| 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 | P | 51 | Low | 49.4 | Very low | 145 Ų | 145 | 126.5 Ų | 126.5 | 94% | 0.942 | 65% | 0.649 | S | S | * | * | 0 | -54.3 | 0 | -12.9 | 30.5 | 0 | 0 | 0 | 114 | H4 | P1-H4 VanDerWaalsContact CA-CD2 3.46Å; P1-H4 WeakPolarHBondContact CA-CD2 3.36Å | |||
| 2 | I | 54.3 | Low | 49.2 | Very low | 161 Ų | 161 | 128.3 Ų | 128.3 | 83% | 0.826 | 66% | 0.656 | S | S | * | * | trans | -85.1 | -23.9 | -177.8 | -69.7 | 162 | 0 | 0 | 0 | 113.2 | ||||
| 3 | L | 46.7 | Very low | 49.2 | Very low | 142 Ų | 142 | 129.6 Ų | 129.6 | 74% | 0.743 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -95.1 | 6.1 | 176.7 | -73.5 | 168.1 | 0 | 0 | 0 | 114.3 | M5 | L3-M5 PolarHBondContact O-N 3.33Š|
| 4 | H | 43.8 | Very low | 50.1 | Low | 145 Ų | 145 | 121.1 Ų | 121.1 | 67% | 0.671 | 61% | 0.611 | S | S | * | * | trans | -79.7 | 90 | 175.5 | -70.7 | -69 | 0 | 0 | 0 | 110.3 | P1 S6 | P1-H4 VanDerWaalsContact CA-CD2 3.46Å; P1-H4 WeakPolarHBondContact CA-CD2 3.36Å; H4-S6 VanDerWaalsContact C-N 3.32Å | ||
| 5 | M | 57.7 | Low | 51.1 | Low | 154 Ų | 154 | 119.6 Ų | 119.6 | 76% | 0.759 | 61% | 0.612 | S | S | * | * | trans | -91.7 | 10.2 | 171 | -70.6 | -77.3 | 162.5 | 0 | 0 | 112.7 | L3 | L3-M5 PolarHBondContact O-N 3.33Š| ||
| 6 | S | 45.6 | Very low | 52.3 | Low | 40 Ų | 40 | 116.4 Ų | 116.4 | 28% | 0.28 | 60% | 0.597 | S | S | . | * | trans | -101.3 | 127.1 | -177.3 | 176.7 | 0 | 0 | 0 | 0 | 111.9 | H4 Q8 R14 | H4-S6 VanDerWaalsContact C-N 3.32Å; S6-Q8 VanDerWaalsContact C-N 3.26Å; S6-Q8 PolarHBondContact O-N 2.92Å; S6-Q8 PolarHBondContact OG-N 3.26Å; S6-Q8 PolarHBondContact OG-O 3.47Å; S6-Q8 VanDerWaalsContact OG-O 3.06Å; S6-R14 PolarHBondContact OG-NH1 3.48Å | ||
| 7 | K | 53.1 | Low | 53.4 | Low | 197 Ų | 197 | 110.4 Ų | 110.4 | 86% | 0.857 | 57% | 0.567 | S | S | * | * | S | Bend | trans | -73.3 | -7 | 173.3 | -93.5 | -170.1 | 178 | -179.6 | 0 | 114.5 | W75 | K7-W75 HydrophobicContact CB-CZ3 4.34Š|
| 8 | Q | 42.5 | Very low | 54.5 | Low | 60 Ų | 60 | 108.7 Ų | 108.7 | 28% | 0.28 | 56% | 0.556 | S | S | . | * | trans | -111.5 | 127.2 | 173.2 | -82.3 | 176.7 | -54.1 | 0 | 0 | 110.6 | S6 S10 W75 | S6-Q8 VanDerWaalsContact C-N 3.26Å; S6-Q8 PolarHBondContact O-N 2.92Å; S6-Q8 PolarHBondContact OG-N 3.26Å; S6-Q8 PolarHBondContact OG-O 3.47Å; S6-Q8 VanDerWaalsContact OG-O 3.06Å; Q8-S10 VanDerWaalsContact C-N 3.29Å; Q8-W75 HydrophobicContact CG-CH2 4.15Å; Q8-W75 HydrophobicContact CG-CZ3 3.94Å | ||
| 9 | Q | 50.8 | Low | 55.9 | Low | 211 Ų | 211 | 106.3 Ų | 106.3 | 99% | 0.986 | 55% | 0.551 | S | S | * | * | S | Bend | trans | -78 | -12.5 | 178.8 | -169.7 | 167.8 | -23.9 | 0 | 0 | 113 | ||
| 10 | S | 45.4 | Very low | 57.2 | Low | 60 Ų | 60 | 101.9 Ų | 101.9 | 42% | 0.42 | 53% | 0.527 | S | S | . | . | trans | -112.4 | 123.4 | -176.2 | -175.7 | 0 | 0 | 0 | 0 | 111.6 | Q8 M12 | Q8-S10 VanDerWaalsContact C-N 3.29Å; S10-M12 PolarHBondContact O-N 2.88Å; S10-M12 VanDerWaalsContact O-N 3.17Å; S10-M12 WeakPolarHBondContact OG-CB 3.42Å; S10-M12 PolarHBondContact OG-N 3.23Å | ||
| 11 | M | 52.5 | Low | 58.4 | Low | 76 Ų | 76 | 103.3 Ų | 103.3 | 37% | 0.374 | 53% | 0.527 | S | S | . | . | G | 310 helix | trans | -66.6 | -0.8 | 168.8 | -101.8 | 172 | 176.6 | 0 | 0 | 113.1 | F13 Q18 Y21 M62 | M11-F13 VanDerWaalsContact C-N 3.34Å; M11-F13 PolarHBondContact O-N 2.96Å; M11-Q18 WeakPolarHBondContact O-CG 3.27Å; M11-Q18 PolarHBondContact O-NE2 2.61Å; M11-Y21 HydrophobicContact CE-CD2 4.35Å; M11-Y21 HydrophobicContact SD-CG 4.48Å; M11-M62 HydrophobicContact CE-CE 4.01Å |
| 12 | M | 46.7 | Very low | 59.9 | Low | 148 Ų | 148 | 104.8 Ų | 104.8 | 73% | 0.729 | 51% | 0.514 | S | S | * | . | G | 310 helix | trans | -71.8 | -21.6 | -171.5 | -161.4 | 172.6 | -176.4 | 0 | 0 | 114.2 | S10 | S10-M12 PolarHBondContact O-N 2.88Å; S10-M12 VanDerWaalsContact O-N 3.17Å; S10-M12 WeakPolarHBondContact OG-CB 3.42Å; S10-M12 PolarHBondContact OG-N 3.23Å |
| 13 | F | 49.9 | Very low | 61.4 | Low | 146 Ų | 146 | 101.1 Ų | 101.1 | 64% | 0.64 | 50% | 0.495 | S | S | * | . | G | 310 helix | trans | -106.5 | 17.3 | -177.7 | -70.8 | -76.5 | 0 | 0 | 0 | 114.4 | M11 | M11-F13 VanDerWaalsContact C-N 3.34Å; M11-F13 PolarHBondContact O-N 2.96Å |
| 14 | R | 61.8 | Low | 63.4 | Low | 11 Ų | 11 | 95.8 Ų | 95.8 | 4% | 0.042 | 47% | 0.468 | C | S | . | . | trans | -134.4 | 82.2 | -170.1 | -66.3 | -174 | 83.7 | 159.5 | 29 | 111.5 | S6 L16 S17 Q18 S66 E69 N70 | S6-R14 PolarHBondContact OG-NH1 3.48Å; R14-L16 PolarHBondContact O-N 3.09Å; R14-S17 PolarHBondContact NE-OG 3.33Å; R14-S17 PolarHBondContact O-N 3.29Å; R14-Q18 PolarHBondContact O-N 2.92Å; R14-S66 PolarHBondContact NH2-O 3.01Å; R14-E69 WeakPolarHBondContact CA-OE1 3.36Å; R14-E69 VanDerWaalsContact CB-OE1 3.28Å; R14-E69 WeakPolarHBondContact CB-OE1 3.3Å; R14-E69 WeakPolarHBondContact CB-OE2 3.3Å; R14-E69 IonicContact CZ-OE2 3.31Å; R14-E69 VanDerWaalsContact CZ-OE2 3.31Å; R14-E69 IonicContact NE-OE2 2.66Å; R14-E69 PolarHBondContact NE-OE2 3.46Å; R14-E69 IonicContact NH2-OE2 3.45Å; R14-E69 PolarHBondContact NH2-OE2 2.9Å; R14-N70 PolarHBondContact NH2-OD1 3.09Å | ||
| 15 | P | 64.9 | Low | 65.6 | Low | 98 Ų | 98 | 90.2 Ų | 90.2 | 64% | 0.636 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -62 | -27.4 | -175.2 | 24.1 | -32.8 | 0 | 0 | 0 | 113.1 | S19 | P15-S19 PolarHBondContact O-N 3.45Å |
| 16 | L | 69.5 | Low | 67.2 | Low | 69 Ų | 69 | 86.5 Ų | 86.5 | 36% | 0.361 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -79.2 | -36 | 176.9 | -58.4 | 169 | 0 | 0 | 0 | 111.5 | R14 Q18 S19 L20 I65 E69 M72 | R14-L16 PolarHBondContact O-N 3.09Å; L16-Q18 VanDerWaalsContact C-N 3.32Å; L16-S19 PolarHBondContact O-N 2.66Å; L16-S19 PolarHBondContact O-OG 3.25Å; L16-L20 PolarHBondContact O-N 3.2Å; L16-I65 HydrophobicContact CB-CD1 4.42Å; L16-I65 HydrophobicContact CB-CG2 3.6Å; L16-E69 WeakPolarHBondContact CA-OE1 3.44Å; L16-E69 HydrophobicContact CB-CG 4.07Å; L16-E69 VanDerWaalsContact CB-OE1 3.27Å; L16-E69 WeakPolarHBondContact CB-OE1 3.36Å; L16-E69 HydrophobicContact CD1-CG 3.88Å; L16-E69 HydrophobicContact CG-CG 4.37Å; L16-E69 PolarHBondContact N-OE1 2.91Å; L16-M72 HydrophobicContact CD1-SD 4.49Å |
| 17 | S | 71.1 | Confident | 69.3 | Low | 14 Ų | 14 | 85.1 Ų | 85.1 | 10% | 0.098 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -67.2 | -33.5 | 172.3 | -69.3 | 0 | 0 | 0 | 0 | 112.4 | R14 Y21 E69 | R14-S17 PolarHBondContact NE-OG 3.33Å; R14-S17 PolarHBondContact O-N 3.29Å; S17-Y21 PolarHBondContact O-N 2.96Å; S17-Y21 VanDerWaalsContact O-N 3.13Å; S17-E69 PolarHBondContact N-OE1 3.45Å; S17-E69 PolarHBondContact OG-OE2 2.74Å |
| 18 | Q | 74.4 | Confident | 71 | Confident | 79 Ų | 79 | 79 Ų | 79 | 37% | 0.369 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -67.4 | -42.4 | 174.5 | -74.5 | -178.7 | 10.6 | 0 | 0 | 112.4 | M11 R14 L16 L20 Y21 W22 | M11-Q18 WeakPolarHBondContact O-CG 3.27Å; M11-Q18 PolarHBondContact O-NE2 2.61Å; R14-Q18 PolarHBondContact O-N 2.92Å; L16-Q18 VanDerWaalsContact C-N 3.32Å; Q18-L20 VanDerWaalsContact C-N 3.34Å; Q18-L20 PolarHBondContact O-N 3.41Å; Q18-Y21 WeakPolarHBondContact O-CB 3.44Å; Q18-Y21 PolarHBondContact O-N 3.19Å; Q18-W22 VanDerWaalsContact O-CD1 3.28Å; Q18-W22 PolarHBondContact O-N 3.24Å; Q18-W22 VanDerWaalsContact O-N 3.09Å |
| 19 | S | 80.7 | Confident | 73.4 | Confident | 64 Ų | 64 | 82 Ų | 82 | 45% | 0.448 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -64.9 | -38.4 | 178.1 | 66.2 | 0 | 0 | 0 | 0 | 112 | P15 L16 Y21 W22 L23 | P15-S19 PolarHBondContact O-N 3.45Å; L16-S19 PolarHBondContact O-N 2.66Å; L16-S19 PolarHBondContact O-OG 3.25Å; S19-Y21 VanDerWaalsContact C-N 3.34Å; S19-Y21 PolarHBondContact O-N 3.33Å; S19-W22 PolarHBondContact O-N 3.25Å; S19-L23 WeakPolarHBondContact O-CB 3.43Å; S19-L23 PolarHBondContact O-N 3.21Å |
| 20 | L | 81.6 | Confident | 75.2 | Confident | 17 Ų | 17 | 75.1 Ų | 75.1 | 9% | 0.089 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -62 | -39.8 | 172.1 | -79.3 | 180 | 0 | 0 | 0 | 113.2 | L16 Q18 W22 L23 L24 L61 I65 | L16-L20 PolarHBondContact O-N 3.2Å; Q18-L20 VanDerWaalsContact C-N 3.34Å; Q18-L20 PolarHBondContact O-N 3.41Å; L20-W22 VanDerWaalsContact C-N 3.33Å; L20-L23 PolarHBondContact O-N 2.73Å; L20-L24 WeakPolarHBondContact O-CB 3.28Å; L20-L24 PolarHBondContact O-N 3.36Å; L20-L61 HydrophobicContact CD1-CB 4.25Å; L20-L61 HydrophobicContact CD2-CB 3.87Å; L20-L61 HydrophobicContact CD2-CD2 3.66Å; L20-L61 HydrophobicContact CD2-CG 4.23Å; L20-I65 HydrophobicContact CD1-CB 3.54Å; L20-I65 HydrophobicContact CD1-CD1 3.43Å; L20-I65 VanDerWaalsContact CD1-CD1 3.43Å; L20-I65 HydrophobicContact CD1-CG1 3.55Å; L20-I65 HydrophobicContact CD1-CG2 3.91Å; L20-I65 HydrophobicContact CD2-CD1 4.04Å; L20-I65 HydrophobicContact CG-CD1 3.68Å; L20-I65 HydrophobicContact CG-CG1 4.36Å |
| 21 | Y | 81.4 | Confident | 77.3 | Confident | 132 Ų | 132 | 74.3 Ų | 74.3 | 52% | 0.518 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -61.9 | -44.6 | 177 | 177.3 | -98.2 | 0 | 0 | 0 | 111.2 | M11 S17 Q18 S19 L24 A25 | M11-Y21 HydrophobicContact CE-CD2 4.35Å; M11-Y21 HydrophobicContact SD-CG 4.48Å; S17-Y21 PolarHBondContact O-N 2.96Å; S17-Y21 VanDerWaalsContact O-N 3.13Å; Q18-Y21 WeakPolarHBondContact O-CB 3.44Å; Q18-Y21 PolarHBondContact O-N 3.19Å; S19-Y21 VanDerWaalsContact C-N 3.34Å; S19-Y21 PolarHBondContact O-N 3.33Å; Y21-L24 PolarHBondContact O-N 2.9Å; Y21-A25 PolarHBondContact O-N 2.73Å |
| 22 | W | 83.4 | Confident | 79.1 | Confident | 177 Ų | 177 | 75.8 Ų | 75.8 | 67% | 0.67 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -65 | -38 | 174.9 | -80.5 | 106.8 | 0 | 0 | 0 | 112.7 | Q18 S19 L20 L24 A25 V26 | Q18-W22 VanDerWaalsContact O-CD1 3.28Å; Q18-W22 PolarHBondContact O-N 3.24Å; Q18-W22 VanDerWaalsContact O-N 3.09Å; S19-W22 PolarHBondContact O-N 3.25Å; L20-W22 VanDerWaalsContact C-N 3.33Å; W22-L24 VanDerWaalsContact C-N 3.34Å; W22-L24 PolarHBondContact O-N 3Å; W22-A25 PolarHBondContact O-N 3.35Å; W22-V26 WeakPolarHBondContact O-CG2 3.44Å; W22-V26 PolarHBondContact O-N 3.48Å |
| 23 | L | 85.9 | Confident | 81.1 | Confident | 83 Ų | 83 | 77.7 Ų | 77.7 | 44% | 0.435 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -60.5 | -44.8 | 174.3 | -170.5 | 153.4 | 0 | 0 | 0 | 111.1 | S19 L20 V26 D27 T57 | S19-L23 WeakPolarHBondContact O-CB 3.43Å; S19-L23 PolarHBondContact O-N 3.21Å; L20-L23 PolarHBondContact O-N 2.73Å; L23-V26 PolarHBondContact O-N 3.14Å; L23-D27 WeakPolarHBondContact O-CB 3.21Å; L23-D27 PolarHBondContact O-N 2.68Å; L23-T57 HydrophobicContact CD2-CG2 4.21Å |
| 24 | L | 88.4 | Confident | 83.1 | Confident | 30 Ų | 30 | 72.1 Ų | 72.1 | 16% | 0.157 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -66.1 | -37.4 | 176 | -175.2 | 133.9 | 0 | 0 | 0 | 112.6 | L20 Y21 W22 D27 L28 Y54 T57 I58 | L20-L24 WeakPolarHBondContact O-CB 3.28Å; L20-L24 PolarHBondContact O-N 3.36Å; Y21-L24 PolarHBondContact O-N 2.9Å; W22-L24 VanDerWaalsContact C-N 3.34Å; W22-L24 PolarHBondContact O-N 3Å; L24-D27 PolarHBondContact O-N 3.25Å; L24-L28 HydrophobicContact CD2-CD1 3.84Å; L24-L28 HydrophobicContact CD2-CG 4.49Å; L24-L28 WeakPolarHBondContact O-CG 3.28Å; L24-L28 PolarHBondContact O-N 3.25Å; L24-Y54 HydrophobicContact CD1-CE2 4.31Å; L24-Y54 HydrophobicContact CG-CE2 4.38Å; L24-T57 HydrophobicContact CB-CG2 4.31Å; L24-T57 HydrophobicContact CD1-CG2 4.14Å; L24-I58 HydrophobicContact CD1-CD1 3.83Å; L24-I58 HydrophobicContact CD1-CG1 3.35Å |
| 25 | A | 89.3 | Confident | 84.2 | Confident | 28 Ų | 28 | 74.9 Ų | 74.9 | 23% | 0.231 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -62.8 | -42.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | Y21 W22 L28 L29 | Y21-A25 PolarHBondContact O-N 2.73Å; W22-A25 PolarHBondContact O-N 3.35Å; A25-L28 PolarHBondContact O-N 3.14Å; A25-L29 WeakPolarHBondContact O-CG 3.38Å; A25-L29 PolarHBondContact O-N 3.48Å; A25-L29 VanDerWaalsContact O-N 3.11Å |
| 26 | V | 91.7 | Very high | 85.3 | Confident | 77 Ų | 77 | 73.2 Ų | 73.2 | 47% | 0.467 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -65.1 | -42.6 | 175.2 | 171.9 | 0 | 0 | 0 | 0 | 111.2 | W22 L23 L28 L29 I30 | W22-V26 WeakPolarHBondContact O-CG2 3.44Å; W22-V26 PolarHBondContact O-N 3.48Å; L23-V26 PolarHBondContact O-N 3.14Å; V26-L28 PolarHBondContact O-N 2.97Å; V26-L29 WeakPolarHBondContact O-CB 3.19Å; V26-L29 PolarHBondContact O-N 3.19Å; V26-L29 VanDerWaalsContact O-N 3.16Å; V26-I30 HydrophobicContact CG1-CD1 3.88Å; V26-I30 HydrophobicContact CG1-CG1 4.46Å; V26-I30 WeakPolarHBondContact O-CG1 3.29Å; V26-I30 PolarHBondContact O-N 2.9Å |
| 27 | D | 90 | Very high | 86.1 | Confident | 10 Ų | 10 | 73.3 Ų | 73.3 | 5% | 0.053 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -61.8 | -41.1 | 178.2 | -171.5 | 73.2 | 0 | 0 | 0 | 112.2 | L23 L24 L29 I30 L31 Y54 | L23-D27 WeakPolarHBondContact O-CB 3.21Å; L23-D27 PolarHBondContact O-N 2.68Å; L24-D27 PolarHBondContact O-N 3.25Å; D27-L29 PolarHBondContact O-N 2.95Å; D27-I30 PolarHBondContact O-N 3.48Å; D27-L31 PolarHBondContact O-N 3.22Å; D27-Y54 VanDerWaalsContact OD2-CA 3.31Å; D27-Y54 WeakPolarHBondContact OD2-CA 3.43Å; D27-Y54 WeakPolarHBondContact OD2-CB 3.47Å; D27-Y54 PolarHBondContact OD2-N 3.4Å |
| 28 | L | 89.9 | Confident | 86.7 | Confident | 70 Ų | 70 | 76.7 Ų | 76.7 | 37% | 0.366 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -63.4 | -38.7 | 172.7 | -77.6 | 173.9 | 0 | 0 | 0 | 113 | L24 A25 V26 I30 L31 T32 Y54 | L24-L28 HydrophobicContact CD2-CD1 3.84Å; L24-L28 HydrophobicContact CD2-CG 4.49Å; L24-L28 WeakPolarHBondContact O-CG 3.28Å; L24-L28 PolarHBondContact O-N 3.25Å; A25-L28 PolarHBondContact O-N 3.14Å; V26-L28 PolarHBondContact O-N 2.97Å; L28-I30 VanDerWaalsContact C-N 3.34Å; L28-L31 PolarHBondContact O-N 3Å; L28-T32 WeakPolarHBondContact O-CB 3.37Å; L28-T32 PolarHBondContact O-N 3.13Å; L28-T32 PolarHBondContact O-OG1 2.85Å; L28-Y54 HydrophobicContact CD1-CE2 4.44Å; L28-Y54 HydrophobicContact CD2-CD2 4.07Å; L28-Y54 HydrophobicContact CD2-CE2 3.5Å; L28-Y54 VanDerWaalsContact CD2-CE2 3.5Å; L28-Y54 HydrophobicContact CG-CD2 4.39Å; L28-Y54 HydrophobicContact CG-CE2 3.92Å |
| 29 | L | 92.8 | Very high | 86.9 | Confident | 122 Ų | 122 | 79.4 Ų | 79.4 | 64% | 0.639 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -64.2 | -41 | 174.5 | -71.6 | 171.4 | 0 | 0 | 0 | 111.2 | A25 V26 D27 T32 W33 | A25-L29 WeakPolarHBondContact O-CG 3.38Å; A25-L29 PolarHBondContact O-N 3.48Å; A25-L29 VanDerWaalsContact O-N 3.11Å; V26-L29 WeakPolarHBondContact O-CB 3.19Å; V26-L29 PolarHBondContact O-N 3.19Å; V26-L29 VanDerWaalsContact O-N 3.16Å; D27-L29 PolarHBondContact O-N 2.95Å; L29-T32 PolarHBondContact O-N 3.34Å; L29-W33 PolarHBondContact O-N 3.49Å |
| 30 | I | 88.6 | Confident | 86.9 | Confident | 66 Ų | 66 | 78.8 Ų | 78.8 | 34% | 0.338 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -64 | -45.9 | 176.4 | -68.3 | 167 | 0 | 0 | 0 | 110.7 | V26 D27 L28 T32 W33 I34 A50 | V26-I30 HydrophobicContact CG1-CD1 3.88Å; V26-I30 HydrophobicContact CG1-CG1 4.46Å; V26-I30 WeakPolarHBondContact O-CG1 3.29Å; V26-I30 PolarHBondContact O-N 2.9Å; D27-I30 PolarHBondContact O-N 3.48Å; L28-I30 VanDerWaalsContact C-N 3.34Å; I30-T32 VanDerWaalsContact C-N 3.34Å; I30-T32 PolarHBondContact O-N 3.2Å; I30-W33 PolarHBondContact O-N 3.13Å; I30-I34 HydrophobicContact CG2-CD1 3.64Å; I30-I34 HydrophobicContact CG2-CG1 4.43Å; I30-I34 VanDerWaalsContact O-CG1 3.3Å; I30-I34 WeakPolarHBondContact O-CG1 3.34Å; I30-I34 PolarHBondContact O-N 3.09Å; I30-A50 HydrophobicContact CG2-CB 4.33Å |
| 31 | L | 88.4 | Confident | 86.9 | Confident | 44 Ų | 44 | 87.3 Ų | 87.3 | 23% | 0.23 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -61 | -41.6 | 176.1 | -82.4 | 157.6 | 0 | 0 | 0 | 112.2 | D27 L28 I34 G35 A50 Y54 | D27-L31 PolarHBondContact O-N 3.22Å; L28-L31 PolarHBondContact O-N 3Å; L31-I34 PolarHBondContact O-N 3.17Å; L31-G35 PolarHBondContact O-N 3.26Å; L31-A50 HydrophobicContact CD2-CB 4.03Å; L31-A50 HydrophobicContact CG-CB 3.98Å; L31-Y54 HydrophobicContact CD1-CD2 4.27Å; L31-Y54 HydrophobicContact CD1-CG 4.25Å |
| 32 | T | 90.3 | Very high | 86.9 | Confident | 106 Ų | 106 | 83.7 Ų | 83.7 | 65% | 0.65 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -64.3 | -41.9 | 177.4 | -55.6 | 0 | 0 | 0 | 0 | 111.3 | L28 L29 I30 | L28-T32 WeakPolarHBondContact O-CB 3.37Å; L28-T32 PolarHBondContact O-N 3.13Å; L28-T32 PolarHBondContact O-OG1 2.85Å; L29-T32 PolarHBondContact O-N 3.34Å; I30-T32 VanDerWaalsContact C-N 3.34Å; I30-T32 PolarHBondContact O-N 3.2Å |
| 33 | W | 89.3 | Confident | 87 | Confident | 188 Ų | 188 | 78.5 Ų | 78.5 | 71% | 0.712 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -62.8 | -50.5 | 174.9 | -176.3 | -7.8 | 0 | 0 | 0 | 110.7 | L29 I30 G35 G36 | L29-W33 PolarHBondContact O-N 3.49Å; I30-W33 PolarHBondContact O-N 3.13Å; W33-G35 VanDerWaalsContact C-N 3.25Å; W33-G35 PolarHBondContact O-N 3.18Å; W33-G36 PolarHBondContact O-N 3.37Å |
| 34 | I | 90.6 | Very high | 87 | Confident | 30 Ų | 30 | 77.1 Ų | 77.1 | 15% | 0.154 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -62.2 | -34.1 | -178.1 | -68.1 | 167.3 | 0 | 0 | 0 | 111.7 | I30 L31 G36 Q37 I46 | I30-I34 HydrophobicContact CG2-CD1 3.64Å; I30-I34 HydrophobicContact CG2-CG1 4.43Å; I30-I34 VanDerWaalsContact O-CG1 3.3Å; I30-I34 WeakPolarHBondContact O-CG1 3.34Å; I30-I34 PolarHBondContact O-N 3.09Å; L31-I34 PolarHBondContact O-N 3.17Å; I34-G36 PolarHBondContact O-N 2.73Å; I34-Q37 PolarHBondContact O-N 3.28Å; I34-I46 HydrophobicContact CD1-CB 3.88Å; I34-I46 HydrophobicContact CD1-CG2 3.38Å; I34-I46 HydrophobicContact CG1-CG2 4.48Å |
| 35 | G | 86.9 | Confident | 87.1 | Confident | 69 Ų | 69 | 79.7 Ų | 79.7 | 71% | 0.711 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -60.7 | -22.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | L31 W33 | L31-G35 PolarHBondContact O-N 3.26Å; W33-G35 VanDerWaalsContact C-N 3.25Å; W33-G35 PolarHBondContact O-N 3.18Å |
| 36 | G | 86.7 | Confident | 87 | Confident | 63 Ų | 63 | 82 Ų | 82 | 65% | 0.649 | 46% | 0.458 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.7 | -5.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | W33 I34 | W33-G36 PolarHBondContact O-N 3.37Å; I34-G36 PolarHBondContact O-N 2.73Å |
| 37 | Q | 86.1 | Confident | 86.9 | Confident | 70 Ų | 70 | 79 Ų | 79 | 33% | 0.327 | 44% | 0.442 | S | S | . | . | S | Bend | trans | -88.4 | 150.2 | 177.5 | -64.7 | -58.2 | -56.5 | 0 | 0 | 110.8 | I34 F43 | I34-Q37 PolarHBondContact O-N 3.28Å; Q37-F43 HydrophobicContact CB-CB 4.45Å; Q37-F43 HydrophobicContact CB-CD1 4.35Å; Q37-F43 HydrophobicContact CB-CD2 4.3Å; Q37-F43 HydrophobicContact CB-CG 4.11Å; Q37-F43 HydrophobicContact CG-CD1 4.28Å; Q37-F43 HydrophobicContact CG-CE1 4.36Å |
| 38 | P | 83.6 | Confident | 86.9 | Confident | 86 Ų | 86 | 84.3 Ų | 84.3 | 56% | 0.558 | 47% | 0.467 | S | S | * | . | trans | -60.8 | 144.8 | 172.5 | 26.5 | -33.7 | 0 | 0 | 0 | 110.2 | S40 | P38-S40 PolarHBondContact O-N 3.06Š| ||
| 39 | V | 79 | Confident | 87 | Confident | 135 Ų | 135 | 84.8 Ų | 84.8 | 82% | 0.818 | 47% | 0.473 | S | S | * | . | S | Bend | trans | -74.9 | 69.7 | 177.8 | -170.3 | 0 | 0 | 0 | 0 | 109.6 | ||
| 40 | S | 81.2 | Confident | 86.9 | Confident | 51 Ų | 51 | 79.2 Ų | 79.2 | 36% | 0.357 | 44% | 0.444 | S | S | . | . | trans | -119.5 | 153.9 | 174.6 | 59.3 | 0 | 0 | 0 | 0 | 110.3 | P38 F43 T44 | P38-S40 PolarHBondContact O-N 3.06Å; S40-F43 PolarHBondContact O-N 3.35Å; S40-T44 PolarHBondContact O-N 3.41Å | ||
| 41 | Y | 81.3 | Confident | 87 | Confident | 196 Ų | 196 | 78.4 Ų | 78.4 | 77% | 0.769 | 44% | 0.444 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.8 | 127.7 | 166.5 | -176 | -89.7 | 0 | 0 | 0 | 108.2 | I45 | Y41-I45 HydrophobicContact CD2-CD1 4.03Å; Y41-I45 HydrophobicContact CE2-CD1 3.54Å |
| 42 | P | 81.3 | Confident | 87.2 | Confident | 57 Ų | 57 | 80.9 Ų | 80.9 | 37% | 0.37 | 46% | 0.461 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -101.8 | -2 | 16.2 | 37.8 | -35.4 | 0 | 0 | 0 | 116.2 | T44 I45 I46 | P42-T44 VanDerWaalsContact C-N 3.29Å; P42-T44 PolarHBondContact O-N 2.7Å; P42-I45 PolarHBondContact O-N 3.28Å; P42-I46 PolarHBondContact O-N 3.39Å |
| 43 | F | 85.9 | Confident | 87.2 | Confident | 68 Ų | 68 | 79.9 Ų | 79.9 | 30% | 0.298 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -63.3 | -31.1 | -171.5 | -59.4 | -66 | 0 | 0 | 0 | 113.7 | Q37 S40 I45 I46 G47 | Q37-F43 HydrophobicContact CB-CB 4.45Å; Q37-F43 HydrophobicContact CB-CD1 4.35Å; Q37-F43 HydrophobicContact CB-CD2 4.3Å; Q37-F43 HydrophobicContact CB-CG 4.11Å; Q37-F43 HydrophobicContact CG-CD1 4.28Å; Q37-F43 HydrophobicContact CG-CE1 4.36Å; S40-F43 PolarHBondContact O-N 3.35Å; F43-I45 VanDerWaalsContact C-N 3.32Å; F43-I45 PolarHBondContact O-N 2.83Å; F43-I46 HydrophobicContact CD1-CD1 4.49Å; F43-I46 PolarHBondContact O-N 2.95Å; F43-G47 PolarHBondContact O-N 3.46Å |
| 44 | T | 86 | Confident | 87.2 | Confident | 53 Ų | 53 | 74.1 Ų | 74.1 | 33% | 0.325 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -58.9 | -41.7 | 175.6 | -51 | 0 | 0 | 0 | 0 | 112.5 | S40 P42 G47 Q48 | S40-T44 PolarHBondContact O-N 3.41Å; P42-T44 VanDerWaalsContact C-N 3.29Å; P42-T44 PolarHBondContact O-N 2.7Å; T44-G47 PolarHBondContact O-N 3.04Å; T44-Q48 WeakPolarHBondContact O-CG 3.44Å; T44-Q48 PolarHBondContact O-N 2.97Å; T44-Q48 VanDerWaalsContact O-N 3.09Å |
| 45 | I | 89.6 | Confident | 87.2 | Confident | 84 Ų | 84 | 78.8 Ų | 78.8 | 43% | 0.431 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -70.8 | -41.9 | -179.8 | -65.6 | 178.3 | 0 | 0 | 0 | 110.1 | Y41 P42 F43 G47 Q48 V49 | Y41-I45 HydrophobicContact CD2-CD1 4.03Å; Y41-I45 HydrophobicContact CE2-CD1 3.54Å; P42-I45 PolarHBondContact O-N 3.28Å; F43-I45 VanDerWaalsContact C-N 3.32Å; F43-I45 PolarHBondContact O-N 2.83Å; I45-G47 VanDerWaalsContact C-N 3.3Å; I45-G47 PolarHBondContact O-N 3.37Å; I45-Q48 PolarHBondContact O-N 3.09Å; I45-V49 HydrophobicContact CG2-CG2 4.32Å; I45-V49 WeakPolarHBondContact O-CG2 3.47Å; I45-V49 PolarHBondContact O-N 3.47Å |
| 46 | I | 88.6 | Confident | 87.3 | Confident | 78 Ų | 78 | 77.9 Ų | 77.9 | 40% | 0.4 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -62.4 | -41.4 | 178.5 | -52.7 | 173.2 | 0 | 0 | 0 | 110 | I34 P42 F43 Q48 V49 A50 | I34-I46 HydrophobicContact CD1-CB 3.88Å; I34-I46 HydrophobicContact CD1-CG2 3.38Å; I34-I46 HydrophobicContact CG1-CG2 4.48Å; P42-I46 PolarHBondContact O-N 3.39Å; F43-I46 HydrophobicContact CD1-CD1 4.49Å; F43-I46 PolarHBondContact O-N 2.95Å; I46-Q48 PolarHBondContact O-N 2.95Å; I46-V49 PolarHBondContact O-N 3.37Å; I46-A50 VanDerWaalsContact O-CB 3.25Å; I46-A50 WeakPolarHBondContact O-CB 3.42Å; I46-A50 PolarHBondContact O-N 2.91Å |
| 47 | G | 89.4 | Confident | 87.2 | Confident | 13 Ų | 13 | 75.2 Ų | 75.2 | 13% | 0.134 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -64.1 | -39.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | F43 T44 I45 S51 | F43-G47 PolarHBondContact O-N 3.46Å; T44-G47 PolarHBondContact O-N 3.04Å; I45-G47 VanDerWaalsContact C-N 3.3Å; I45-G47 PolarHBondContact O-N 3.37Å; G47-S51 WeakPolarHBondContact O-CB 3.42Å; G47-S51 PolarHBondContact O-N 3.49Å; G47-S51 PolarHBondContact O-OG 3.32Å |
| 48 | Q | 89.3 | Confident | 87.2 | Confident | 122 Ų | 122 | 74.2 Ų | 74.2 | 57% | 0.57 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -65.3 | -47.5 | 175 | -74.4 | 176.1 | -1.1 | 0 | 0 | 111.8 | T44 I45 I46 S51 V52 | T44-Q48 WeakPolarHBondContact O-CG 3.44Å; T44-Q48 PolarHBondContact O-N 2.97Å; T44-Q48 VanDerWaalsContact O-N 3.09Å; I45-Q48 PolarHBondContact O-N 3.09Å; I46-Q48 PolarHBondContact O-N 2.95Å; Q48-S51 PolarHBondContact O-N 2.93Å; Q48-V52 WeakPolarHBondContact O-CG2 3.45Å; Q48-V52 PolarHBondContact O-N 3.33Å |
| 49 | V | 92.4 | Very high | 87.2 | Confident | 80 Ų | 80 | 75.2 Ų | 75.2 | 49% | 0.485 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -62.1 | -45.4 | 177.8 | 172.4 | 0 | 0 | 0 | 0 | 110.8 | I45 I46 S51 V52 L53 | I45-V49 HydrophobicContact CG2-CG2 4.32Å; I45-V49 WeakPolarHBondContact O-CG2 3.47Å; I45-V49 PolarHBondContact O-N 3.47Å; I46-V49 PolarHBondContact O-N 3.37Å; V49-S51 PolarHBondContact O-N 2.95Å; V49-V52 PolarHBondContact O-N 3.27Å; V49-L53 HydrophobicContact CG1-CD1 3.93Å; V49-L53 HydrophobicContact CG1-CG 4.41Å; V49-L53 WeakPolarHBondContact O-CB 3.35Å; V49-L53 WeakPolarHBondContact O-CG 3.37Å; V49-L53 PolarHBondContact O-N 2.91Å |
| 50 | A | 90.3 | Very high | 87.4 | Confident | 5 Ų | 5 | 73.4 Ų | 73.4 | 4% | 0.041 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -61.1 | -42.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | I30 L31 I46 V52 L53 Y54 | I30-A50 HydrophobicContact CG2-CB 4.33Å; L31-A50 HydrophobicContact CD2-CB 4.03Å; L31-A50 HydrophobicContact CG-CB 3.98Å; I46-A50 VanDerWaalsContact O-CB 3.25Å; I46-A50 WeakPolarHBondContact O-CB 3.42Å; I46-A50 PolarHBondContact O-N 2.91Å; A50-V52 PolarHBondContact O-N 3.29Å; A50-L53 PolarHBondContact O-N 3.3Å; A50-Y54 WeakPolarHBondContact O-CB 3.46Å; A50-Y54 PolarHBondContact O-N 3.43Å |
| 51 | S | 90.4 | Very high | 87.5 | Confident | 49 Ų | 49 | 73.7 Ų | 73.7 | 34% | 0.343 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -63.2 | -41.8 | 176.6 | -59.1 | 0 | 0 | 0 | 0 | 112.3 | G47 Q48 V49 Y54 F55 | G47-S51 WeakPolarHBondContact O-CB 3.42Å; G47-S51 PolarHBondContact O-N 3.49Å; G47-S51 PolarHBondContact O-OG 3.32Å; Q48-S51 PolarHBondContact O-N 2.93Å; V49-S51 PolarHBondContact O-N 2.95Å; S51-Y54 WeakPolarHBondContact O-CB 3.27Å; S51-Y54 PolarHBondContact O-N 3.49Å; S51-F55 VanDerWaalsContact O-CD2 3.29Å; S51-F55 WeakPolarHBondContact O-CD2 3.43Å; S51-F55 PolarHBondContact O-N 2.92Å; S51-F55 VanDerWaalsContact O-N 3.17Å |
| 52 | V | 93.6 | Very high | 87.5 | Confident | 95 Ų | 95 | 68.8 Ų | 68.8 | 58% | 0.576 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -64.6 | -42 | 175.5 | 172.3 | 0 | 0 | 0 | 0 | 110.7 | Q48 V49 A50 T56 | Q48-V52 WeakPolarHBondContact O-CG2 3.45Å; Q48-V52 PolarHBondContact O-N 3.33Å; V49-V52 PolarHBondContact O-N 3.27Å; A50-V52 PolarHBondContact O-N 3.29Å; V52-T56 WeakPolarHBondContact O-CB 3.34Å; V52-T56 PolarHBondContact O-N 2.86Å; V52-T56 PolarHBondContact O-OG1 2.89Å |
| 53 | L | 90 | Very high | 87.4 | Confident | 86 Ų | 86 | 68.7 Ų | 68.7 | 45% | 0.45 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -61.8 | -43.3 | 175.5 | -76.5 | 171.1 | 0 | 0 | 0 | 111.8 | V49 A50 T56 T57 | V49-L53 HydrophobicContact CG1-CD1 3.93Å; V49-L53 HydrophobicContact CG1-CG 4.41Å; V49-L53 WeakPolarHBondContact O-CB 3.35Å; V49-L53 WeakPolarHBondContact O-CG 3.37Å; V49-L53 PolarHBondContact O-N 2.91Å; A50-L53 PolarHBondContact O-N 3.3Å; L53-T56 PolarHBondContact O-N 3.41Å; L53-T57 VanDerWaalsContact O-CB 3.27Å; L53-T57 WeakPolarHBondContact O-CB 3.48Å; L53-T57 PolarHBondContact O-N 3.28Å; L53-T57 PolarHBondContact O-OG1 3.3Å |
| 54 | Y | 89.8 | Confident | 87.2 | Confident | 66 Ų | 66 | 68.3 Ų | 68.3 | 26% | 0.259 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -55.1 | -56.1 | 176.4 | -177.3 | -104.8 | 0 | 0 | 0 | 111.8 | L24 D27 L28 L31 A50 S51 T56 T57 I58 | L24-Y54 HydrophobicContact CD1-CE2 4.31Å; L24-Y54 HydrophobicContact CG-CE2 4.38Å; D27-Y54 VanDerWaalsContact OD2-CA 3.31Å; D27-Y54 WeakPolarHBondContact OD2-CA 3.43Å; D27-Y54 WeakPolarHBondContact OD2-CB 3.47Å; D27-Y54 PolarHBondContact OD2-N 3.4Å; L28-Y54 HydrophobicContact CD1-CE2 4.44Å; L28-Y54 HydrophobicContact CD2-CD2 4.07Å; L28-Y54 HydrophobicContact CD2-CE2 3.5Å; L28-Y54 VanDerWaalsContact CD2-CE2 3.5Å; L28-Y54 HydrophobicContact CG-CD2 4.39Å; L28-Y54 HydrophobicContact CG-CE2 3.92Å; L31-Y54 HydrophobicContact CD1-CD2 4.27Å; L31-Y54 HydrophobicContact CD1-CG 4.25Å; A50-Y54 WeakPolarHBondContact O-CB 3.46Å; A50-Y54 PolarHBondContact O-N 3.43Å; S51-Y54 WeakPolarHBondContact O-CB 3.27Å; S51-Y54 PolarHBondContact O-N 3.49Å; Y54-T56 PolarHBondContact O-N 3.46Å; Y54-T57 PolarHBondContact O-N 3.46Å; Y54-I58 HydrophobicContact CD1-CD1 4.25Å; Y54-I58 HydrophobicContact CD2-CD1 4.37Å; Y54-I58 HydrophobicContact CE1-CD1 3.62Å; Y54-I58 HydrophobicContact CE2-CD1 3.73Å; Y54-I58 PolarHBondContact O-N 3.4Å; Y54-I58 VanDerWaalsContact O-N 3.13Å; Y54-I58 WeakPolarHBondContact OH-CD1 3.36Å |
| 55 | F | 89.1 | Confident | 87 | Confident | 128 Ų | 128 | 67.2 Ų | 67.2 | 56% | 0.561 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -65.2 | -40.3 | -179 | -81.5 | -71.8 | 0 | 0 | 0 | 112.3 | S51 T57 I58 L59 | S51-F55 VanDerWaalsContact O-CD2 3.29Å; S51-F55 WeakPolarHBondContact O-CD2 3.43Å; S51-F55 PolarHBondContact O-N 2.92Å; S51-F55 VanDerWaalsContact O-N 3.17Å; F55-T57 VanDerWaalsContact C-N 3.3Å; F55-T57 PolarHBondContact O-N 3.01Å; F55-I58 PolarHBondContact O-N 2.82Å; F55-L59 HydrophobicContact CD1-CD1 4.37Å; F55-L59 VanDerWaalsContact O-CB 3.29Å; F55-L59 WeakPolarHBondContact O-CB 3.28Å; F55-L59 WeakPolarHBondContact O-CG 3.29Å; F55-L59 PolarHBondContact O-N 3.23Å |
| 56 | T | 89.9 | Confident | 86.3 | Confident | 51 Ų | 51 | 63.9 Ų | 63.9 | 31% | 0.313 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -63.5 | -39.4 | 177.4 | -59.6 | 0 | 0 | 0 | 0 | 111.1 | V52 L53 Y54 I60 L61 | V52-T56 WeakPolarHBondContact O-CB 3.34Å; V52-T56 PolarHBondContact O-N 2.86Å; V52-T56 PolarHBondContact O-OG1 2.89Å; L53-T56 PolarHBondContact O-N 3.41Å; Y54-T56 PolarHBondContact O-N 3.46Å; T56-I60 HydrophobicContact CG2-CB 4.49Å; T56-I60 HydrophobicContact CG2-CD1 4.32Å; T56-I60 WeakPolarHBondContact O-CA 3.45Å; T56-I60 WeakPolarHBondContact O-CB 3.21Å; T56-I60 PolarHBondContact O-N 3.23Å; T56-L61 HydrophobicContact CG2-CD1 4.04Å; T56-L61 PolarHBondContact O-N 2.92Å; T56-L61 VanDerWaalsContact O-N 3.09Å |
| 57 | T | 85.5 | Confident | 85.8 | Confident | 6 Ų | 6 | 65.1 Ų | 65.1 | 4% | 0.037 | 35% | 0.35 | C | S | . | . | I | π-helix | trans | -64.2 | -48.2 | 179.6 | -61 | 0 | 0 | 0 | 0 | 111.1 | L23 L24 L53 Y54 F55 L61 M62 | L23-T57 HydrophobicContact CD2-CG2 4.21Å; L24-T57 HydrophobicContact CB-CG2 4.31Å; L24-T57 HydrophobicContact CD1-CG2 4.14Å; L53-T57 VanDerWaalsContact O-CB 3.27Å; L53-T57 WeakPolarHBondContact O-CB 3.48Å; L53-T57 PolarHBondContact O-N 3.28Å; L53-T57 PolarHBondContact O-OG1 3.3Å; Y54-T57 PolarHBondContact O-N 3.46Å; F55-T57 VanDerWaalsContact C-N 3.3Å; F55-T57 PolarHBondContact O-N 3.01Å; T57-L61 WeakPolarHBondContact O-CB 3.19Å; T57-L61 PolarHBondContact O-N 3.17Å; T57-M62 PolarHBondContact O-N 2.93Å |
| 58 | I | 84.1 | Confident | 85.4 | Confident | 49 Ų | 49 | 68.6 Ų | 68.6 | 25% | 0.251 | 37% | 0.365 | S | S | . | . | I | π-helix | trans | -70.8 | -49.3 | -179 | -64.8 | 178.4 | 0 | 0 | 0 | 111.8 | L24 Y54 F55 M62 | L24-I58 HydrophobicContact CD1-CD1 3.83Å; L24-I58 HydrophobicContact CD1-CG1 3.35Å; Y54-I58 HydrophobicContact CD1-CD1 4.25Å; Y54-I58 HydrophobicContact CD2-CD1 4.37Å; Y54-I58 HydrophobicContact CE1-CD1 3.62Å; Y54-I58 HydrophobicContact CE2-CD1 3.73Å; Y54-I58 PolarHBondContact O-N 3.4Å; Y54-I58 VanDerWaalsContact O-N 3.13Å; Y54-I58 WeakPolarHBondContact OH-CD1 3.36Å; F55-I58 PolarHBondContact O-N 2.82Å; I58-M62 WeakPolarHBondContact O-CB 3.42Å |
| 59 | L | 83.6 | Confident | 84.7 | Confident | 108 Ų | 108 | 63.2 Ų | 63.2 | 57% | 0.565 | 34% | 0.34 | S | S | * | . | I | π-helix | trans | -80.3 | -32.5 | -170.6 | -67.5 | 175.4 | 0 | 0 | 0 | 113.1 | F55 P63 | F55-L59 HydrophobicContact CD1-CD1 4.37Å; F55-L59 VanDerWaalsContact O-CB 3.29Å; F55-L59 WeakPolarHBondContact O-CB 3.28Å; F55-L59 WeakPolarHBondContact O-CG 3.29Å; F55-L59 PolarHBondContact O-N 3.23Å; L59-P63 WeakPolarHBondContact O-CD 3.45Å; L59-P63 WeakPolarHBondContact O-CG 3.25Å |
| 60 | I | 84.8 | Confident | 83.8 | Confident | 97 Ų | 97 | 61.4 Ų | 61.4 | 50% | 0.497 | 33% | 0.328 | S | S | . | . | I | π-helix | trans | -114 | -54 | -171.2 | -56.6 | 176.5 | 0 | 0 | 0 | 111.3 | T56 M62 P63 T64 | T56-I60 HydrophobicContact CG2-CB 4.49Å; T56-I60 HydrophobicContact CG2-CD1 4.32Å; T56-I60 WeakPolarHBondContact O-CA 3.45Å; T56-I60 WeakPolarHBondContact O-CB 3.21Å; T56-I60 PolarHBondContact O-N 3.23Å; I60-M62 PolarHBondContact O-N 3.43Å; I60-P63 VanDerWaalsContact O-CD 3.29Å; I60-P63 WeakPolarHBondContact O-CD 3.36Å; I60-P63 WeakPolarHBondContact O-CG 3.12Å; I60-T64 HydrophobicContact CG2-CG2 4.36Å; I60-T64 WeakPolarHBondContact O-CB 3.17Å; I60-T64 WeakPolarHBondContact O-CG2 3.31Å; I60-T64 PolarHBondContact O-N 3.13Å; I60-T64 VanDerWaalsContact O-N 3.14Å; I60-T64 PolarHBondContact O-OG1 2.95Å |
| 61 | L | 82.3 | Confident | 83 | Confident | 56 Ų | 56 | 69.3 Ų | 69.3 | 29% | 0.293 | 36% | 0.361 | S | S | . | . | I | π-helix | trans | -66.8 | -41 | -175.9 | -87.3 | 59.2 | 0 | 0 | 0 | 111.8 | L20 T56 T57 T64 I65 | L20-L61 HydrophobicContact CD1-CB 4.25Å; L20-L61 HydrophobicContact CD2-CB 3.87Å; L20-L61 HydrophobicContact CD2-CD2 3.66Å; L20-L61 HydrophobicContact CD2-CG 4.23Å; T56-L61 HydrophobicContact CG2-CD1 4.04Å; T56-L61 PolarHBondContact O-N 2.92Å; T56-L61 VanDerWaalsContact O-N 3.09Å; T57-L61 WeakPolarHBondContact O-CB 3.19Å; T57-L61 PolarHBondContact O-N 3.17Å; L61-T64 VanDerWaalsContact CA-OG1 3.28Å; L61-T64 WeakPolarHBondContact CA-OG1 3.48Å; L61-T64 PolarHBondContact O-N 3.46Å; L61-T64 PolarHBondContact O-OG1 3.24Å; L61-I65 WeakPolarHBondContact O-CB 3.39Å; L61-I65 WeakPolarHBondContact O-CG1 3.45Å; L61-I65 PolarHBondContact O-N 3.38Å |
| 62 | M | 82.3 | Confident | 82 | Confident | 93 Ų | 93 | 73.6 Ų | 73.6 | 46% | 0.458 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -60.9 | -49.5 | -178.1 | -155.2 | 152.3 | -172.5 | 0 | 0 | 113.3 | M11 T57 I58 I60 S66 | M11-M62 HydrophobicContact CE-CE 4.01Å; T57-M62 PolarHBondContact O-N 2.93Å; I58-M62 WeakPolarHBondContact O-CB 3.42Å; I60-M62 PolarHBondContact O-N 3.43Å; M62-S66 VanDerWaalsContact O-CB 3.28Å; M62-S66 WeakPolarHBondContact O-CB 3.44Å; M62-S66 PolarHBondContact O-N 3.47Å; M62-S66 VanDerWaalsContact O-N 3.13Å |
| 63 | P | 78.4 | Confident | 80.9 | Confident | 55 Ų | 55 | 73.4 Ų | 73.4 | 36% | 0.357 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -68.8 | -38.2 | 174.7 | 24.4 | -32.1 | 0 | 0 | 0 | 112.8 | L59 I60 S66 L67 | L59-P63 WeakPolarHBondContact O-CD 3.45Å; L59-P63 WeakPolarHBondContact O-CG 3.25Å; I60-P63 VanDerWaalsContact O-CD 3.29Å; I60-P63 WeakPolarHBondContact O-CD 3.36Å; I60-P63 WeakPolarHBondContact O-CG 3.12Å; P63-S66 WeakPolarHBondContact CA-OG 3.44Å; P63-S66 PolarHBondContact O-N 3.11Å; P63-S66 PolarHBondContact O-OG 3.46Å; P63-L67 WeakPolarHBondContact O-CG 3.46Å; P63-L67 PolarHBondContact O-N 2.89Å |
| 64 | T | 81.8 | Confident | 79.4 | Confident | 60 Ų | 60 | 78.1 Ų | 78.1 | 37% | 0.368 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -66.3 | -47 | -177.9 | 52 | 0 | 0 | 0 | 0 | 112.6 | I60 L61 S66 L67 I68 | I60-T64 HydrophobicContact CG2-CG2 4.36Å; I60-T64 WeakPolarHBondContact O-CB 3.17Å; I60-T64 WeakPolarHBondContact O-CG2 3.31Å; I60-T64 PolarHBondContact O-N 3.13Å; I60-T64 VanDerWaalsContact O-N 3.14Å; I60-T64 PolarHBondContact O-OG1 2.95Å; L61-T64 VanDerWaalsContact CA-OG1 3.28Å; L61-T64 WeakPolarHBondContact CA-OG1 3.48Å; L61-T64 PolarHBondContact O-N 3.46Å; L61-T64 PolarHBondContact O-OG1 3.24Å; T64-S66 PolarHBondContact O-N 3.45Å; T64-L67 PolarHBondContact O-N 3.39Å; T64-L67 VanDerWaalsContact O-N 3.14Å; T64-I68 VanDerWaalsContact O-CG1 3.3Å; T64-I68 WeakPolarHBondContact O-CG1 3.35Å; T64-I68 PolarHBondContact O-N 2.93Å |
| 65 | I | 81.9 | Confident | 77.8 | Confident | 31 Ų | 31 | 82.3 Ų | 82.3 | 16% | 0.159 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -63.9 | -36.1 | 174.2 | -65.4 | -146.9 | 0 | 0 | 0 | 110.5 | L16 L20 L61 L67 I68 E69 | L16-I65 HydrophobicContact CB-CD1 4.42Å; L16-I65 HydrophobicContact CB-CG2 3.6Å; L20-I65 HydrophobicContact CD1-CB 3.54Å; L20-I65 HydrophobicContact CD1-CD1 3.43Å; L20-I65 VanDerWaalsContact CD1-CD1 3.43Å; L20-I65 HydrophobicContact CD1-CG1 3.55Å; L20-I65 HydrophobicContact CD1-CG2 3.91Å; L20-I65 HydrophobicContact CD2-CD1 4.04Å; L20-I65 HydrophobicContact CG-CD1 3.68Å; L20-I65 HydrophobicContact CG-CG1 4.36Å; L61-I65 WeakPolarHBondContact O-CB 3.39Å; L61-I65 WeakPolarHBondContact O-CG1 3.45Å; L61-I65 PolarHBondContact O-N 3.38Å; I65-L67 VanDerWaalsContact C-N 3.27Å; I65-L67 PolarHBondContact O-N 2.97Å; I65-I68 PolarHBondContact O-N 3.16Å; I65-E69 HydrophobicContact CG2-CG 4.36Å; I65-E69 WeakPolarHBondContact O-CB 3.45Å; I65-E69 PolarHBondContact O-N 3.42Å |
| 66 | S | 75.9 | Confident | 75.7 | Confident | 14 Ų | 14 | 84.4 Ų | 84.4 | 10% | 0.098 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -61.8 | -35.9 | 175.6 | 84 | 0 | 0 | 0 | 0 | 112.8 | R14 M62 P63 T64 N70 | R14-S66 PolarHBondContact NH2-O 3.01Å; M62-S66 VanDerWaalsContact O-CB 3.28Å; M62-S66 WeakPolarHBondContact O-CB 3.44Å; M62-S66 PolarHBondContact O-N 3.47Å; M62-S66 VanDerWaalsContact O-N 3.13Å; P63-S66 WeakPolarHBondContact CA-OG 3.44Å; P63-S66 PolarHBondContact O-N 3.11Å; P63-S66 PolarHBondContact O-OG 3.46Å; T64-S66 PolarHBondContact O-N 3.45Å; S66-N70 WeakPolarHBondContact O-CB 3.29Å; S66-N70 PolarHBondContact O-N 2.93Å; S66-N70 PolarHBondContact O-ND2 3.49Å; S66-N70 PolarHBondContact O-OD1 2.78Å |
| 67 | L | 77.5 | Confident | 75 | Confident | 103 Ų | 103 | 86.1 Ų | 86.1 | 54% | 0.539 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -73.8 | -40.2 | 175.7 | -69.9 | 167.6 | 0 | 0 | 0 | 112.1 | P63 T64 I65 N70 K71 | P63-L67 WeakPolarHBondContact O-CG 3.46Å; P63-L67 PolarHBondContact O-N 2.89Å; T64-L67 PolarHBondContact O-N 3.39Å; T64-L67 VanDerWaalsContact O-N 3.14Å; I65-L67 VanDerWaalsContact C-N 3.27Å; I65-L67 PolarHBondContact O-N 2.97Å; L67-N70 PolarHBondContact O-N 2.97Å; L67-K71 WeakPolarHBondContact O-CG 3.46Å; L67-K71 PolarHBondContact O-N 3.02Å |
| 68 | I | 80.6 | Confident | 74.4 | Confident | 87 Ų | 87 | 90.3 Ų | 90.3 | 45% | 0.446 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -63.4 | -48.3 | 178.9 | -68.7 | 164.2 | 0 | 0 | 0 | 110.4 | T64 I65 N70 K71 M72 | T64-I68 VanDerWaalsContact O-CG1 3.3Å; T64-I68 WeakPolarHBondContact O-CG1 3.35Å; T64-I68 PolarHBondContact O-N 2.93Å; I65-I68 PolarHBondContact O-N 3.16Å; I68-N70 VanDerWaalsContact C-N 3.34Å; I68-N70 PolarHBondContact O-N 3.17Å; I68-K71 PolarHBondContact O-N 3.26Å; I68-M72 HydrophobicContact CG2-SD 4.32Å; I68-M72 PolarHBondContact O-N 3.49Å |
| 69 | E | 74.3 | Confident | 73.9 | Confident | 8 Ų | 8 | 92.6 Ų | 92.6 | 4% | 0.037 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -66.2 | -36.2 | 178.6 | -82 | -179.9 | 140.8 | 0 | 0 | 111.8 | R14 L16 S17 I65 K71 M72 L73 | R14-E69 WeakPolarHBondContact CA-OE1 3.36Å; R14-E69 VanDerWaalsContact CB-OE1 3.28Å; R14-E69 WeakPolarHBondContact CB-OE1 3.3Å; R14-E69 WeakPolarHBondContact CB-OE2 3.3Å; R14-E69 IonicContact CZ-OE2 3.31Å; R14-E69 VanDerWaalsContact CZ-OE2 3.31Å; R14-E69 IonicContact NE-OE2 2.66Å; R14-E69 PolarHBondContact NE-OE2 3.46Å; R14-E69 IonicContact NH2-OE2 3.45Å; R14-E69 PolarHBondContact NH2-OE2 2.9Å; L16-E69 WeakPolarHBondContact CA-OE1 3.44Å; L16-E69 HydrophobicContact CB-CG 4.07Å; L16-E69 VanDerWaalsContact CB-OE1 3.27Å; L16-E69 WeakPolarHBondContact CB-OE1 3.36Å; L16-E69 HydrophobicContact CD1-CG 3.88Å; L16-E69 HydrophobicContact CG-CG 4.37Å; L16-E69 PolarHBondContact N-OE1 2.91Å; S17-E69 PolarHBondContact N-OE1 3.45Å; S17-E69 PolarHBondContact OG-OE2 2.74Å; I65-E69 HydrophobicContact CG2-CG 4.36Å; I65-E69 WeakPolarHBondContact O-CB 3.45Å; I65-E69 PolarHBondContact O-N 3.42Å; E69-K71 VanDerWaalsContact C-N 3.34Å; E69-K71 PolarHBondContact O-N 3.28Å; E69-M72 PolarHBondContact O-N 2.77Å; E69-L73 WeakPolarHBondContact O-CB 3.38Å; E69-L73 WeakPolarHBondContact O-CG 3.4Å; E69-L73 PolarHBondContact O-N 3.18Å |
| 70 | N | 73.1 | Confident | 73.3 | Confident | 43 Ų | 43 | 91.6 Ų | 91.6 | 23% | 0.23 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -61.7 | -42.7 | 173.3 | -72.7 | -7.2 | 0 | 0 | 0 | 111.6 | R14 S66 L67 I68 | R14-N70 PolarHBondContact NH2-OD1 3.09Å; S66-N70 WeakPolarHBondContact O-CB 3.29Å; S66-N70 PolarHBondContact O-N 2.93Å; S66-N70 PolarHBondContact O-ND2 3.49Å; S66-N70 PolarHBondContact O-OD1 2.78Å; L67-N70 PolarHBondContact O-N 2.97Å; I68-N70 VanDerWaalsContact C-N 3.34Å; I68-N70 PolarHBondContact O-N 3.17Å |
| 71 | K | 73.5 | Confident | 72.6 | Confident | 170 Ų | 170 | 91.3 Ų | 91.3 | 74% | 0.739 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -65.7 | -41.1 | 175.5 | -75.9 | 178.4 | 178.3 | -72.5 | 0 | 112.3 | L67 I68 E69 K74 | L67-K71 WeakPolarHBondContact O-CG 3.46Å; L67-K71 PolarHBondContact O-N 3.02Å; I68-K71 PolarHBondContact O-N 3.26Å; E69-K71 VanDerWaalsContact C-N 3.34Å; E69-K71 PolarHBondContact O-N 3.28Å; K71-K74 PolarHBondContact O-N 3.29Å |
| 72 | M | 70.3 | Confident | 72 | Confident | 139 Ų | 139 | 93.7 Ų | 93.7 | 69% | 0.685 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -64.3 | -38.9 | 177.4 | -81.6 | -177.1 | 62.4 | 0 | 0 | 112.6 | L16 I68 E69 K74 | L16-M72 HydrophobicContact CD1-SD 4.49Å; I68-M72 HydrophobicContact CG2-SD 4.32Å; I68-M72 PolarHBondContact O-N 3.49Å; E69-M72 PolarHBondContact O-N 2.77Å; M72-K74 PolarHBondContact O-N 3.03Å |
| 73 | L | 70.1 | Confident | 71.2 | Confident | 91 Ų | 91 | 93.7 Ų | 93.7 | 48% | 0.476 | 50% | 0.496 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.8 | 6.6 | -179.7 | -67.8 | 170.9 | 0 | 0 | 0 | 113.6 | E69 W75 | E69-L73 WeakPolarHBondContact O-CB 3.38Å; E69-L73 WeakPolarHBondContact O-CG 3.4Å; E69-L73 PolarHBondContact O-N 3.18Å; L73-W75 PolarHBondContact O-N 3.39Å; L73-W75 VanDerWaalsContact O-N 3.09Å |
| 74 | K | 58.4 | Low | 70.7 | Confident | 185 Ų | 185 | 96.7 Ų | 96.7 | 80% | 0.804 | 51% | 0.506 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.1 | 33.9 | 178 | -68.8 | -175 | 177.8 | 179.4 | 0 | 114 | K71 M72 A76 | K71-K74 PolarHBondContact O-N 3.29Å; M72-K74 PolarHBondContact O-N 3.03Å; K74-A76 PolarHBondContact O-N 2.94Å |
| 75 | W | 56.8 | Low | 69.8 | Low | 155 Ų | 155 | 99.8 Ų | 99.8 | 59% | 0.587 | 52% | 0.518 | S | S | * | . | trans | -84 | 99 | 160.4 | -82.6 | 0.7 | 0 | 0 | 0 | 107.5 | K7 Q8 L73 | K7-W75 HydrophobicContact CB-CZ3 4.34Å; Q8-W75 HydrophobicContact CG-CH2 4.15Å; Q8-W75 HydrophobicContact CG-CZ3 3.94Å; L73-W75 PolarHBondContact O-N 3.39Å; L73-W75 VanDerWaalsContact O-N 3.09Å | ||
| 76 | A | 44.9 | Very low | 68.7 | Low | 171 Ų | 171 | 106 Ų | 106 | 100% | 1.413 | 55% | 0.551 | S | S | * | * | trans | -64.5 | 0 | 163.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | K74 | K74-A76 PolarHBondContact O-N 2.94Š|
Retrieved 76 of 76 residues in 16.6 ms
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