y147 I148 S149 F156 L189 | M141-V145 WeakPolarHBondContact O-CB 3.35Å; M141-V145 WeakPolarHBondContact O-CG2 3.45Å; M141-V145 PolarHBondContact O-N 2.93Å; V142-V145 PolarHBondContact O-N 2.88Å; V145-Y147 VanDerWaalsContact C-N 3.32Å; V145-Y147 PolarHBondContact O-N 2.88Å; V145-I148 WeakPolarHBondContact O-CG1 3.25Å; V145-I148 PolarHBondContact O-N 3.36Å; V145-S149 WeakPolarHBondContact O-CB 3.46Å; V145-S149 PolarHBondContact O-N 3.38Å; V145-S149 PolarHBondContact O-OG 2.93Å; V145-F156 HydrophobicContact CG1-CD2 3.69Å; V145-F156 HydrophobicContact CG1-CE2 3.84Å; V145-F156 HydrophobicContact CG1-CG 4.22Å; V145-F156 HydrophobicContact CG1-CZ 4.5Å; V145-F156 HydrophobicContact CG2-CE2 4.48Å; V145-F156 HydrophobicContact CG2-CZ 4.4Å; V145-L189 HydrophobicContact CG2-CD1 3.67Å |
| 146 | A | 92.9 | Very high | 93.6 | Very high | 58 Ų | 58 | 44.9 Ų | 44.9 | 48% | 0.479 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -60.2 | -43.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | V142 A143 S149 A150 | V142-A146 WeakPolarHBondContact O-CB 3.28Å; V142-A146 PolarHBondContact O-N 3.39Å; A143-A146 PolarHBondContact O-N 2.83Å; A146-S149 PolarHBondContact O-N 3.3Å; A146-A150 WeakPolarHBondContact O-CB 3.31Å; A146-A150 PolarHBondContact O-N 2.87Å |
| 147 | Y | 92.9 | Very high | 93.2 | Very high | 43 Ų | 43 | 48.8 Ų | 48.8 | 17% | 0.169 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -61.4 | -51.9 | 177.8 | 176.3 | -91.4 | 0 | 0 | 0 | 112.2 | L29 F30 A143 G144 V145 S149 A150 V151 V185 | L29-Y147 HydrophobicContact CD1-CE2 3.92Å; L29-Y147 WeakPolarHBondContact CD1-OH 3.21Å; L29-Y147 HydrophobicContact CD2-CD1 4.49Å; L29-Y147 HydrophobicContact CD2-CE1 4.04Å; L29-Y147 HydrophobicContact CD2-CE2 4.36Å; L29-Y147 HydrophobicContact CG-CD2 4.29Å; L29-Y147 HydrophobicContact CG-CE1 4.3Å; L29-Y147 HydrophobicContact CG-CE2 3.73Å; F30-Y147 HydrophobicContact CD1-CD1 4.45Å; F30-Y147 AromaticContact CD1-CD2 3.94Å; F30-Y147 HydrophobicContact CD1-CD2 3.94Å; F30-Y147 AromaticContact CD1-CG 3.77Å; F30-Y147 HydrophobicContact CD1-CG 3.77Å; F30-Y147 HydrophobicContact CE1-CD1 4.04Å; F30-Y147 HydrophobicContact CE1-CD2 4.34Å; F30-Y147 AromaticContact CE1-CG 3.77Å; F30-Y147 HydrophobicContact CE1-CG 3.77Å; A143-Y147 WeakPolarHBondContact O-CB 3.43Å; A143-Y147 PolarHBondContact O-N 3.47Å; G144-Y147 PolarHBondContact O-N 3.35Å; V145-Y147 VanDerWaalsContact C-N 3.32Å; V145-Y147 PolarHBondContact O-N 2.88Å; Y147-S149 VanDerWaalsContact C-N 3.3Å; Y147-S149 PolarHBondContact O-N 2.91Å; Y147-A150 PolarHBondContact O-N 3.13Å; Y147-V151 HydrophobicContact CD2-CG2 3.95Å; Y147-V151 HydrophobicContact CE1-CB 4.36Å; Y147-V151 HydrophobicContact CE1-CG2 4.49Å; Y147-V151 HydrophobicContact CE2-CB 4.39Å; Y147-V151 HydrophobicContact CE2-CG2 3.69Å; Y147-V151 HydrophobicContact CG-CG2 4.46Å; Y147-V151 WeakPolarHBondContact O-CB 3.38Å; Y147-V151 WeakPolarHBondContact O-CG2 3.27Å; Y147-V151 PolarHBondContact O-N 2.91Å; Y147-V185 HydrophobicContact CD1-CG1 4.33Å |
| 148 | I | 93.1 | Very high | 92.8 | Very high | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -69.2 | -29.1 | -179 | 65.7 | -171.4 | 0 | 0 | 0 | 112.2 | G144 V145 L152 S153 I154 F156 L165 V185 L189 | G144-I148 WeakPolarHBondContact O-CG1 3.34Å; G144-I148 PolarHBondContact O-N 3.27Å; V145-I148 WeakPolarHBondContact O-CG1 3.25Å; V145-I148 PolarHBondContact O-N 3.36Å; I148-L152 HydrophobicContact CB-CB 4.49Å; I148-L152 HydrophobicContact CB-CD1 3.98Å; I148-L152 HydrophobicContact CB-CG 4.28Å; I148-L152 HydrophobicContact CG2-CD1 3.79Å; I148-L152 HydrophobicContact CG2-CG 4.42Å; I148-L152 CarbonylContact O-C 3.6Å; I148-L152 VanDerWaalsContact O-CA 3.29Å; I148-L152 WeakPolarHBondContact O-CA 3.38Å; I148-L152 VanDerWaalsContact O-CB 3.22Å; I148-L152 WeakPolarHBondContact O-CB 3.34Å; I148-L152 PolarHBondContact O-N 2.85Å; I148-S153 PolarHBondContact O-N 3.28Å; I148-I154 HydrophobicContact CB-CD1 4.43Å; I148-I154 PolarHBondContact O-N 3.02Å; I148-F156 HydrophobicContact CD1-CE2 3.69Å; I148-F156 HydrophobicContact CD1-CZ 3.48Å; I148-F156 VanDerWaalsContact CD1-CZ 3.48Å; I148-F156 HydrophobicContact CG1-CE2 3.81Å; I148-F156 HydrophobicContact CG1-CZ 4.14Å; I148-L165 HydrophobicContact CD1-CD2 4.19Å; I148-V185 HydrophobicContact CG2-CG1 3.82Å; I148-L189 HydrophobicContact CD1-CD1 3.6Å |
| 149 | S | 92.9 | Very high | 92.1 | Very high | 45 Ų | 45 | 54.5 Ų | 54.5 | 32% | 0.315 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -68.1 | -41.9 | 172 | -72.6 | 0 | 0 | 0 | 0 | 112.5 | V145 A146 Y147 S153 I154 F156 | V145-S149 WeakPolarHBondContact O-CB 3.46Å; V145-S149 PolarHBondContact O-N 3.38Å; V145-S149 PolarHBondContact O-OG 2.93Å; A146-S149 PolarHBondContact O-N 3.3Å; Y147-S149 VanDerWaalsContact C-N 3.3Å; Y147-S149 PolarHBondContact O-N 2.91Å; S149-S153 WeakPolarHBondContact O-CA 3.23Å; S149-S153 PolarHBondContact O-N 3.5Å; S149-I154 VanDerWaalsContact CA-O 3.27Å; S149-I154 WeakPolarHBondContact CA-O 3.33Å; S149-I154 WeakPolarHBondContact CB-O 3.5Å; S149-I154 PolarHBondContact OG-O 2.82Å; S149-F156 WeakPolarHBondContact OG-CD2 3.44Å |
| 150 | A | 90.3 | Very high | 91.8 | Very high | 81 Ų | 81 | 57.5 Ų | 57.5 | 67% | 0.669 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -75.3 | -43.6 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | A146 Y147 | A146-A150 WeakPolarHBondContact O-CB 3.31Å; A146-A150 PolarHBondContact O-N 2.87Å; Y147-A150 PolarHBondContact O-N 3.13Å |
| 151 | V | 88.3 | Confident | 91.5 | Very high | 77 Ų | 77 | 58.2 Ų | 58.2 | 47% | 0.467 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -94 | -39.6 | -170.7 | -177.9 | 0 | 0 | 0 | 0 | 112 | Y147 | Y147-V151 HydrophobicContact CD2-CG2 3.95Å; Y147-V151 HydrophobicContact CE1-CB 4.36Å; Y147-V151 HydrophobicContact CE1-CG2 4.49Å; Y147-V151 HydrophobicContact CE2-CB 4.39Å; Y147-V151 HydrophobicContact CE2-CG2 3.69Å; Y147-V151 HydrophobicContact CG-CG2 4.46Å; Y147-V151 WeakPolarHBondContact O-CB 3.38Å; Y147-V151 WeakPolarHBondContact O-CG2 3.27Å; Y147-V151 PolarHBondContact O-N 2.91Å |
| 152 | L | 85.9 | Confident | 91.3 | Very high | 40 Ų | 40 | 58.7 Ų | 58.7 | 21% | 0.209 | 37% | 0.368 | C | S | . | . | S | Bend | trans | -97.8 | 2.3 | -178.1 | -47.9 | -177.2 | 0 | 0 | 0 | 112.7 | I148 I154 E182 | I148-L152 HydrophobicContact CB-CB 4.49Å; I148-L152 HydrophobicContact CB-CD1 3.98Å; I148-L152 HydrophobicContact CB-CG 4.28Å; I148-L152 HydrophobicContact CG2-CD1 3.79Å; I148-L152 HydrophobicContact CG2-CG 4.42Å; I148-L152 CarbonylContact O-C 3.6Å; I148-L152 VanDerWaalsContact O-CA 3.29Å; I148-L152 WeakPolarHBondContact O-CA 3.38Å; I148-L152 VanDerWaalsContact O-CB 3.22Å; I148-L152 WeakPolarHBondContact O-CB 3.34Å; I148-L152 PolarHBondContact O-N 2.85Å; L152-I154 HydrophobicContact CB-CD1 3.95Å; L152-I154 HydrophobicContact CB-CG1 3.95Å; L152-I154 HydrophobicContact CD1-CD1 4.23Å; L152-I154 PolarHBondContact O-N 3.35Å; L152-I154 VanDerWaalsContact O-N 3.17Å; L152-E182 HydrophobicContact CD1-CB 4.06Å; L152-E182 HydrophobicContact CD1-CG 4.11Å; L152-E182 HydrophobicContact CD2-CG 3.78Å; L152-E182 WeakPolarHBondContact CD2-OE1 3.15Å |
| 153 | S | 89.3 | Confident | 91.2 | Very high | 106 Ų | 106 | 60.2 Ų | 60.2 | 74% | 0.741 | 37% | 0.373 | S | S | * | . | trans | 55.4 | 30.5 | -179 | -58.7 | 0 | 0 | 0 | 0 | 113.8 | I148 S149 | I148-S153 PolarHBondContact O-N 3.28Å; S149-S153 WeakPolarHBondContact O-CA 3.23Å; S149-S153 PolarHBondContact O-N 3.5Å | ||
| 154 | I | 89.6 | Confident | 91.2 | Very high | 44 Ų | 44 | 62.8 Ų | 62.8 | 23% | 0.226 | 39% | 0.388 | C | S | . | . | trans | -85.8 | 121.5 | 179.6 | -62.6 | 176.8 | 0 | 0 | 0 | 110.1 | I148 S149 L152 F156 L165 | I148-I154 HydrophobicContact CB-CD1 4.43Å; I148-I154 PolarHBondContact O-N 3.02Å; S149-I154 VanDerWaalsContact CA-O 3.27Å; S149-I154 WeakPolarHBondContact CA-O 3.33Å; S149-I154 WeakPolarHBondContact CB-O 3.5Å; S149-I154 PolarHBondContact OG-O 2.82Å; L152-I154 HydrophobicContact CB-CD1 3.95Å; L152-I154 HydrophobicContact CB-CG1 3.95Å; L152-I154 HydrophobicContact CD1-CD1 4.23Å; L152-I154 PolarHBondContact O-N 3.35Å; L152-I154 VanDerWaalsContact O-N 3.17Å; I154-F156 HydrophobicContact CB-CE2 4.49Å; I154-F156 HydrophobicContact CG2-CD2 4.44Å; I154-F156 HydrophobicContact CG2-CE2 3.83Å; I154-F156 HydrophobicContact CG2-CZ 4.01Å; I154-L165 HydrophobicContact CD1-CD1 3.81Å; I154-L165 HydrophobicContact CG2-CD1 4.24Å | ||
| 155 | S | 91.1 | Very high | 91.2 | Very high | 85 Ų | 85 | 63.1 Ų | 63.1 | 59% | 0.594 | 39% | 0.39 | S | S | * | . | trans | -91.8 | 129.3 | 177.3 | -178.4 | 0 | 0 | 0 | 0 | 112.5 | A157 A161 | S155-A157 WeakPolarHBondContact OG-CB 3.31Å; S155-A157 PolarHBondContact OG-N 3.43Å; S155-A161 WeakPolarHBondContact O-CB 3.43Å | ||
| 156 | F | 91.6 | Very high | 91.3 | Very high | 53 Ų | 53 | 63.6 Ų | 63.6 | 23% | 0.232 | 39% | 0.391 | C | S | . | . | trans | -100.4 | 16.9 | 171.3 | -67.9 | -88.3 | 0 | 0 | 0 | 113.2 | V145 I148 S149 I154 H158 A161 F162 L165 | V145-F156 HydrophobicContact CG1-CD2 3.69Å; V145-F156 HydrophobicContact CG1-CE2 3.84Å; V145-F156 HydrophobicContact CG1-CG 4.22Å; V145-F156 HydrophobicContact CG1-CZ 4.5Å; V145-F156 HydrophobicContact CG2-CE2 4.48Å; V145-F156 HydrophobicContact CG2-CZ 4.4Å; I148-F156 HydrophobicContact CD1-CE2 3.69Å; I148-F156 HydrophobicContact CD1-CZ 3.48Å; I148-F156 VanDerWaalsContact CD1-CZ 3.48Å; I148-F156 HydrophobicContact CG1-CE2 3.81Å; I148-F156 HydrophobicContact CG1-CZ 4.14Å; S149-F156 WeakPolarHBondContact OG-CD2 3.44Å; I154-F156 HydrophobicContact CB-CE2 4.49Å; I154-F156 HydrophobicContact CG2-CD2 4.44Å; I154-F156 HydrophobicContact CG2-CE2 3.83Å; I154-F156 HydrophobicContact CG2-CZ 4.01Å; F156-H158 PolarHBondContact O-N 2.97Å; F156-A161 HydrophobicContact CD1-CB 4.2Å; F156-F162 HydrophobicContact CD1-CB 4.46Å; F156-F162 HydrophobicContact CE1-CB 4.47Å; F156-F162 HydrophobicContact CE1-CD2 4.35Å; F156-L165 HydrophobicContact CE1-CD2 4.03Å; F156-L165 HydrophobicContact CZ-CD2 3.83Å | ||
| 157 | A | 89.9 | Confident | 91.4 | Very high | 93 Ų | 93 | 64.5 Ų | 64.5 | 77% | 0.769 | 39% | 0.391 | S | S | * | . | trans | -62.3 | -31 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | S155 | S155-A157 WeakPolarHBondContact OG-CB 3.31Å; S155-A157 PolarHBondContact OG-N 3.43Å | ||
| 158 | H | 89.8 | Confident | 91.5 | Very high | 114 Ų | 114 | 65.4 Ų | 65.4 | 53% | 0.528 | 40% | 0.401 | S | S | . | . | S | Bend | trans | -90.8 | 133 | 179.1 | -168.7 | -100.1 | 0 | 0 | 0 | 110.9 | F156 L160 A161 | F156-H158 PolarHBondContact O-N 2.97Å; H158-L160 WeakPolarHBondContact CE1-CD1 3.37Å; H158-L160 WeakPolarHBondContact ND1-CB 3.41Å; H158-L160 PolarHBondContact ND1-N 3.27Å; H158-L160 PolarHBondContact O-N 3.08Å; H158-L160 VanDerWaalsContact O-N 3.16Å; H158-A161 WeakPolarHBondContact O-CB 3.29Å; H158-A161 PolarHBondContact O-N 3.35Å |
| 159 | P | 83.3 | Confident | 91.6 | Very high | 109 Ų | 109 | 65.5 Ų | 65.5 | 71% | 0.708 | 40% | 0.402 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.8 | -27.5 | -174.9 | 23.2 | -33.8 | 0 | 0 | 0 | 113.7 | A161 | P159-A161 VanDerWaalsContact C-N 3.31Š|
| 160 | L | 92.1 | Very high | 91.8 | Very high | 91 Ų | 91 | 66.8 Ų | 66.8 | 48% | 0.476 | 41% | 0.405 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.6 | -10.5 | 175.4 | -74.9 | 128.4 | 0 | 0 | 0 | 113.8 | H158 F162 L163 T164 | H158-L160 WeakPolarHBondContact CE1-CD1 3.37Å; H158-L160 WeakPolarHBondContact ND1-CB 3.41Å; H158-L160 PolarHBondContact ND1-N 3.27Å; H158-L160 PolarHBondContact O-N 3.08Å; H158-L160 VanDerWaalsContact O-N 3.16Å; L160-F162 VanDerWaalsContact C-N 3.29Å; L160-F162 PolarHBondContact O-N 2.92Å; L160-L163 HydrophobicContact CD2-CD1 4.24Å; L160-L163 WeakPolarHBondContact O-CA 3.36Å; L160-L163 WeakPolarHBondContact O-CB 3.34Å; L160-L163 PolarHBondContact O-N 3.45Å; L160-T164 PolarHBondContact O-N 3.08Å; L160-T164 PolarHBondContact O-OG1 3.33Å; L160-T164 VanDerWaalsContact O-OG1 3.13Å |
| 161 | A | 92.6 | Very high | 92.1 | Very high | 15 Ų | 15 | 66.7 Ų | 66.7 | 12% | 0.124 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -56.7 | -43.3 | -176.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | S155 F156 H158 P159 L163 T164 L165 | S155-A161 WeakPolarHBondContact O-CB 3.43Å; F156-A161 HydrophobicContact CD1-CB 4.2Å; H158-A161 WeakPolarHBondContact O-CB 3.29Å; H158-A161 PolarHBondContact O-N 3.35Å; P159-A161 VanDerWaalsContact C-N 3.31Å; A161-L163 VanDerWaalsContact C-N 3.28Å; A161-L163 PolarHBondContact O-N 3.02Å; A161-T164 PolarHBondContact O-N 3.2Å; A161-T164 PolarHBondContact O-OG1 2.65Å; A161-L165 WeakPolarHBondContact O-CB 3.42Å; A161-L165 PolarHBondContact O-N 3.5Å |
| 162 | F | 92.4 | Very high | 92.4 | Very high | 45 Ų | 45 | 67 Ų | 67 | 20% | 0.197 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -66 | -29.6 | 176.1 | -173.9 | -90 | 0 | 0 | 0 | 113 | F156 L160 L189 Y190 F193 | F156-F162 HydrophobicContact CD1-CB 4.46Å; F156-F162 HydrophobicContact CE1-CB 4.47Å; F156-F162 HydrophobicContact CE1-CD2 4.35Å; L160-F162 VanDerWaalsContact C-N 3.29Å; L160-F162 PolarHBondContact O-N 2.92Å; F162-L189 HydrophobicContact CD2-CD2 4.19Å; F162-L189 HydrophobicContact CE2-CD2 3.4Å; F162-L189 HydrophobicContact CE2-CG 4.49Å; F162-L189 HydrophobicContact CZ-CD2 4.01Å; F162-Y190 HydrophobicContact CD1-CE1 4.21Å; F162-Y190 HydrophobicContact CE1-CD1 4.14Å; F162-Y190 AromaticContact CE1-CE1 3.71Å; F162-Y190 HydrophobicContact CE1-CE1 3.71Å; F162-Y190 HydrophobicContact CE2-CE1 4.47Å; F162-Y190 HydrophobicContact CZ-CD1 4.03Å; F162-Y190 AromaticContact CZ-CE1 3.86Å; F162-Y190 HydrophobicContact CZ-CE1 3.86Å; F162-Y190 PolarHBondContact O-OH 3.04Å; F162-F193 HydrophobicContact CE1-CD1 4.06Å; F162-F193 HydrophobicContact CE1-CE1 4.11Å; F162-F193 HydrophobicContact CE1-CG 4.35Å; F162-F193 HydrophobicContact CE1-CZ 4.45Å; F162-F193 HydrophobicContact CZ-CB 4.12Å; F162-F193 AromaticContact CZ-CD1 3.99Å; F162-F193 HydrophobicContact CZ-CD1 3.99Å; F162-F193 HydrophobicContact CZ-CD2 4.24Å; F162-F193 HydrophobicContact CZ-CE1 4.43Å; F162-F193 AromaticContact CZ-CG 3.86Å; F162-F193 HydrophobicContact CZ-CG 3.86Å |
| 163 | L | 92.9 | Very high | 93 | Very high | 118 Ų | 118 | 69.2 Ų | 69.2 | 62% | 0.618 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -80.4 | -35.3 | 179.7 | -64.3 | 175.4 | 0 | 0 | 0 | 111.9 | L160 A161 P167 | L160-L163 HydrophobicContact CD2-CD1 4.24Å; L160-L163 WeakPolarHBondContact O-CA 3.36Å; L160-L163 WeakPolarHBondContact O-CB 3.34Å; L160-L163 PolarHBondContact O-N 3.45Å; A161-L163 VanDerWaalsContact C-N 3.28Å; A161-L163 PolarHBondContact O-N 3.02Å; L163-P167 WeakPolarHBondContact O-CD 3.38Å |
| 164 | T | 95.1 | Very high | 93.3 | Very high | 65 Ų | 65 | 72 Ų | 72 | 40% | 0.399 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -86.5 | -20.7 | -179.1 | 56.5 | 0 | 0 | 0 | 0 | 113.2 | L160 A161 L166 P167 T168 | L160-T164 PolarHBondContact O-N 3.08Å; L160-T164 PolarHBondContact O-OG1 3.33Å; L160-T164 VanDerWaalsContact O-OG1 3.13Å; A161-T164 PolarHBondContact O-N 3.2Å; A161-T164 PolarHBondContact O-OG1 2.65Å; T164-L166 PolarHBondContact O-N 3.14Å; T164-P167 WeakPolarHBondContact O-CD 3.47Å; T164-P167 VanDerWaalsContact O-CG 3.23Å; T164-P167 WeakPolarHBondContact O-CG 3.43Å; T164-T168 WeakPolarHBondContact O-CB 3.39Å; T164-T168 VanDerWaalsContact O-CG2 3.28Å; T164-T168 WeakPolarHBondContact O-CG2 3.19Å; T164-T168 PolarHBondContact O-N 3.39Å; T164-T168 PolarHBondContact O-OG1 3.45Å |
| 165 | L | 95.4 | Very high | 93.6 | Very high | 7 Ų | 7 | 74.1 Ų | 74.1 | 4% | 0.037 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -54.2 | -50.5 | -176.8 | 171.5 | 70.9 | 0 | 0 | 0 | 113.2 | I148 I154 F156 A161 T168 S169 I186 Y190 | I148-L165 HydrophobicContact CD1-CD2 4.19Å; I154-L165 HydrophobicContact CD1-CD1 3.81Å; I154-L165 HydrophobicContact CG2-CD1 4.24Å; F156-L165 HydrophobicContact CE1-CD2 4.03Å; F156-L165 HydrophobicContact CZ-CD2 3.83Å; A161-L165 WeakPolarHBondContact O-CB 3.42Å; A161-L165 PolarHBondContact O-N 3.5Å; L165-T168 PolarHBondContact O-OG1 3.05Å; L165-S169 VanDerWaalsContact O-CB 3.22Å; L165-S169 WeakPolarHBondContact O-CB 3.38Å; L165-S169 PolarHBondContact O-N 2.93Å; L165-S169 PolarHBondContact O-OG 3.42Å; L165-I186 HydrophobicContact CD1-CD1 4.17Å; L165-I186 HydrophobicContact CD2-CG2 4.17Å; L165-I186 HydrophobicContact CG-CG2 4Å; L165-Y190 WeakPolarHBondContact CB-OH 3.32Å; L165-Y190 HydrophobicContact CD2-CE2 4.29Å; L165-Y190 HydrophobicContact CG-CE2 4.46Å |
| 166 | L | 95.3 | Very high | 93.8 | Very high | 47 Ų | 47 | 73.2 Ų | 73.2 | 25% | 0.246 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -60.6 | -55.7 | 179.7 | -173.1 | 58.3 | 0 | 0 | 0 | 113 | T164 T168 S169 I170 I186 L187 Y190 | T164-L166 PolarHBondContact O-N 3.14Å; L166-T168 VanDerWaalsContact C-N 3.33Å; L166-T168 PolarHBondContact O-N 3.4Å; L166-S169 PolarHBondContact O-N 2.88Å; L166-I170 HydrophobicContact CD1-CD1 3.92Å; L166-I170 HydrophobicContact CD1-CG1 4.18Å; L166-I170 HydrophobicContact CG-CD1 3.83Å; L166-I170 HydrophobicContact CG-CG1 4.48Å; L166-I170 VanDerWaalsContact O-CG1 3.27Å; L166-I170 WeakPolarHBondContact O-CG1 3.42Å; L166-I170 PolarHBondContact O-N 3.19Å; L166-I186 HydrophobicContact CD1-CG2 4.45Å; L166-L187 HydrophobicContact CD1-CD2 3.8Å; L166-Y190 HydrophobicContact CB-CD2 4.11Å; L166-Y190 HydrophobicContact CB-CE1 4.3Å; L166-Y190 HydrophobicContact CB-CE2 3.48Å; L166-Y190 VanDerWaalsContact CB-CE2 3.48Å; L166-Y190 HydrophobicContact CD1-CD2 4.12Å; L166-Y190 HydrophobicContact CD1-CE2 4.16Å; L166-Y190 HydrophobicContact CD2-CD2 4.26Å; L166-Y190 HydrophobicContact CD2-CE2 4.43Å; L166-Y190 HydrophobicContact CD2-CG 4.41Å; L166-Y190 HydrophobicContact CG-CD2 4.4Å; L166-Y190 HydrophobicContact CG-CE2 4.23Å; L166-Y190 PolarHBondContact N-OH 3.31Å |
| 167 | P | 96.4 | Very high | 93.9 | Very high | 76 Ų | 76 | 74 Ų | 74 | 49% | 0.494 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -63.5 | -36.5 | -178.6 | 22.4 | -32.2 | 0 | 0 | 0 | 112.9 | L163 T164 S171 | L163-P167 WeakPolarHBondContact O-CD 3.38Å; T164-P167 WeakPolarHBondContact O-CD 3.47Å; T164-P167 VanDerWaalsContact O-CG 3.23Å; T164-P167 WeakPolarHBondContact O-CG 3.43Å; P167-S171 PolarHBondContact O-N 3.19Å; P167-S171 VanDerWaalsContact O-N 3.15Å |
| 168 | T | 94.4 | Very high | 94.1 | Very high | 62 Ų | 62 | 70.6 Ų | 70.6 | 38% | 0.38 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -66.6 | -43.9 | 176.4 | 57.1 | 0 | 0 | 0 | 0 | 111.4 | T164 L165 L166 I170 S171 Q172 | T164-T168 WeakPolarHBondContact O-CB 3.39Å; T164-T168 VanDerWaalsContact O-CG2 3.28Å; T164-T168 WeakPolarHBondContact O-CG2 3.19Å; T164-T168 PolarHBondContact O-N 3.39Å; T164-T168 PolarHBondContact O-OG1 3.45Å; L165-T168 PolarHBondContact O-OG1 3.05Å; L166-T168 VanDerWaalsContact C-N 3.33Å; L166-T168 PolarHBondContact O-N 3.4Å; T168-I170 VanDerWaalsContact C-N 3.35Å; T168-I170 PolarHBondContact O-N 2.94Å; T168-S171 WeakPolarHBondContact O-CB 3.4Å; T168-S171 PolarHBondContact O-N 3.5Å; T168-Q172 WeakPolarHBondContact O-CB 3.46Å; T168-Q172 VanDerWaalsContact O-CG 3.27Å; T168-Q172 WeakPolarHBondContact O-CG 3.4Å; T168-Q172 PolarHBondContact O-N 3.4Å |
| 169 | S | 95.7 | Very high | 94.4 | Very high | 3 Ų | 3 | 70.5 Ų | 70.5 | 2% | 0.021 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -67.5 | -37.2 | -178.8 | -49.6 | 0 | 0 | 0 | 0 | 111.3 | L165 L166 S171 Q172 F173 M183 I186 | L165-S169 VanDerWaalsContact O-CB 3.22Å; L165-S169 WeakPolarHBondContact O-CB 3.38Å; L165-S169 PolarHBondContact O-N 2.93Å; L165-S169 PolarHBondContact O-OG 3.42Å; L166-S169 PolarHBondContact O-N 2.88Å; S169-S171 PolarHBondContact O-N 2.73Å; S169-Q172 PolarHBondContact O-N 2.83Å; S169-F173 WeakPolarHBondContact O-CB 3.35Å; S169-F173 PolarHBondContact O-N 2.92Å; S169-M183 WeakPolarHBondContact CB-SD 3.28Å; S169-I186 WeakPolarHBondContact OG-CD1 3.48Å |
| 170 | I | 96.7 | Very high | 95 | Very high | 71 Ų | 71 | 67.4 Ų | 67.4 | 36% | 0.364 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -58.7 | -48.7 | 172.6 | -71.6 | 168.7 | 0 | 0 | 0 | 110.5 | L166 T168 Q172 F173 F174 M183 | L166-I170 HydrophobicContact CD1-CD1 3.92Å; L166-I170 HydrophobicContact CD1-CG1 4.18Å; L166-I170 HydrophobicContact CG-CD1 3.83Å; L166-I170 HydrophobicContact CG-CG1 4.48Å; L166-I170 VanDerWaalsContact O-CG1 3.27Å; L166-I170 WeakPolarHBondContact O-CG1 3.42Å; L166-I170 PolarHBondContact O-N 3.19Å; T168-I170 VanDerWaalsContact C-N 3.35Å; T168-I170 PolarHBondContact O-N 2.94Å; I170-Q172 VanDerWaalsContact C-N 3.34Å; I170-Q172 PolarHBondContact O-N 3.14Å; I170-F173 PolarHBondContact O-N 3.37Å; I170-F174 HydrophobicContact CG2-CD2 3.96Å; I170-F174 HydrophobicContact CG2-CE2 3.85Å; I170-F174 WeakPolarHBondContact O-CD2 3.5Å; I170-F174 PolarHBondContact O-N 3.39Å; I170-M183 HydrophobicContact CB-CE 4.44Å; I170-M183 HydrophobicContact CG1-CE 3.85Å |
| 171 | S | 96.5 | Very high | 95 | Very high | 79 Ų | 79 | 66.8 Ų | 66.8 | 55% | 0.552 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -59 | -46.5 | 177.4 | -174.3 | 0 | 0 | 0 | 0 | 111.5 | P167 T168 S169 F173 F174 S175 | P167-S171 PolarHBondContact O-N 3.19Å; P167-S171 VanDerWaalsContact O-N 3.15Å; T168-S171 WeakPolarHBondContact O-CB 3.4Å; T168-S171 PolarHBondContact O-N 3.5Å; S169-S171 PolarHBondContact O-N 2.73Å; S171-F173 VanDerWaalsContact C-N 3.34Å; S171-F173 PolarHBondContact O-N 3.48Å; S171-F174 PolarHBondContact O-N 2.88Å; S171-S175 PolarHBondContact O-N 3.14Å |
| 172 | Q | 95.3 | Very high | 95.1 | Very high | 85 Ų | 85 | 68.4 Ų | 68.4 | 40% | 0.397 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -66.6 | -32.3 | 179.8 | -70.8 | 171 | -34.1 | 0 | 0 | 113.4 | T168 S169 I170 S175 G176 A177 V178 | T168-Q172 WeakPolarHBondContact O-CB 3.46Å; T168-Q172 VanDerWaalsContact O-CG 3.27Å; T168-Q172 WeakPolarHBondContact O-CG 3.4Å; T168-Q172 PolarHBondContact O-N 3.4Å; S169-Q172 PolarHBondContact O-N 2.83Å; I170-Q172 VanDerWaalsContact C-N 3.34Å; I170-Q172 PolarHBondContact O-N 3.14Å; Q172-S175 WeakPolarHBondContact CA-OG 3.35Å; Q172-S175 PolarHBondContact O-N 2.84Å; Q172-S175 PolarHBondContact O-OG 3.48Å; Q172-G176 PolarHBondContact O-N 3.37Å; Q172-A177 HydrophobicContact CB-CB 4.17Å; Q172-A177 PolarHBondContact O-N 2.91Å; Q172-V178 HydrophobicContact CB-CB 4.21Å; Q172-V178 HydrophobicContact CB-CG2 3.55Å; Q172-V178 HydrophobicContact CG-CG2 4.48Å; Q172-V178 PolarHBondContact O-N 3.45Å |
| 173 | F | 96.7 | Very high | 95.2 | Very high | 85 Ų | 85 | 66.8 Ų | 66.8 | 37% | 0.373 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -64.9 | -45.9 | 174.4 | 178.7 | -108.9 | 0 | 0 | 0 | 111.5 | S169 I170 S171 S175 G176 M183 | S169-F173 WeakPolarHBondContact O-CB 3.35Å; S169-F173 PolarHBondContact O-N 2.92Å; I170-F173 PolarHBondContact O-N 3.37Å; S171-F173 VanDerWaalsContact C-N 3.34Å; S171-F173 PolarHBondContact O-N 3.48Å; F173-S175 VanDerWaalsContact C-N 3.29Å; F173-S175 PolarHBondContact O-N 3.31Å; F173-G176 PolarHBondContact O-N 2.91Å; F173-M183 HydrophobicContact CB-CE 4.18Å; F173-M183 HydrophobicContact CB-CG 3.53Å; F173-M183 HydrophobicContact CB-SD 3.83Å; F173-M183 HydrophobicContact CD2-CB 4.22Å; F173-M183 HydrophobicContact CD2-CG 3.38Å; F173-M183 HydrophobicContact CE2-CG 4.23Å; F173-M183 HydrophobicContact CG-CG 3.56Å; F173-M183 HydrophobicContact CG-SD 4.47Å |
| 174 | F | 96.8 | Very high | 95.4 | Very high | 166 Ų | 166 | 65.6 Ų | 65.6 | 73% | 0.728 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -70.6 | -24.4 | 177.6 | -75 | -67.5 | 0 | 0 | 0 | 113.2 | I170 S171 G176 | I170-F174 HydrophobicContact CG2-CD2 3.96Å; I170-F174 HydrophobicContact CG2-CE2 3.85Å; I170-F174 WeakPolarHBondContact O-CD2 3.5Å; I170-F174 PolarHBondContact O-N 3.39Å; S171-F174 PolarHBondContact O-N 2.88Å; F174-G176 VanDerWaalsContact C-N 3.26Å |
| 175 | S | 96.6 | Very high | 95.4 | Very high | 88 Ų | 88 | 62.7 Ų | 62.7 | 62% | 0.615 | 38% | 0.376 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.9 | -3.7 | 170 | 75.5 | 0 | 0 | 0 | 0 | 113.6 | S171 Q172 F173 A177 | S171-S175 PolarHBondContact O-N 3.14Å; Q172-S175 WeakPolarHBondContact CA-OG 3.35Å; Q172-S175 PolarHBondContact O-N 2.84Å; Q172-S175 PolarHBondContact O-OG 3.48Å; F173-S175 VanDerWaalsContact C-N 3.29Å; F173-S175 PolarHBondContact O-N 3.31Å; S175-A177 VanDerWaalsContact C-N 3.28Å; S175-A177 PolarHBondContact O-N 3.5Å |
| 176 | G | 94.6 | Very high | 95.5 | Very high | 65 Ų | 65 | 62.5 Ų | 62.5 | 67% | 0.67 | 38% | 0.375 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 75.9 | 10.5 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | Q172 F173 F174 | Q172-G176 PolarHBondContact O-N 3.37Å; F173-G176 PolarHBondContact O-N 2.91Å; F174-G176 VanDerWaalsContact C-N 3.26Å |
| 177 | A | 93.5 | Very high | 95.6 | Very high | 71 Ų | 71 | 64.2 Ų | 64.2 | 59% | 0.587 | 38% | 0.384 | S | S | * | . | trans | -81.9 | -17.5 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | Q172 S175 | Q172-A177 HydrophobicContact CB-CB 4.17Å; Q172-A177 PolarHBondContact O-N 2.91Å; S175-A177 VanDerWaalsContact C-N 3.28Å; S175-A177 PolarHBondContact O-N 3.5Å | ||
| 178 | V | 94.1 | Very high | 95.7 | Very high | 20 Ų | 20 | 60.9 Ų | 60.9 | 12% | 0.121 | 36% | 0.361 | C | S | . | . | S | Bend | trans | -124.5 | 135.7 | 179.7 | 169.6 | 0 | 0 | 0 | 0 | 109.3 | Q172 E182 M183 | Q172-V178 HydrophobicContact CB-CB 4.21Å; Q172-V178 HydrophobicContact CB-CG2 3.55Å; Q172-V178 HydrophobicContact CG-CG2 4.48Å; Q172-V178 PolarHBondContact O-N 3.45Å; V178-E182 WeakPolarHBondContact CA-OE2 3.23Å; V178-E182 HydrophobicContact CG1-CB 3.66Å; V178-E182 WeakPolarHBondContact CG1-OE2 3.39Å; V178-M183 HydrophobicContact CG1-CG 3.67Å; V178-M183 HydrophobicContact CG1-SD 3.77Å |
| 179 | L | 95.2 | Very high | 95.8 | Very high | 112 Ų | 112 | 57.9 Ų | 57.9 | 59% | 0.586 | 34% | 0.343 | S | S | * | . | trans | -74.4 | 153.2 | 179.1 | -64.7 | 173.7 | 0 | 0 | 0 | 111.3 | S181 E182 M183 | L179-S181 PolarHBondContact O-N 3.1Å; L179-E182 HydrophobicContact CB-CG 4.17Å; L179-E182 PolarHBondContact N-OE2 3.28Å; L179-E182 WeakPolarHBondContact O-CB 3.27Å; L179-E182 PolarHBondContact O-N 2.85Å; L179-M183 PolarHBondContact O-N 2.95Å; L179-M183 VanDerWaalsContact O-N 3.1Å | ||
| 180 | G | 96 | Very high | 95.9 | Very high | 44 Ų | 44 | 59.7 Ų | 59.7 | 45% | 0.454 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -58.5 | -32.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | F184 | G180-F184 WeakPolarHBondContact O-CB 3.45Å; G180-F184 PolarHBondContact O-N 3.22Å |
| 181 | S | 92.9 | Very high | 95.9 | Very high | 78 Ų | 78 | 59.2 Ų | 59.2 | 55% | 0.545 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -66.4 | -37.3 | 175.2 | 48.7 | 0 | 0 | 0 | 0 | 112.9 | L179 F184 V185 | L179-S181 PolarHBondContact O-N 3.1Å; S181-F184 WeakPolarHBondContact O-CB 3.24Å; S181-F184 PolarHBondContact O-N 3.31Å; S181-V185 WeakPolarHBondContact O-CG2 3.5Å; S181-V185 PolarHBondContact O-N 3.18Å; S181-V185 VanDerWaalsContact O-N 3.14Å |
| 182 | E | 93.8 | Very high | 96 | Very high | 49 Ų | 49 | 55.5 Ų | 55.5 | 23% | 0.229 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -69.9 | -46.9 | 178.3 | -62.9 | 170.2 | 164.9 | 0 | 0 | 110 | L152 V178 L179 F184 V185 I186 | L152-E182 HydrophobicContact CD1-CB 4.06Å; L152-E182 HydrophobicContact CD1-CG 4.11Å; L152-E182 HydrophobicContact CD2-CG 3.78Å; L152-E182 WeakPolarHBondContact CD2-OE1 3.15Å; V178-E182 WeakPolarHBondContact CA-OE2 3.23Å; V178-E182 HydrophobicContact CG1-CB 3.66Å; V178-E182 WeakPolarHBondContact CG1-OE2 3.39Å; L179-E182 HydrophobicContact CB-CG 4.17Å; L179-E182 PolarHBondContact N-OE2 3.28Å; L179-E182 WeakPolarHBondContact O-CB 3.27Å; L179-E182 PolarHBondContact O-N 2.85Å; E182-F184 VanDerWaalsContact C-N 3.25Å; E182-F184 PolarHBondContact O-N 3.01Å; E182-V185 PolarHBondContact O-N 3.01Å; E182-I186 WeakPolarHBondContact O-CG1 3.46Å; E182-I186 PolarHBondContact O-N 2.86Å |
| 183 | M | 95.6 | Very high | 96.1 | Very high | 12 Ų | 12 | 55.4 Ų | 55.4 | 6% | 0.059 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -55.9 | -41.8 | 171.9 | -76.4 | -50.7 | -70.2 | 0 | 0 | 112.6 | S169 I170 F173 V178 L179 V185 I186 L187 | S169-M183 WeakPolarHBondContact CB-SD 3.28Å; I170-M183 HydrophobicContact CB-CE 4.44Å; I170-M183 HydrophobicContact CG1-CE 3.85Å; F173-M183 HydrophobicContact CB-CE 4.18Å; F173-M183 HydrophobicContact CB-CG 3.53Å; F173-M183 HydrophobicContact CB-SD 3.83Å; F173-M183 HydrophobicContact CD2-CB 4.22Å; F173-M183 HydrophobicContact CD2-CG 3.38Å; F173-M183 HydrophobicContact CE2-CG 4.23Å; F173-M183 HydrophobicContact CG-CG 3.56Å; F173-M183 HydrophobicContact CG-SD 4.47Å; V178-M183 HydrophobicContact CG1-CG 3.67Å; V178-M183 HydrophobicContact CG1-SD 3.77Å; L179-M183 PolarHBondContact O-N 2.95Å; L179-M183 VanDerWaalsContact O-N 3.1Å; M183-V185 PolarHBondContact O-N 2.94Å; M183-I186 PolarHBondContact O-N 3.44Å; M183-L187 WeakPolarHBondContact O-CB 3.39Å; M183-L187 VanDerWaalsContact O-CG 3.29Å; M183-L187 WeakPolarHBondContact O-CG 3.33Å; M183-L187 PolarHBondContact O-N 3.33Å |
| 184 | F | 96.9 | Very high | 96.2 | Very high | 92 Ų | 92 | 54.1 Ų | 54.1 | 40% | 0.404 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -61.2 | -44.7 | 178.7 | -179.5 | -104.9 | 0 | 0 | 0 | 112 | V21 L25 G180 S181 E182 I186 L187 M188 | V21-F184 HydrophobicContact CG1-CE1 3.97Å; V21-F184 HydrophobicContact CG1-CZ 3.55Å; L25-F184 HydrophobicContact CD1-CE1 4.05Å; L25-F184 HydrophobicContact CD2-CE1 4.18Å; L25-F184 HydrophobicContact CG-CE1 4.44Å; G180-F184 WeakPolarHBondContact O-CB 3.45Å; G180-F184 PolarHBondContact O-N 3.22Å; S181-F184 WeakPolarHBondContact O-CB 3.24Å; S181-F184 PolarHBondContact O-N 3.31Å; E182-F184 VanDerWaalsContact C-N 3.25Å; E182-F184 PolarHBondContact O-N 3.01Å; F184-I186 VanDerWaalsContact C-N 3.34Å; F184-I186 PolarHBondContact O-N 3.26Å; F184-L187 PolarHBondContact O-N 3.41Å; F184-M188 HydrophobicContact CD1-CG 4.38Å; F184-M188 HydrophobicContact CE1-CG 4.05Å; F184-M188 HydrophobicContact CE2-CG 4.32Å; F184-M188 HydrophobicContact CZ-CG 4.03Å; F184-M188 HydrophobicContact CZ-SD 4.35Å; F184-M188 WeakPolarHBondContact O-CB 3.44Å; F184-M188 VanDerWaalsContact O-CG 3.31Å; F184-M188 WeakPolarHBondContact O-CG 3.17Å; F184-M188 PolarHBondContact O-N 3.26Å |
| 185 | V | 95.9 | Very high | 96.3 | Very high | 5 Ų | 5 | 47.6 Ų | 47.6 | 3% | 0.03 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -63 | -41.6 | 176.2 | 174.2 | 0 | 0 | 0 | 0 | 111.2 | L29 F30 Y147 I148 S181 E182 M183 M188 L189 | L29-V185 HydrophobicContact CD2-CG2 3.6Å; F30-V185 HydrophobicContact CE1-CG1 4.34Å; F30-V185 HydrophobicContact CZ-CG1 4.34Å; Y147-V185 HydrophobicContact CD1-CG1 4.33Å; I148-V185 HydrophobicContact CG2-CG1 3.82Å; S181-V185 WeakPolarHBondContact O-CG2 3.5Å; S181-V185 PolarHBondContact O-N 3.18Å; S181-V185 VanDerWaalsContact O-N 3.14Å; E182-V185 PolarHBondContact O-N 3.01Å; M183-V185 PolarHBondContact O-N 2.94Å; V185-M188 PolarHBondContact O-N 2.98Å; V185-L189 PolarHBondContact O-N 3.48Å |
| 186 | I | 96.4 | Very high | 96.4 | Very high | 3 Ų | 3 | 43.8 Ų | 43.8 | 2% | 0.015 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -63.4 | -46 | 177.3 | -66.3 | 169.5 | 0 | 0 | 0 | 110.6 | L165 L166 S169 E182 M183 F184 M188 L189 Y190 | L165-I186 HydrophobicContact CD1-CD1 4.17Å; L165-I186 HydrophobicContact CD2-CG2 4.17Å; L165-I186 HydrophobicContact CG-CG2 4Å; L166-I186 HydrophobicContact CD1-CG2 4.45Å; S169-I186 WeakPolarHBondContact OG-CD1 3.48Å; E182-I186 WeakPolarHBondContact O-CG1 3.46Å; E182-I186 PolarHBondContact O-N 2.86Å; M183-I186 PolarHBondContact O-N 3.44Å; F184-I186 VanDerWaalsContact C-N 3.34Å; F184-I186 PolarHBondContact O-N 3.26Å; I186-M188 VanDerWaalsContact C-N 3.34Å; I186-M188 PolarHBondContact O-N 2.88Å; I186-L189 WeakPolarHBondContact O-CB 3.32Å; I186-L189 PolarHBondContact O-N 3.2Å; I186-Y190 HydrophobicContact CG2-CD2 4.22Å; I186-Y190 HydrophobicContact CG2-CE2 3.83Å; I186-Y190 WeakPolarHBondContact O-CD2 3.5Å; I186-Y190 PolarHBondContact O-N 2.95Å |
| 187 | L | 97.6 | Very high | 96.5 | Very high | 83 Ų | 83 | 45.4 Ų | 45.4 | 44% | 0.435 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -60.4 | -43.2 | 175.6 | -72.1 | 171.7 | 0 | 0 | 0 | 111.8 | L166 M183 F184 L189 Y190 L191 | L166-L187 HydrophobicContact CD1-CD2 3.8Å; M183-L187 WeakPolarHBondContact O-CB 3.39Å; M183-L187 VanDerWaalsContact O-CG 3.29Å; M183-L187 WeakPolarHBondContact O-CG 3.33Å; M183-L187 PolarHBondContact O-N 3.33Å; F184-L187 PolarHBondContact O-N 3.41Å; L187-L189 VanDerWaalsContact C-N 3.29Å; L187-L189 PolarHBondContact O-N 3.4Å; L187-Y190 PolarHBondContact O-N 3.47Å; L187-L191 WeakPolarHBondContact O-CG 3.37Å; L187-L191 PolarHBondContact O-N 3.06Å |
| 188 | M | 97.8 | Very high | 96.8 | Very high | 5 Ų | 5 | 44.4 Ų | 44.4 | 3% | 0.025 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -61.1 | -37.7 | 175.7 | -76.1 | -60.9 | -54.2 | 0 | 0 | 112.4 | I18 V21 L25 F184 V185 I186 Y190 L191 W192 | I18-M188 HydrophobicContact CD1-SD 4.34Å; I18-M188 HydrophobicContact CG2-CE 4.35Å; V21-M188 HydrophobicContact CG1-CE 3.83Å; V21-M188 HydrophobicContact CG1-CG 4.42Å; V21-M188 HydrophobicContact CG1-SD 3.84Å; L25-M188 HydrophobicContact CD1-CB 4.18Å; L25-M188 HydrophobicContact CD1-CE 4.41Å; L25-M188 HydrophobicContact CD1-CG 3.89Å; F184-M188 HydrophobicContact CD1-CG 4.38Å; F184-M188 HydrophobicContact CE1-CG 4.05Å; F184-M188 HydrophobicContact CE2-CG 4.32Å; F184-M188 HydrophobicContact CZ-CG 4.03Å; F184-M188 HydrophobicContact CZ-SD 4.35Å; F184-M188 WeakPolarHBondContact O-CB 3.44Å; F184-M188 VanDerWaalsContact O-CG 3.31Å; F184-M188 WeakPolarHBondContact O-CG 3.17Å; F184-M188 PolarHBondContact O-N 3.26Å; V185-M188 PolarHBondContact O-N 2.98Å; I186-M188 VanDerWaalsContact C-N 3.34Å; I186-M188 PolarHBondContact O-N 2.88Å; M188-Y190 PolarHBondContact O-N 3.18Å; M188-L191 PolarHBondContact O-N 3.21Å; M188-L191 HydrophobicContact SD-CD1 3.99Å; M188-W192 HydrophobicContact CB-CH2 3.93Å; M188-W192 HydrophobicContact CB-CZ2 4Å; M188-W192 HydrophobicContact CB-CZ3 4.24Å; M188-W192 HydrophobicContact CE-CZ2 3.67Å; M188-W192 VanDerWaalsContact O-CD2 3.25Å; M188-W192 PolarHBondContact O-N 3.43Å |
| 189 | L | 97 | Very high | 97 | Very high | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -59.5 | -44.2 | 175.1 | 172.9 | 160 | 0 | 0 | 0 | 112.4 | M141 V145 I148 F162 V185 I186 L187 W192 F193 | M141-L189 HydrophobicContact CG-CG 4.34Å; V145-L189 HydrophobicContact CG2-CD1 3.67Å; I148-L189 HydrophobicContact CD1-CD1 3.6Å; F162-L189 HydrophobicContact CD2-CD2 4.19Å; F162-L189 HydrophobicContact CE2-CD2 3.4Å; F162-L189 HydrophobicContact CE2-CG 4.49Å; F162-L189 HydrophobicContact CZ-CD2 4.01Å; V185-L189 PolarHBondContact O-N 3.48Å; I186-L189 WeakPolarHBondContact O-CB 3.32Å; I186-L189 PolarHBondContact O-N 3.2Å; L187-L189 VanDerWaalsContact C-N 3.29Å; L187-L189 PolarHBondContact O-N 3.4Å; L189-W192 HydrophobicContact CB-CE3 4.44Å; L189-W192 PolarHBondContact O-N 3.46Å; L189-F193 PolarHBondContact O-N 3.04Å |
| 190 | Y | 97.5 | Very high | 97.1 | Very high | 41 Ų | 41 | 40.7 Ų | 40.7 | 16% | 0.161 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -69.5 | -34.7 | 174.8 | -72.6 | -80.7 | 0 | 0 | 0 | 112.9 | F162 L165 L166 I186 L187 M188 F193 A194 | F162-Y190 HydrophobicContact CD1-CE1 4.21Å; F162-Y190 HydrophobicContact CE1-CD1 4.14Å; F162-Y190 AromaticContact CE1-CE1 3.71Å; F162-Y190 HydrophobicContact CE1-CE1 3.71Å; F162-Y190 HydrophobicContact CE2-CE1 4.47Å; F162-Y190 HydrophobicContact CZ-CD1 4.03Å; F162-Y190 AromaticContact CZ-CE1 3.86Å; F162-Y190 HydrophobicContact CZ-CE1 3.86Å; F162-Y190 PolarHBondContact O-OH 3.04Å; L165-Y190 WeakPolarHBondContact CB-OH 3.32Å; L165-Y190 HydrophobicContact CD2-CE2 4.29Å; L165-Y190 HydrophobicContact CG-CE2 4.46Å; L166-Y190 HydrophobicContact CB-CD2 4.11Å; L166-Y190 HydrophobicContact CB-CE1 4.3Å; L166-Y190 HydrophobicContact CB-CE2 3.48Å; L166-Y190 VanDerWaalsContact CB-CE2 3.48Å; L166-Y190 HydrophobicContact CD1-CD2 4.12Å; L166-Y190 HydrophobicContact CD1-CE2 4.16Å; L166-Y190 HydrophobicContact CD2-CD2 4.26Å; L166-Y190 HydrophobicContact CD2-CE2 4.43Å; L166-Y190 HydrophobicContact CD2-CG 4.41Å; L166-Y190 HydrophobicContact CG-CD2 4.4Å; L166-Y190 HydrophobicContact CG-CE2 4.23Å; L166-Y190 PolarHBondContact N-OH 3.31Å; I186-Y190 HydrophobicContact CG2-CD2 4.22Å; I186-Y190 HydrophobicContact CG2-CE2 3.83Å; I186-Y190 WeakPolarHBondContact O-CD2 3.5Å; I186-Y190 PolarHBondContact O-N 2.95Å; L187-Y190 PolarHBondContact O-N 3.47Å; M188-Y190 PolarHBondContact O-N 3.18Å; Y190-F193 PolarHBondContact O-N 3.43Å; Y190-A194 WeakPolarHBondContact O-CB 3.36Å; Y190-A194 PolarHBondContact O-N 3.42Å |
| 191 | L | 98.1 | Very high | 97.2 | Very high | 60 Ų | 60 | 40.6 Ų | 40.6 | 31% | 0.314 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -64.3 | -44.1 | 174.4 | -71.9 | 175.3 | 0 | 0 | 0 | 111.6 | I18 L187 M188 F193 A194 I195 | I18-L191 HydrophobicContact CD1-CD1 4.09Å; L187-L191 WeakPolarHBondContact O-CG 3.37Å; L187-L191 PolarHBondContact O-N 3.06Å; M188-L191 PolarHBondContact O-N 3.21Å; M188-L191 HydrophobicContact SD-CD1 3.99Å; L191-F193 VanDerWaalsContact C-N 3.35Å; L191-F193 PolarHBondContact O-N 3.33Å; L191-A194 PolarHBondContact O-N 2.82Å; L191-I195 WeakPolarHBondContact O-CB 3.38Å; L191-I195 VanDerWaalsContact O-CG1 3.24Å; L191-I195 WeakPolarHBondContact O-CG1 3.34Å; L191-I195 PolarHBondContact O-N 2.94Å |
| 192 | W | 98.5 | Very high | 97.3 | Very high | 2 Ų | 2 | 42 Ų | 42 | 1% | 0.008 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -61.4 | -43.3 | 174.2 | -66.4 | -39.8 | 0 | 0 | 0 | 111.8 | T22 L25 F30 C137 S140 M141 M188 L189 G196 | T22-W192 HydrophobicContact CG2-CZ2 3.89Å; T22-W192 PolarHBondContact OG1-NE1 3.47Å; L25-W192 HydrophobicContact CD1-CH2 3.81Å; L25-W192 HydrophobicContact CD1-CZ2 3.84Å; F30-W192 AromaticContact CE2-CH2 3.55Å; F30-W192 HydrophobicContact CE2-CH2 3.55Å; F30-W192 AromaticContact CE2-CZ3 3.92Å; F30-W192 HydrophobicContact CE2-CZ3 3.92Å; F30-W192 AromaticContact CZ-CH2 3.74Å; F30-W192 HydrophobicContact CZ-CH2 3.74Å; F30-W192 AromaticContact CZ-CZ3 3.98Å; F30-W192 HydrophobicContact CZ-CZ3 3.98Å; C137-W192 HydrophobicContact CB-CB 4.23Å; C137-W192 WeakPolarHBondContact CB-O 3.33Å; S140-W192 WeakPolarHBondContact O-CZ3 3.49Å; M141-W192 HydrophobicContact CB-CB 4.35Å; M188-W192 HydrophobicContact CB-CH2 3.93Å; M188-W192 HydrophobicContact CB-CZ2 4Å; M188-W192 HydrophobicContact CB-CZ3 4.24Å; M188-W192 HydrophobicContact CE-CZ2 3.67Å; M188-W192 VanDerWaalsContact O-CD2 3.25Å; M188-W192 PolarHBondContact O-N 3.43Å; L189-W192 HydrophobicContact CB-CE3 4.44Å; L189-W192 PolarHBondContact O-N 3.46Å; W192-G196 WeakPolarHBondContact O-CA 3.33Å; W192-G196 PolarHBondContact O-N 3.3Å |
| 193 | F | 97.8 | Very high | 97.5 | Very high | 83 Ų | 83 | 40 Ų | 40 | 36% | 0.364 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -58.8 | -50.2 | 175.8 | 179.6 | -112.7 | 0 | 0 | 0 | 111.8 | M141 F162 L189 Y190 L191 G196 L197 | M141-F193 HydrophobicContact SD-CB 3.97Å; M141-F193 HydrophobicContact SD-CD2 3.75Å; M141-F193 HydrophobicContact SD-CG 4.31Å; F162-F193 HydrophobicContact CE1-CD1 4.06Å; F162-F193 HydrophobicContact CE1-CE1 4.11Å; F162-F193 HydrophobicContact CE1-CG 4.35Å; F162-F193 HydrophobicContact CE1-CZ 4.45Å; F162-F193 HydrophobicContact CZ-CB 4.12Å; F162-F193 AromaticContact CZ-CD1 3.99Å; F162-F193 HydrophobicContact CZ-CD1 3.99Å; F162-F193 HydrophobicContact CZ-CD2 4.24Å; F162-F193 HydrophobicContact CZ-CE1 4.43Å; F162-F193 AromaticContact CZ-CG 3.86Å; F162-F193 HydrophobicContact CZ-CG 3.86Å; L189-F193 PolarHBondContact O-N 3.04Å; Y190-F193 PolarHBondContact O-N 3.43Å; L191-F193 VanDerWaalsContact C-N 3.35Å; L191-F193 PolarHBondContact O-N 3.33Å; F193-G196 PolarHBondContact O-N 3.4Å; F193-L197 HydrophobicContact CD1-CD1 4.16Å; F193-L197 HydrophobicContact CD2-CD1 4.25Å; F193-L197 HydrophobicContact CD2-CG 4.39Å; F193-L197 HydrophobicContact CE1-CD1 3.6Å; F193-L197 HydrophobicContact CE2-CD1 3.7Å; F193-L197 HydrophobicContact CE2-CG 4.11Å; F193-L197 HydrophobicContact CG-CD1 4.47Å; F193-L197 HydrophobicContact CZ-CD1 3.36Å; F193-L197 HydrophobicContact CZ-CG 4.27Å; F193-L197 WeakPolarHBondContact O-CB 3.35Å; F193-L197 WeakPolarHBondContact O-CG 3.35Å; F193-L197 PolarHBondContact O-N 3.3Å |
| 194 | A | 98.1 | Very high | 97.6 | Very high | 57 Ų | 57 | 42.8 Ų | 42.8 | 47% | 0.471 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -64 | -47.6 | -179 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y190 L191 A198 | Y190-A194 WeakPolarHBondContact O-CB 3.36Å; Y190-A194 PolarHBondContact O-N 3.42Å; L191-A194 PolarHBondContact O-N 2.82Å; A194-A198 WeakPolarHBondContact O-CB 3.47Å; A194-A198 PolarHBondContact O-N 3.49Å |
| 195 | I | 98.3 | Very high | 97.5 | Very high | 30 Ų | 30 | 42.4 Ų | 42.4 | 15% | 0.154 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -65.4 | -42 | 178.5 | -66.1 | 168.2 | 0 | 0 | 0 | 110.3 | Y14 I18 T133 L191 A198 C199 | Y14-I195 HydrophobicContact CE1-CD1 4.41Å; I18-I195 HydrophobicContact CG2-CD1 3.93Å; T133-I195 HydrophobicContact CG2-CG2 4.08Å; L191-I195 WeakPolarHBondContact O-CB 3.38Å; L191-I195 VanDerWaalsContact O-CG1 3.24Å; L191-I195 WeakPolarHBondContact O-CG1 3.34Å; L191-I195 PolarHBondContact O-N 2.94Å; I195-A198 PolarHBondContact O-N 3.47Å; I195-C199 WeakPolarHBondContact O-CB 3.27Å; I195-C199 PolarHBondContact O-N 2.94Å; I195-C199 PolarHBondContact O-SG 3.47Å |
| 196 | G | 98.3 | Very high | 97.4 | Very high | 8 Ų | 8 | 42.5 Ų | 42.5 | 8% | 0.082 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -60.6 | -45.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | S134 W192 F193 A200 | S134-G196 PolarHBondContact OG-O 3.23Å; W192-G196 WeakPolarHBondContact O-CA 3.33Å; W192-G196 PolarHBondContact O-N 3.3Å; F193-G196 PolarHBondContact O-N 3.4Å; G196-A200 WeakPolarHBondContact O-CB 3.41Å; G196-A200 PolarHBondContact O-N 3.41Å |
| 197 | L | 98.3 | Very high | 97.3 | Very high | 99 Ų | 99 | 45 Ų | 45 | 52% | 0.518 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -66 | -44.5 | 175.1 | -75.8 | -178.4 | 0 | 0 | 0 | 112.5 | F193 C199 A200 G201 | F193-L197 HydrophobicContact CD1-CD1 4.16Å; F193-L197 HydrophobicContact CD2-CD1 4.25Å; F193-L197 HydrophobicContact CD2-CG 4.39Å; F193-L197 HydrophobicContact CE1-CD1 3.6Å; F193-L197 HydrophobicContact CE2-CD1 3.7Å; F193-L197 HydrophobicContact CE2-CG 4.11Å; F193-L197 HydrophobicContact CG-CD1 4.47Å; F193-L197 HydrophobicContact CZ-CD1 3.36Å; F193-L197 HydrophobicContact CZ-CG 4.27Å; F193-L197 WeakPolarHBondContact O-CB 3.35Å; F193-L197 WeakPolarHBondContact O-CG 3.35Å; F193-L197 PolarHBondContact O-N 3.3Å; L197-C199 VanDerWaalsContact C-N 3.34Å; L197-C199 PolarHBondContact O-N 2.9Å; L197-A200 PolarHBondContact O-N 3.32Å; L197-G201 PolarHBondContact O-N 3.15Å |
| 198 | A | 97.9 | Very high | 97.2 | Very high | 49 Ų | 49 | 45 Ų | 45 | 41% | 0.405 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -59.3 | -46.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | A194 I195 G201 F202 | A194-A198 WeakPolarHBondContact O-CB 3.47Å; A194-A198 PolarHBondContact O-N 3.49Å; I195-A198 PolarHBondContact O-N 3.47Å; A198-G201 PolarHBondContact O-N 2.81Å; A198-F202 WeakPolarHBondContact O-CD2 3.22Å; A198-F202 PolarHBondContact O-N 3.39Å |
| 199 | C | 98.3 | Very high | 96.9 | Very high | 15 Ų | 15 | 45.2 Ų | 45.2 | 10% | 0.101 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -65.6 | -40.1 | 178 | -68.5 | 0 | 0 | 0 | 0 | 112.3 | C130 I195 L197 G201 F202 C203 | C130-C199 HydrophobicContact CB-CB 4.41Å; C130-C199 WeakPolarHBondContact O-CB 3.22Å; I195-C199 WeakPolarHBondContact O-CB 3.27Å; I195-C199 PolarHBondContact O-N 2.94Å; I195-C199 PolarHBondContact O-SG 3.47Å; L197-C199 VanDerWaalsContact C-N 3.34Å; L197-C199 PolarHBondContact O-N 2.9Å; C199-G201 VanDerWaalsContact C-N 3.34Å; C199-G201 PolarHBondContact O-N 2.91Å; C199-F202 PolarHBondContact O-N 2.98Å; C199-C203 VanDerWaalsContact O-CB 3.22Å; C199-C203 WeakPolarHBondContact O-CB 3.36Å; C199-C203 PolarHBondContact O-N 2.92Å |
| 200 | A | 98.3 | Very high | 96.6 | Very high | 39 Ų | 39 | 45.8 Ų | 45.8 | 32% | 0.322 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -60.1 | -44.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | S134 G196 L197 C203 C204 | S134-A200 WeakPolarHBondContact OG-CB 3.17Å; G196-A200 WeakPolarHBondContact O-CB 3.41Å; G196-A200 PolarHBondContact O-N 3.41Å; L197-A200 PolarHBondContact O-N 3.32Å; A200-C203 PolarHBondContact O-N 2.97Å; A200-C204 VanDerWaalsContact O-CB 3.28Å; A200-C204 WeakPolarHBondContact O-CB 3.48Å; A200-C204 PolarHBondContact O-N 3.49Å |
| 201 | G | 97.9 | Very high | 96.4 | Very high | 43 Ų | 43 | 46.8 Ų | 46.8 | 44% | 0.443 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -61 | -47.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | L197 A198 C199 C204 H205 | L197-G201 PolarHBondContact O-N 3.15Å; A198-G201 PolarHBondContact O-N 2.81Å; C199-G201 VanDerWaalsContact C-N 3.34Å; C199-G201 PolarHBondContact O-N 2.91Å; G201-C204 PolarHBondContact O-N 2.82Å; G201-H205 WeakPolarHBondContact O-CB 3.47Å; G201-H205 PolarHBondContact O-N 3.01Å |
| 202 | F | 96.1 | Very high | 96 | Very high | 107 Ų | 107 | 51.7 Ų | 51.7 | 47% | 0.469 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -63.7 | -44 | 175.4 | -71.9 | -56.2 | 0 | 0 | 0 | 112.3 | A198 C199 H205 Q206 | A198-F202 WeakPolarHBondContact O-CD2 3.22Å; A198-F202 PolarHBondContact O-N 3.39Å; C199-F202 PolarHBondContact O-N 2.98Å; F202-H205 PolarHBondContact O-N 3.47Å; F202-Q206 WeakPolarHBondContact O-CG 3.48Å; F202-Q206 PolarHBondContact O-N 3.48Å |
| 203 | C | 96.9 | Very high | 95.5 | Very high | 8 Ų | 8 | 53.1 Ų | 53.1 | 5% | 0.054 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -58 | -50.7 | 176.6 | -176.5 | 0 | 0 | 0 | 0 | 111 | C130 C199 A200 H205 Q206 L207 | C130-C203 HydrophobicContact CB-CB 3.87Å; C199-C203 VanDerWaalsContact O-CB 3.22Å; C199-C203 WeakPolarHBondContact O-CB 3.36Å; C199-C203 PolarHBondContact O-N 2.92Å; A200-C203 PolarHBondContact O-N 2.97Å; C203-H205 PolarHBondContact O-N 3.05Å; C203-Q206 PolarHBondContact O-N 3.22Å; C203-L207 WeakPolarHBondContact O-CB 3.19Å; C203-L207 VanDerWaalsContact O-CG 3.3Å; C203-L207 WeakPolarHBondContact O-CG 3.33Å; C203-L207 PolarHBondContact O-N 3.31Å |
| 204 | C | 97.3 | Very high | 94.9 | Very high | 69 Ų | 69 | 51.6 Ų | 51.6 | 47% | 0.466 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -59.8 | -48 | 178 | -177.2 | 0 | 0 | 0 | 0 | 111.6 | A200 G201 Q206 L207 L208 | A200-C204 VanDerWaalsContact O-CB 3.28Å; A200-C204 WeakPolarHBondContact O-CB 3.48Å; A200-C204 PolarHBondContact O-N 3.49Å; G201-C204 PolarHBondContact O-N 2.82Å; C204-Q206 PolarHBondContact O-N 2.96Å; C204-L207 PolarHBondContact O-N 2.9Å; C204-L208 VanDerWaalsContact O-CG 3.3Å; C204-L208 WeakPolarHBondContact O-CG 3.28Å; C204-L208 PolarHBondContact O-N 3.33Å |
| 205 | H | 94.9 | Very high | 94.2 | Very high | 85 Ų | 85 | 50.5 Ų | 50.5 | 39% | 0.394 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -56.7 | -48.6 | 178.4 | -177.5 | 69.1 | 0 | 0 | 0 | 112 | G201 F202 C203 L208 L209 | G201-H205 WeakPolarHBondContact O-CB 3.47Å; G201-H205 PolarHBondContact O-N 3.01Å; F202-H205 PolarHBondContact O-N 3.47Å; C203-H205 PolarHBondContact O-N 3.05Å; H205-L208 PolarHBondContact O-N 2.92Å; H205-L209 WeakPolarHBondContact O-CG 3.5Å; H205-L209 PolarHBondContact O-N 2.85Å; H205-L209 VanDerWaalsContact O-N 3.12Å |
| 206 | Q | 94.9 | Very high | 93.4 | Very high | 7 Ų | 7 | 53 Ų | 53 | 3% | 0.033 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -68.9 | -40.2 | -179.8 | -64.1 | -59.7 | -3.2 | 0 | 0 | 112.2 | D108 F126 V127 F202 C203 C204 L208 L209 I210 | D108-Q206 PolarHBondContact OD2-NE2 2.98Å; F126-Q206 HydrophobicContact CD1-CG 4.25Å; F126-Q206 HydrophobicContact CE1-CG 3.87Å; V127-Q206 HydrophobicContact CG2-CB 3.84Å; F202-Q206 WeakPolarHBondContact O-CG 3.48Å; F202-Q206 PolarHBondContact O-N 3.48Å; C203-Q206 PolarHBondContact O-N 3.22Å; C204-Q206 PolarHBondContact O-N 2.96Å; Q206-L208 VanDerWaalsContact C-N 3.31Å; Q206-L208 PolarHBondContact O-N 3.42Å; Q206-L209 PolarHBondContact O-N 3.34Å; Q206-I210 WeakPolarHBondContact O-CB 3.37Å; Q206-I210 WeakPolarHBondContact O-CD1 3.38Å; Q206-I210 WeakPolarHBondContact O-CG1 3.43Å; Q206-I210 PolarHBondContact O-N 3.01Å |
| 207 | L | 94.1 | Very high | 92.7 | Very high | 55 Ų | 55 | 56.9 Ų | 56.9 | 29% | 0.288 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -59.6 | -42 | 175 | -76.5 | 172.3 | 0 | 0 | 0 | 111.6 | V127 C203 C204 I210 L211 F238 | V127-L207 HydrophobicContact CG1-CD1 4.44Å; V127-L207 HydrophobicContact CG1-CD2 3.84Å; V127-L207 HydrophobicContact CG1-CG 3.89Å; C203-L207 WeakPolarHBondContact O-CB 3.19Å; C203-L207 VanDerWaalsContact O-CG 3.3Å; C203-L207 WeakPolarHBondContact O-CG 3.33Å; C203-L207 PolarHBondContact O-N 3.31Å; C204-L207 PolarHBondContact O-N 2.9Å; L207-I210 PolarHBondContact O-N 2.93Å; L207-L211 WeakPolarHBondContact O-CB 3.27Å; L207-L211 WeakPolarHBondContact O-CG 3.32Å; L207-L211 PolarHBondContact O-N 2.88Å; L207-F238 HydrophobicContact CD2-CE2 4.24Å; L207-F238 HydrophobicContact CD2-CZ 4.09Å |
| 208 | L | 94.3 | Very high | 92 | Very high | 83 Ų | 83 | 54.6 Ų | 54.6 | 44% | 0.435 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -63.2 | -41.7 | 176.2 | -70.6 | 172.7 | 0 | 0 | 0 | 112.4 | C204 H205 Q206 L211 R212 | C204-L208 VanDerWaalsContact O-CG 3.3Å; C204-L208 WeakPolarHBondContact O-CG 3.28Å; C204-L208 PolarHBondContact O-N 3.33Å; H205-L208 PolarHBondContact O-N 2.92Å; Q206-L208 VanDerWaalsContact C-N 3.31Å; Q206-L208 PolarHBondContact O-N 3.42Å; L208-L211 PolarHBondContact O-N 2.93Å; L208-R212 WeakPolarHBondContact O-CG 3.49Å; L208-R212 PolarHBondContact O-N 3.46Å; L208-R212 VanDerWaalsContact O-N 3.13Å |
| 209 | L | 92.4 | Very high | 91.4 | Very high | 10 Ų | 10 | 55.5 Ų | 55.5 | 5% | 0.052 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -62.7 | -45.2 | 174.9 | -71.8 | 179.9 | 0 | 0 | 0 | 111.6 | H205 Q206 R212 G213 Q214 R216 V219 | H205-L209 WeakPolarHBondContact O-CG 3.5Å; H205-L209 PolarHBondContact O-N 2.85Å; H205-L209 VanDerWaalsContact O-N 3.12Å; Q206-L209 PolarHBondContact O-N 3.34Å; L209-R212 CarbonylContact O-C 3.54Å; L209-R212 PolarHBondContact O-N 2.81Å; L209-G213 PolarHBondContact O-N 3.03Å; L209-Q214 CarbonylContact C-O 3.6Å; L209-Q214 WeakPolarHBondContact CB-O 3.31Å; L209-Q214 PolarHBondContact O-N 2.93Å; L209-R216 HydrophobicContact CD1-CB 4.11Å; L209-V219 HydrophobicContact CD2-CG2 3.67Å |
| 210 | I | 91.5 | Very high | 90.8 | Very high | 12 Ų | 12 | 63.1 Ų | 63.1 | 6% | 0.062 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -62.5 | -46.2 | 177.2 | -65.9 | 163.8 | 0 | 0 | 0 | 110.5 | M123 V127 Q206 L207 R212 G213 N233 L234 V237 F238 | M123-I210 HydrophobicContact CG-CD1 4.1Å; V127-I210 HydrophobicContact CG2-CD1 3.91Å; Q206-I210 WeakPolarHBondContact O-CB 3.37Å; Q206-I210 WeakPolarHBondContact O-CD1 3.38Å; Q206-I210 WeakPolarHBondContact O-CG1 3.43Å; Q206-I210 PolarHBondContact O-N 3.01Å; L207-I210 PolarHBondContact O-N 2.93Å; I210-R212 PolarHBondContact O-N 2.59Å; I210-G213 WeakPolarHBondContact O-CA 3.15Å; I210-G213 PolarHBondContact O-N 2.95Å; I210-N233 WeakPolarHBondContact O-CB 3.37Å; I210-L234 HydrophobicContact CG2-CD2 3.92Å; I210-V237 HydrophobicContact CD1-CG1 4.05Å; I210-V237 HydrophobicContact CD1-CG2 4.39Å; I210-V237 HydrophobicContact CG1-CG2 4.14Å; I210-V237 HydrophobicContact CG2-CB 4.17Å; I210-V237 HydrophobicContact CG2-CG2 3.79Å; I210-F238 HydrophobicContact CD1-CE2 4.2Å |
| 211 | L | 91.8 | Very high | 90.1 | Very high | 61 Ų | 61 | 68.5 Ų | 68.5 | 32% | 0.319 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -59.3 | -36.7 | 178.9 | -73.2 | 168.2 | 0 | 0 | 0 | 111.9 | L207 L208 G213 W230 N233 L234 | L207-L211 WeakPolarHBondContact O-CB 3.27Å; L207-L211 WeakPolarHBondContact O-CG 3.32Å; L207-L211 PolarHBondContact O-N 2.88Å; L208-L211 PolarHBondContact O-N 2.93Å; L211-G213 VanDerWaalsContact C-N 3.29Å; L211-G213 PolarHBondContact O-N 2.56Å; L211-W230 HydrophobicContact CD2-CB 4.01Å; L211-W230 HydrophobicContact CD2-CD2 4.48Å; L211-W230 HydrophobicContact CD2-CE3 3.92Å; L211-N233 PolarHBondContact O-ND2 3.41Å; L211-L234 HydrophobicContact CD2-CD1 3.81Å; L211-L234 HydrophobicContact CD2-CD2 4.2Å; L211-L234 HydrophobicContact CD2-CG 3.83Å |
| 212 | R | 89.9 | Confident | 89.4 | Confident | 164 Ų | 164 | 69.6 Ų | 69.6 | 62% | 0.619 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -76.2 | -12.2 | 174.1 | -68.4 | 174.6 | -177.8 | -179.7 | 1.4 | 113.9 | L208 L209 I210 Q214 | L208-R212 WeakPolarHBondContact O-CG 3.49Å; L208-R212 PolarHBondContact O-N 3.46Å; L208-R212 VanDerWaalsContact O-N 3.13Å; L209-R212 CarbonylContact O-C 3.54Å; L209-R212 PolarHBondContact O-N 2.81Å; I210-R212 PolarHBondContact O-N 2.59Å; R212-Q214 VanDerWaalsContact C-N 3.28Å; R212-Q214 HydrophobicContact CB-CB 4.43Å; R212-Q214 HydrophobicContact CB-CG 4.23Å |
| 213 | G | 87.4 | Confident | 88.8 | Confident | 31 Ų | 31 | 67.8 Ų | 67.8 | 32% | 0.32 | 35% | 0.347 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 68.3 | 27.2 | -175 | 0 | 0 | 0 | 0 | 0 | 112.9 | L209 I210 L211 N233 | L209-G213 PolarHBondContact O-N 3.03Å; I210-G213 WeakPolarHBondContact O-CA 3.15Å; I210-G213 PolarHBondContact O-N 2.95Å; L211-G213 VanDerWaalsContact C-N 3.29Å; L211-G213 PolarHBondContact O-N 2.56Å; G213-N233 PolarHBondContact N-ND2 3.38Å |
| 214 | Q | 85.9 | Confident | 87.9 | Confident | 51 Ų | 51 | 72 Ų | 72 | 24% | 0.238 | 38% | 0.382 | C | S | . | . | trans | -116.4 | 145.6 | -175.9 | -67.6 | -177.1 | -45.6 | 0 | 0 | 111.2 | L209 R212 V219 V225 | L209-Q214 CarbonylContact C-O 3.6Å; L209-Q214 WeakPolarHBondContact CB-O 3.31Å; L209-Q214 PolarHBondContact O-N 2.93Å; R212-Q214 VanDerWaalsContact C-N 3.28Å; R212-Q214 HydrophobicContact CB-CB 4.43Å; R212-Q214 HydrophobicContact CB-CG 4.23Å; Q214-V219 HydrophobicContact CB-CG2 3.94Å; Q214-V225 HydrophobicContact CG-CB 4.21Å; Q214-V225 HydrophobicContact CG-CG2 3.9Å | ||
| 215 | T | 83.1 | Confident | 87.1 | Confident | 34 Ų | 34 | 71.5 Ų | 71.5 | 21% | 0.209 | 38% | 0.377 | C | S | . | . | trans | -88.3 | 156 | 166 | 61.3 | 0 | 0 | 0 | 0 | 110.3 | H217 Q218 V219 | T215-H217 PolarHBondContact O-N 3.37Å; T215-Q218 PolarHBondContact O-N 3.32Å; T215-Q218 VanDerWaalsContact O-N 3.08Å; T215-Q218 VanDerWaalsContact OG1-CD 3.26Å; T215-Q218 VanDerWaalsContact OG1-CG 3.25Å; T215-Q218 WeakPolarHBondContact OG1-CG 3.37Å; T215-Q218 PolarHBondContact OG1-N 2.93Å; T215-Q218 PolarHBondContact OG1-OE1 3.45Å; T215-V219 PolarHBondContact O-N 3Å; T215-V219 VanDerWaalsContact O-N 3.12Å | ||
| 216 | R | 83 | Confident | 86.4 | Confident | 82 Ų | 82 | 78.2 Ų | 78.2 | 31% | 0.309 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -55.7 | -35.8 | 174.9 | -174 | -174.5 | -173.2 | -163.3 | 10.7 | 112.8 | D108 L209 R220 | D108-R216 WeakPolarHBondContact OD1-CB 3.38Å; L209-R216 HydrophobicContact CD1-CB 4.11Å; R216-R220 WeakPolarHBondContact O-CB 3.44Å; R216-R220 WeakPolarHBondContact O-CG 3.37Å; R216-R220 PolarHBondContact O-N 2.91Å |
| 217 | H | 82.1 | Confident | 85.8 | Confident | 91 Ų | 91 | 82.5 Ų | 82.5 | 42% | 0.421 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -61.3 | -48.4 | 175.8 | 179.4 | 83.8 | 0 | 0 | 0 | 111.8 | T215 V219 R220 K221 | T215-H217 PolarHBondContact O-N 3.37Å; H217-V219 PolarHBondContact O-N 2.91Å; H217-R220 PolarHBondContact O-N 3.11Å; H217-K221 WeakPolarHBondContact O-CB 3.37Å; H217-K221 PolarHBondContact O-N 3.16Å |
| 218 | Q | 83.6 | Confident | 85.4 | Confident | 51 Ų | 51 | 85.6 Ų | 85.6 | 24% | 0.238 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -61.6 | -43.1 | 179.6 | -74.3 | 164.4 | -30.7 | 0 | 0 | 111.8 | T215 R220 K221 G222 V223 | T215-Q218 PolarHBondContact O-N 3.32Å; T215-Q218 VanDerWaalsContact O-N 3.08Å; T215-Q218 VanDerWaalsContact OG1-CD 3.26Å; T215-Q218 VanDerWaalsContact OG1-CG 3.25Å; T215-Q218 WeakPolarHBondContact OG1-CG 3.37Å; T215-Q218 PolarHBondContact OG1-N 2.93Å; T215-Q218 PolarHBondContact OG1-OE1 3.45Å; Q218-R220 PolarHBondContact O-N 3.42Å; Q218-K221 CarbonylContact O-C 3.58Å; Q218-K221 PolarHBondContact O-N 3Å; Q218-G222 PolarHBondContact O-N 3.35Å; Q218-V223 HydrophobicContact CB-CB 4.1Å; Q218-V223 HydrophobicContact CG-CB 4.18Å; Q218-V223 HydrophobicContact CG-CG1 4.35Å; Q218-V223 PolarHBondContact O-N 3.13Å |
| 219 | V | 86.3 | Confident | 85.3 | Confident | 68 Ų | 68 | 85.5 Ų | 85.5 | 41% | 0.412 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -60.2 | -47.4 | 175.8 | 175.8 | 0 | 0 | 0 | 0 | 111 | L209 Q214 T215 H217 K221 G222 | L209-V219 HydrophobicContact CD2-CG2 3.67Å; Q214-V219 HydrophobicContact CB-CG2 3.94Å; T215-V219 PolarHBondContact O-N 3Å; T215-V219 VanDerWaalsContact O-N 3.12Å; H217-V219 PolarHBondContact O-N 2.91Å; V219-K221 VanDerWaalsContact C-N 3.28Å; V219-K221 PolarHBondContact O-N 3.29Å; V219-G222 PolarHBondContact O-N 3.37Å |
| 220 | R | 85.4 | Confident | 85.1 | Confident | 175 Ų | 175 | 91 Ų | 91 | 66% | 0.66 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -63.6 | -32.2 | 179.4 | -78.8 | 176.8 | 168.5 | -178.1 | -10 | 113.8 | R216 H217 Q218 | R216-R220 WeakPolarHBondContact O-CB 3.44Å; R216-R220 WeakPolarHBondContact O-CG 3.37Å; R216-R220 PolarHBondContact O-N 2.91Å; H217-R220 PolarHBondContact O-N 3.11Å; Q218-R220 PolarHBondContact O-N 3.42Å |
| 221 | K | 83.9 | Confident | 85 | Confident | 152 Ų | 152 | 98 Ų | 98 | 66% | 0.661 | 49% | 0.494 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.5 | 1.6 | 179.7 | -72.1 | -67.2 | -171.2 | 176.8 | 0 | 113.2 | H217 Q218 V219 V223 | H217-K221 WeakPolarHBondContact O-CB 3.37Å; H217-K221 PolarHBondContact O-N 3.16Å; Q218-K221 CarbonylContact O-C 3.58Å; Q218-K221 PolarHBondContact O-N 3Å; V219-K221 VanDerWaalsContact C-N 3.28Å; V219-K221 PolarHBondContact O-N 3.29Å; K221-V223 HydrophobicContact CB-CG2 3.84Å; K221-V223 PolarHBondContact O-N 3.2Å |
| 222 | G | 83.7 | Confident | 84.8 | Confident | 66 Ų | 66 | 100.5 Ų | 100.5 | 68% | 0.68 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 62.9 | 26.3 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q218 V219 A224 | Q218-G222 PolarHBondContact O-N 3.35Å; V219-G222 PolarHBondContact O-N 3.37Å; G222-A224 PolarHBondContact O-N 3.48Å |
| 223 | V | 82.8 | Confident | 84.8 | Confident | 68 Ų | 68 | 93 Ų | 93 | 41% | 0.412 | 47% | 0.474 | S | S | . | . | trans | -74.7 | 115.9 | -178.7 | 178.5 | 0 | 0 | 0 | 0 | 109 | Q218 K221 V225 | Q218-V223 HydrophobicContact CB-CB 4.1Å; Q218-V223 HydrophobicContact CG-CB 4.18Å; Q218-V223 HydrophobicContact CG-CG1 4.35Å; Q218-V223 PolarHBondContact O-N 3.13Å; K221-V223 HydrophobicContact CB-CG2 3.84Å; K221-V223 PolarHBondContact O-N 3.2Å; V223-V225 PolarHBondContact O-N 3.4Å | ||
| 224 | A | 77.6 | Confident | 84.9 | Confident | 97 Ų | 97 | 93.6 Ų | 93.6 | 80% | 0.802 | 47% | 0.47 | S | S | * | . | trans | -65.9 | 130.8 | 173.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | G222 | G222-A224 PolarHBondContact O-N 3.48Š| ||
| 225 | V | 80.2 | Confident | 85 | Confident | 59 Ų | 59 | 95.8 Ų | 95.8 | 36% | 0.358 | 48% | 0.48 | S | S | . | . | trans | -114.2 | 138.2 | 175.7 | -176.2 | 0 | 0 | 0 | 0 | 108.3 | Q214 V223 A227 | Q214-V225 HydrophobicContact CG-CB 4.21Å; Q214-V225 HydrophobicContact CG-CG2 3.9Å; V223-V225 PolarHBondContact O-N 3.4Å; V225-A227 PolarHBondContact O-N 2.86Å | ||
| 226 | R | 81.1 | Confident | 85.2 | Confident | 226 Ų | 226 | 98.1 Ų | 98.1 | 85% | 0.853 | 49% | 0.488 | S | S | * | . | trans | -57.8 | 126.9 | 176.9 | -177 | 176.7 | -178.4 | 177.4 | 2.7 | 110.1 | R228 | R226-R228 PolarHBondContact O-N 3.24Š| ||
| 227 | A | 81.1 | Confident | 85.5 | Confident | 97 Ų | 97 | 95.5 Ų | 95.5 | 80% | 0.802 | 48% | 0.481 | S | S | * | . | trans | -60.4 | 130.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111 | V225 | V225-A227 PolarHBondContact O-N 2.86Š| ||
| 228 | R | 86.6 | Confident | 85.8 | Confident | 120 Ų | 120 | 92 Ų | 92 | 45% | 0.453 | 47% | 0.465 | S | S | . | . | trans | -130.3 | 153.4 | 173.8 | -67.5 | 176.8 | 75.7 | -156.7 | 5.3 | 108.7 | R226 W230 N233 E236 | R226-R228 PolarHBondContact O-N 3.24Å; R228-W230 PolarHBondContact O-N 2.9Å; R228-N233 WeakPolarHBondContact CB-OD1 3.22Å; R228-E236 IonicContact CZ-OE2 3.92Å; R228-E236 IonicContact NH1-OE2 2.75Å; R228-E236 PolarHBondContact NH1-OE2 3.17Å | ||
| 229 | P | 91.4 | Very high | 85.9 | Confident | 81 Ų | 81 | 90.2 Ų | 90.2 | 53% | 0.526 | 46% | 0.461 | S | S | . | . | trans | -56.4 | 132.7 | 173.2 | -23.1 | 32.9 | 0 | 0 | 0 | 110.8 | R231 K232 N233 | P229-R231 PolarHBondContact O-N 2.86Å; P229-K232 WeakPolarHBondContact O-CB 3.32Å; P229-K232 PolarHBondContact O-N 2.97Å; P229-N233 PolarHBondContact O-N 3.45Å | ||
| 230 | W | 89.1 | Confident | 85.7 | Confident | 124 Ų | 124 | 96.1 Ų | 96.1 | 47% | 0.47 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -52.7 | -33.3 | -177.3 | 64 | -96.3 | 0 | 0 | 0 | 113.3 | L211 R228 K232 N233 L234 | L211-W230 HydrophobicContact CD2-CB 4.01Å; L211-W230 HydrophobicContact CD2-CD2 4.48Å; L211-W230 HydrophobicContact CD2-CE3 3.92Å; R228-W230 PolarHBondContact O-N 2.9Å; W230-K232 VanDerWaalsContact C-N 3.32Å; W230-K232 PolarHBondContact O-N 2.98Å; W230-N233 PolarHBondContact O-N 3.26Å; W230-L234 HydrophobicContact CE3-CD1 3.58Å; W230-L234 HydrophobicContact CE3-CG 4.45Å; W230-L234 HydrophobicContact CZ3-CD1 3.57Å; W230-L234 PolarHBondContact O-N 2.83Å |
| 231 | R | 88.5 | Confident | 85.6 | Confident | 160 Ų | 160 | 96.8 Ų | 96.8 | 60% | 0.604 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -60.4 | -39.2 | 175.7 | -65.6 | -176.3 | -178 | -85.9 | 2.9 | 112.5 | P229 Q235 | P229-R231 PolarHBondContact O-N 2.86Å; R231-Q235 WeakPolarHBondContact O-CB 3.29Å; R231-Q235 VanDerWaalsContact O-CG 3.28Å; R231-Q235 WeakPolarHBondContact O-CG 3.33Å; R231-Q235 PolarHBondContact O-N 3.32Å |
| 232 | K | 88.6 | Confident | 85.4 | Confident | 113 Ų | 113 | 95.5 Ų | 95.5 | 49% | 0.491 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -68.6 | -37.5 | 177.6 | -69.8 | -164.7 | 177.1 | -176.8 | 0 | 111.1 | P229 W230 Q235 E236 | P229-K232 WeakPolarHBondContact O-CB 3.32Å; P229-K232 PolarHBondContact O-N 2.97Å; W230-K232 VanDerWaalsContact C-N 3.32Å; W230-K232 PolarHBondContact O-N 2.98Å; K232-Q235 PolarHBondContact O-N 2.94Å; K232-E236 WeakPolarHBondContact O-CB 3.37Å; K232-E236 PolarHBondContact O-N 2.89Å |
| 233 | N | 89.7 | Confident | 85.3 | Confident | 8 Ų | 8 | 97.3 Ų | 97.3 | 4% | 0.043 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -68.8 | -41.2 | 178.1 | -55.8 | -25.1 | 0 | 0 | 0 | 111.6 | I210 L211 G213 R228 P229 W230 E236 V237 | I210-N233 WeakPolarHBondContact O-CB 3.37Å; L211-N233 PolarHBondContact O-ND2 3.41Å; G213-N233 PolarHBondContact N-ND2 3.38Å; R228-N233 WeakPolarHBondContact CB-OD1 3.22Å; P229-N233 PolarHBondContact O-N 3.45Å; W230-N233 PolarHBondContact O-N 3.26Å; N233-E236 WeakPolarHBondContact O-CB 3.43Å; N233-E236 PolarHBondContact O-N 3.38Å; N233-V237 PolarHBondContact O-N 3.37Å |
| 234 | L | 88.9 | Confident | 85.3 | Confident | 42 Ų | 42 | 98.7 Ų | 98.7 | 22% | 0.22 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -62.5 | -46.2 | 172.2 | -80 | 176.8 | 0 | 0 | 0 | 112.1 | I210 L211 W230 E236 V237 F238 | I210-L234 HydrophobicContact CG2-CD2 3.92Å; L211-L234 HydrophobicContact CD2-CD1 3.81Å; L211-L234 HydrophobicContact CD2-CD2 4.2Å; L211-L234 HydrophobicContact CD2-CG 3.83Å; W230-L234 HydrophobicContact CE3-CD1 3.58Å; W230-L234 HydrophobicContact CE3-CG 4.45Å; W230-L234 HydrophobicContact CZ3-CD1 3.57Å; W230-L234 PolarHBondContact O-N 2.83Å; L234-E236 PolarHBondContact O-N 2.93Å; L234-V237 PolarHBondContact O-N 3.33Å; L234-V237 VanDerWaalsContact O-N 3.11Å; L234-F238 HydrophobicContact CD2-CD2 4.01Å; L234-F238 HydrophobicContact CD2-CE2 3.94Å; L234-F238 WeakPolarHBondContact O-CB 3.14Å; L234-F238 PolarHBondContact O-N 3.17Å |
| 235 | Q | 88.8 | Confident | 85.5 | Confident | 98 Ų | 98 | 94.1 Ų | 94.1 | 46% | 0.458 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -62.1 | -30.1 | 178.5 | -78 | 176.8 | -5.1 | 0 | 0 | 112.7 | R231 K232 V237 G239 | R231-Q235 WeakPolarHBondContact O-CB 3.29Å; R231-Q235 VanDerWaalsContact O-CG 3.28Å; R231-Q235 WeakPolarHBondContact O-CG 3.33Å; R231-Q235 PolarHBondContact O-N 3.32Å; K232-Q235 PolarHBondContact O-N 2.94Å; Q235-V237 VanDerWaalsContact C-N 3.31Å; Q235-V237 PolarHBondContact O-N 2.93Å; Q235-G239 CarbonylContact O-C 3.43Å; Q235-G239 WeakPolarHBondContact O-CA 3.34Å; Q235-G239 PolarHBondContact O-N 3.42Å |
| 236 | E | 87.4 | Confident | 85.7 | Confident | 82 Ų | 82 | 93.9 Ų | 93.9 | 38% | 0.383 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -64.8 | -35.2 | 175 | -173.7 | 172.2 | 164.6 | 0 | 0 | 112.2 | R106 R228 K232 N233 L234 | R106-E236 IonicContact CZ-OE1 3.73Å; R106-E236 VanDerWaalsContact CZ-OE1 3.32Å; R106-E236 IonicContact NH1-OE1 2.77Å; R106-E236 PolarHBondContact NH1-OE1 3.44Å; R106-E236 IonicContact NH2-OE1 3.02Å; R106-E236 PolarHBondContact NH2-OE1 3.41Å; R228-E236 IonicContact CZ-OE2 3.92Å; R228-E236 IonicContact NH1-OE2 2.75Å; R228-E236 PolarHBondContact NH1-OE2 3.17Å; K232-E236 WeakPolarHBondContact O-CB 3.37Å; K232-E236 PolarHBondContact O-N 2.89Å; N233-E236 WeakPolarHBondContact O-CB 3.43Å; N233-E236 PolarHBondContact O-N 3.38Å; L234-E236 PolarHBondContact O-N 2.93Å |
| 237 | V | 88.5 | Confident | 86.1 | Confident | 27 Ų | 27 | 87.9 Ų | 87.9 | 16% | 0.164 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -90.3 | -48 | 179.8 | 178.3 | 0 | 0 | 0 | 0 | 112 | M123 R124 I210 N233 L234 Q235 N252 | M123-V237 HydrophobicContact CB-CG1 4.1Å; M123-V237 HydrophobicContact CG-CG1 3.85Å; R124-V237 HydrophobicContact CB-CG1 4.27Å; I210-V237 HydrophobicContact CD1-CG1 4.05Å; I210-V237 HydrophobicContact CD1-CG2 4.39Å; I210-V237 HydrophobicContact CG1-CG2 4.14Å; I210-V237 HydrophobicContact CG2-CB 4.17Å; I210-V237 HydrophobicContact CG2-CG2 3.79Å; N233-V237 PolarHBondContact O-N 3.37Å; L234-V237 PolarHBondContact O-N 3.33Å; L234-V237 VanDerWaalsContact O-N 3.11Å; Q235-V237 VanDerWaalsContact C-N 3.31Å; Q235-V237 PolarHBondContact O-N 2.93Å; V237-N252 PolarHBondContact O-ND2 3.3Å |
| 238 | F | 89 | Confident | 86.5 | Confident | 18 Ų | 18 | 87.5 Ų | 87.5 | 8% | 0.079 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -92.9 | -7.8 | -172.7 | -69.4 | -97.5 | 0 | 0 | 0 | 114.1 | R124 V127 L128 L207 I210 L234 W242 | R124-F238 HydrophobicContact CG-CD1 3.7Å; R124-F238 HydrophobicContact CG-CE1 4.08Å; R124-F238 HydrophobicContact CG-CG 4.26Å; V127-F238 HydrophobicContact CB-CZ 4.08Å; V127-F238 HydrophobicContact CG1-CZ 3.84Å; L128-F238 HydrophobicContact CD2-CE1 4.13Å; L128-F238 HydrophobicContact CG-CE1 4.17Å; L207-F238 HydrophobicContact CD2-CE2 4.24Å; L207-F238 HydrophobicContact CD2-CZ 4.09Å; I210-F238 HydrophobicContact CD1-CE2 4.2Å; L234-F238 HydrophobicContact CD2-CD2 4.01Å; L234-F238 HydrophobicContact CD2-CE2 3.94Å; L234-F238 WeakPolarHBondContact O-CB 3.14Å; L234-F238 PolarHBondContact O-N 3.17Å; F238-W242 HydrophobicContact CB-CB 3.54Å |
| 239 | G | 86.3 | Confident | 86.7 | Confident | 14 Ų | 14 | 83.4 Ų | 83.4 | 14% | 0.144 | 39% | 0.392 | C | S | . | . | trans | 76.8 | 174.9 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | Q235 R241 | Q235-G239 CarbonylContact O-C 3.43Å; Q235-G239 WeakPolarHBondContact O-CA 3.34Å; Q235-G239 PolarHBondContact O-N 3.42Å; G239-R241 VanDerWaalsContact C-N 3.3Å; G239-R241 PolarHBondContact O-N 3.45Å | ||
| 240 | K | 82.1 | Confident | 86.5 | Confident | 191 Ų | 191 | 82.6 Ų | 82.6 | 83% | 0.83 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.7 | -33.2 | 177.9 | -67.4 | -176.5 | -178.8 | 178.7 | 0 | 112.6 | W242 | K240-W242 PolarHBondContact O-N 2.92Š|
| 241 | R | 81.7 | Confident | 86.1 | Confident | 189 Ų | 189 | 81.6 Ų | 81.6 | 71% | 0.713 | 38% | 0.381 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.2 | 44.4 | -179 | -64.3 | -175.9 | -174.7 | -176.9 | 2.1 | 111.7 | G239 L243 L244 | G239-R241 VanDerWaalsContact C-N 3.3Å; G239-R241 PolarHBondContact O-N 3.45Å; R241-L243 VanDerWaalsContact C-N 3.3Å; R241-L243 PolarHBondContact O-N 3.13Å; R241-L244 HydrophobicContact CB-CD1 4.03Å; R241-L244 HydrophobicContact CG-CD1 4.35Å; R241-L244 PolarHBondContact O-N 3.27Å |
| 242 | W | 79.5 | Confident | 85.2 | Confident | 125 Ų | 125 | 75.4 Ų | 75.4 | 47% | 0.473 | 36% | 0.36 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.5 | -36.3 | -172.8 | 64 | -84 | 0 | 0 | 0 | 113.4 | R124 F238 K240 L244 G245 L246 | R124-W242 PolarHBondContact NH2-O 3.47Å; F238-W242 HydrophobicContact CB-CB 3.54Å; K240-W242 PolarHBondContact O-N 2.92Å; W242-L244 VanDerWaalsContact C-N 3.34Å; W242-L244 PolarHBondContact O-N 3.16Å; W242-G245 PolarHBondContact O-N 3.33Å; W242-L246 PolarHBondContact O-N 2.78Å; W242-L246 VanDerWaalsContact O-N 3.14Å |
| 243 | L | 81.9 | Confident | 83.6 | Confident | 105 Ų | 105 | 76.6 Ų | 76.6 | 55% | 0.55 | 38% | 0.376 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.1 | -41 | 176.9 | -74.5 | 166 | 0 | 0 | 0 | 113.1 | R241 G245 L246 L247 | R241-L243 VanDerWaalsContact C-N 3.3Å; R241-L243 PolarHBondContact O-N 3.13Å; L243-G245 VanDerWaalsContact C-N 3.32Å; L243-G245 PolarHBondContact O-N 3.02Å; L243-L246 VanDerWaalsContact O-CB 3.27Å; L243-L246 WeakPolarHBondContact O-CB 3.37Å; L243-L246 PolarHBondContact O-N 3.24Å; L243-L247 PolarHBondContact O-N 2.97Å |
| 244 | L | 83.5 | Confident | 81.8 | Confident | 96 Ų | 96 | 78 Ų | 78 | 50% | 0.503 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -62.1 | -40.8 | -179.4 | -88.4 | 154.6 | 0 | 0 | 0 | 111.9 | R241 W242 L246 L247 V248 M250 | R241-L244 HydrophobicContact CB-CD1 4.03Å; R241-L244 HydrophobicContact CG-CD1 4.35Å; R241-L244 PolarHBondContact O-N 3.27Å; W242-L244 VanDerWaalsContact C-N 3.34Å; W242-L244 PolarHBondContact O-N 3.16Å; L244-L246 VanDerWaalsContact C-N 3.29Å; L244-L246 PolarHBondContact O-N 3.19Å; L244-L247 PolarHBondContact O-N 3.45Å; L244-V248 PolarHBondContact O-N 3.43Å; L244-V248 VanDerWaalsContact O-N 3.08Å; L244-M250 HydrophobicContact CB-SD 4.11Å |
| 245 | G | 80.9 | Confident | 79.8 | Confident | 1 Ų | 1 | 78.4 Ų | 78.4 | 1% | 0.01 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -86.5 | 2.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | L128 W242 L243 V248 | L128-G245 WeakPolarHBondContact CD1-O 3.5Å; W242-G245 PolarHBondContact O-N 3.33Å; L243-G245 VanDerWaalsContact C-N 3.32Å; L243-G245 PolarHBondContact O-N 3.02Å; G245-V248 VanDerWaalsContact CA-O 3.28Å; G245-V248 WeakPolarHBondContact CA-O 3.39Å |
| 246 | L | 86.1 | Confident | 77.4 | Confident | 55 Ų | 55 | 81.9 Ų | 81.9 | 29% | 0.288 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -71.2 | -44.1 | 157.4 | -168 | 68.7 | 0 | 0 | 0 | 108.3 | N60 L128 L131 Y132 W242 L243 L244 | N60-L246 PolarHBondContact OD1-O 2.98Å; L128-L246 HydrophobicContact CD2-CD1 3.85Å; L131-L246 HydrophobicContact CD2-CD1 4.02Å; Y132-L246 HydrophobicContact CE2-CD1 4.36Å; Y132-L246 WeakPolarHBondContact CE2-O 3.35Å; Y132-L246 VanDerWaalsContact CZ-O 3.24Å; Y132-L246 PolarHBondContact OH-O 3.14Å; W242-L246 PolarHBondContact O-N 2.78Å; W242-L246 VanDerWaalsContact O-N 3.14Å; L243-L246 VanDerWaalsContact O-CB 3.27Å; L243-L246 WeakPolarHBondContact O-CB 3.37Å; L243-L246 PolarHBondContact O-N 3.24Å; L244-L246 VanDerWaalsContact C-N 3.29Å; L244-L246 PolarHBondContact O-N 3.19Å |
| 247 | L | 88.2 | Confident | 74.9 | Confident | 100 Ų | 100 | 82 Ų | 82 | 52% | 0.524 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -75.5 | -37.2 | -175.4 | -60.3 | 177 | 0 | 0 | 0 | 114.1 | F56 N60 L243 L244 | F56-L247 VanDerWaalsContact CE2-O 3.31Å; F56-L247 WeakPolarHBondContact CE2-O 3.34Å; F56-L247 HydrophobicContact CZ-CD2 4.47Å; N60-L247 PolarHBondContact ND2-O 3.35Å; N60-L247 PolarHBondContact OD1-O 3.02Å; L243-L247 PolarHBondContact O-N 2.97Å; L244-L247 PolarHBondContact O-N 3.45Å |
| 248 | V | 90.3 | Very high | 72.4 | Confident | 88 Ų | 88 | 84.3 Ų | 84.3 | 53% | 0.533 | 44% | 0.443 | S | S | . | . | S | Bend | trans | -135.1 | 133 | -173.7 | -175.8 | 0 | 0 | 0 | 0 | 110.7 | L244 G245 M250 | L244-V248 PolarHBondContact O-N 3.43Å; L244-V248 VanDerWaalsContact O-N 3.08Å; G245-V248 VanDerWaalsContact CA-O 3.28Å; G245-V248 WeakPolarHBondContact CA-O 3.39Å; V248-M250 PolarHBondContact O-N 2.73Å; V248-M250 VanDerWaalsContact O-N 3.15Å |
| 249 | P | 90 | Very high | 69.9 | Low | 34 Ų | 34 | 92.1 Ų | 92.1 | 22% | 0.221 | 48% | 0.476 | C | S | . | . | trans | -59.7 | 119.9 | 172.6 | -22.3 | 35 | 0 | 0 | 0 | 110.2 | N60 L67 | N60-P249 WeakPolarHBondContact OD1-CD 3.35Å; L67-P249 VanDerWaalsContact CD1-C 3.43Å; L67-P249 HydrophobicContact CD1-CB 3.61Å | ||
| 250 | M | 87.5 | Confident | 67.2 | Low | 64 Ų | 64 | 99.2 Ų | 99.2 | 32% | 0.315 | 51% | 0.506 | S | S | . | . | trans | -145.3 | 151 | -178 | 64.3 | 179.7 | -56.2 | 0 | 0 | 111.8 | L67 L244 V248 | L67-M250 VanDerWaalsContact CD1-N 3.28Å; L244-M250 HydrophobicContact CB-SD 4.11Å; V248-M250 PolarHBondContact O-N 2.73Å; V248-M250 VanDerWaalsContact O-N 3.15Å | ||
| 251 | F | 81.4 | Confident | 64.8 | Low | 104 Ų | 104 | 98.2 Ų | 98.2 | 46% | 0.456 | 50% | 0.504 | S | S | . | . | trans | -58.8 | 145 | 173.3 | -72.4 | -86.2 | 0 | 0 | 0 | 111.5 | L67 Q70 N71 V253 | L67-F251 HydrophobicContact CD2-CD1 4.24Å; L67-F251 HydrophobicContact CD2-CD2 3.96Å; L67-F251 HydrophobicContact CD2-CE1 3.84Å; L67-F251 HydrophobicContact CD2-CE2 3.54Å; L67-F251 HydrophobicContact CD2-CG 4.28Å; L67-F251 HydrophobicContact CD2-CZ 3.46Å; L67-F251 VanDerWaalsContact CD2-CZ 3.46Å; Q70-F251 HydrophobicContact CB-CE1 4.49Å; Q70-F251 HydrophobicContact CB-CZ 4.48Å; N71-F251 WeakPolarHBondContact ND2-CD1 3.27Å; N71-F251 WeakPolarHBondContact ND2-CE1 3.47Å; N71-F251 WeakPolarHBondContact OD1-CD1 3.45Å; N71-F251 WeakPolarHBondContact OD1-CE1 3.39Å; F251-V253 PolarHBondContact O-N 2.95Å | ||
| 252 | N | 68.9 | Low | 62.4 | Low | 29 Ų | 29 | 96.7 Ų | 96.7 | 16% | 0.155 | 51% | 0.51 | C | S | . | . | trans | -80.3 | 103.2 | 175.3 | -161.5 | 6.8 | 0 | 0 | 0 | 109.4 | V237 G254 | V237-N252 PolarHBondContact O-ND2 3.3Å; N252-G254 PolarHBondContact O-N 3.3Å | ||
| 253 | V | 55.5 | Low | 60.1 | Low | 138 Ų | 138 | 103 Ų | 103 | 84% | 0.836 | 54% | 0.541 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.6 | 24.5 | -178.2 | -168.5 | 0 | 0 | 0 | 0 | 112.1 | F251 | F251-V253 PolarHBondContact O-N 2.95Š|
| 254 | G | 52 | Low | 59 | Low | 37 Ų | 37 | 103 Ų | 103 | 38% | 0.381 | 54% | 0.541 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -113.3 | -11.8 | -166.3 | 0 | 0 | 0 | 0 | 0 | 117.2 | N252 | N252-G254 PolarHBondContact O-N 3.3Š|
| 255 | S | 45.8 | Very low | 57.7 | Low | 52 Ų | 52 | 103.3 Ų | 103.3 | 36% | 0.364 | 54% | 0.543 | S | S | . | . | S | Bend | trans | -92.2 | -4.1 | -169.9 | 62.5 | 0 | 0 | 0 | 0 | 115.4 | S258 | S255-S258 PolarHBondContact O-OG 3.27Š|
| 256 | E | 39.7 | Very low | 56.4 | Low | 171 Ų | 171 | 109 Ų | 109 | 80% | 0.799 | 57% | 0.572 | S | S | * | * | S | Bend | trans | -78.8 | -24.6 | 176.9 | -64 | -152.4 | 148.3 | 0 | 0 | 112.8 | S258 K259 | E256-S258 VanDerWaalsContact C-N 3.28Å; E256-S258 PolarHBondContact O-N 2.99Å; E256-K259 PolarHBondContact O-N 2.85Å |
| 257 | S | 34.5 | Very low | 54.7 | Low | 84 Ų | 84 | 112.2 Ų | 112.2 | 59% | 0.587 | 59% | 0.589 | S | S | * | * | G | 310 helix | trans | -74.8 | -13.1 | -176.4 | 69.1 | 0 | 0 | 0 | 0 | 114.5 | K259 | S257-K259 VanDerWaalsContact C-N 3.34Š|
| 258 | S | 36 | Very low | 52.6 | Low | 76 Ų | 76 | 112.9 Ų | 112.9 | 53% | 0.531 | 59% | 0.593 | S | S | . | * | G | 310 helix | trans | -82.7 | -9.8 | 175.3 | 54.1 | 0 | 0 | 0 | 0 | 113.4 | S255 E256 Q260 | S255-S258 PolarHBondContact O-OG 3.27Å; E256-S258 VanDerWaalsContact C-N 3.28Å; E256-S258 PolarHBondContact O-N 2.99Å; S258-Q260 PolarHBondContact O-N 3.34Å |
| 259 | K | 35.5 | Very low | 50.1 | Low | 181 Ų | 181 | 114.6 Ų | 114.6 | 79% | 0.787 | 60% | 0.597 | S | S | * | * | G | 310 helix | trans | -74.6 | -7.8 | 170.9 | -80.2 | -173.4 | 176.5 | 178 | 0 | 113.2 | E256 S257 | E256-K259 PolarHBondContact O-N 2.85Å; S257-K259 VanDerWaalsContact C-N 3.34Å |
| 260 | Q | 31.1 | Very low | 47.2 | Very low | 164 Ų | 164 | 120.4 Ų | 120.4 | 77% | 0.766 | 62% | 0.624 | S | S | * | * | G | 310 helix | trans | -112.8 | 2.6 | -173.4 | -115.8 | 156.4 | -19.5 | 0 | 0 | 114.6 | S258 | S258-Q260 PolarHBondContact O-N 3.34Š|
| 261 | Q | 29.8 | Very low | 44.1 | Very low | 170 Ų | 170 | 124.7 Ų | 124.7 | 79% | 0.794 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -106.7 | -3.4 | 176.6 | -86.7 | -176.8 | -25.3 | 0 | 0 | 114.8 | ||
| 262 | D | 32.1 | Very low | 41 | Very low | 156 Ų | 156 | 126.4 Ų | 126.4 | 83% | 0.834 | 66% | 0.664 | S | S | * | * | trans | -111.5 | 29.8 | 174 | -71.6 | -25.9 | 0 | 0 | 0 | 112.1 | ||||
| 263 | K | 31.3 | Very low | 38.5 | Very low | 259 Ų | 259 | 135.3 Ų | 135.3 | 100% | 1.126 | 71% | 0.71 | S | S | * | * | trans | -117 | 0 | 165.8 | -85.3 | -167.1 | 177.2 | -173 | 0 | 110.3 |
Retrieved 263 of 263 residues in 73 ms
(Link to these results)