| 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 | 64.4 | Low | 70.4 | Confident | 189 Ų | 189 | 132.1 Ų | 132.1 | 93% | 0.931 | 61% | 0.611 | S | S | * | * | 0 | -48.6 | 0 | -63.4 | -56.2 | -83.3 | 0 | 0 | 111.7 | E3 Y4 Q5 | M1-E3 PolarHBondContact O-N 3.35Å; M1-Y4 VanDerWaalsContact O-CB 3.31Å; M1-Y4 WeakPolarHBondContact O-CB 3.41Å; M1-Y4 PolarHBondContact O-N 3.12Å; M1-Y4 VanDerWaalsContact O-N 3.15Å; M1-Q5 PolarHBondContact O-N 2.87Å | |||
| 2 | E | 73.4 | Confident | 69.9 | Low | 155 Ų | 155 | 127 Ų | 127 | 72% | 0.724 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -64.4 | -39 | 179 | -67.8 | 179.5 | 137.9 | 0 | 0 | 114.4 | Y4 Q5 K6 | E2-Y4 PolarHBondContact O-N 3.35Å; E2-Q5 PolarHBondContact O-N 3.48Å; E2-K6 PolarHBondContact O-N 2.93Å |
| 3 | E | 76.6 | Confident | 69.6 | Low | 151 Ų | 151 | 128.7 Ų | 128.7 | 71% | 0.706 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -59.6 | -35.1 | 172.7 | -84.3 | -100.5 | 125.1 | 0 | 0 | 112.5 | M1 K6 L7 | M1-E3 PolarHBondContact O-N 3.35Å; E3-K6 PolarHBondContact O-N 3.19Å; E3-L7 PolarHBondContact O-N 3.08Å; E3-L7 VanDerWaalsContact O-N 3.14Å |
| 4 | Y | 66.3 | Low | 69.4 | Low | 125 Ų | 125 | 132.6 Ų | 132.6 | 49% | 0.49 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -67.1 | -45.5 | 179.6 | -102.1 | -98.2 | 0 | 0 | 0 | 111.4 | M1 E2 K6 L7 E8 | M1-Y4 VanDerWaalsContact O-CB 3.31Å; M1-Y4 WeakPolarHBondContact O-CB 3.41Å; M1-Y4 PolarHBondContact O-N 3.12Å; M1-Y4 VanDerWaalsContact O-N 3.15Å; E2-Y4 PolarHBondContact O-N 3.35Å; Y4-K6 VanDerWaalsContact C-N 3.34Å; Y4-K6 PolarHBondContact O-N 2.95Å; Y4-L7 WeakPolarHBondContact O-CB 3.33Å; Y4-L7 PolarHBondContact O-N 3.22Å; Y4-L7 VanDerWaalsContact O-N 3.12Å; Y4-E8 PolarHBondContact O-N 2.94Å |
| 5 | Q | 73.8 | Confident | 69.1 | Low | 136 Ų | 136 | 135.9 Ų | 135.9 | 64% | 0.636 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -64 | -39.4 | 177.8 | -76.3 | -179 | -48.3 | 0 | 0 | 112.2 | M1 E2 L7 E8 E9 | M1-Q5 PolarHBondContact O-N 2.87Å; E2-Q5 PolarHBondContact O-N 3.48Å; Q5-L7 PolarHBondContact O-N 3.32Å; Q5-E8 PolarHBondContact O-N 3.43Å; Q5-E9 PolarHBondContact O-N 3.3Å |
| 6 | K | 76.5 | Confident | 68.8 | Low | 129 Ų | 129 | 131.4 Ų | 131.4 | 56% | 0.561 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -63.6 | -30.4 | 174.5 | -74.7 | -179.7 | -178.8 | 173.8 | 0 | 112.7 | E2 E3 Y4 K10 | E2-K6 PolarHBondContact O-N 2.93Å; E3-K6 PolarHBondContact O-N 3.19Å; Y4-K6 VanDerWaalsContact C-N 3.34Å; Y4-K6 PolarHBondContact O-N 2.95Å; K6-K10 WeakPolarHBondContact O-CG 3.31Å; K6-K10 PolarHBondContact O-N 3.31Å |
| 7 | L | 69.2 | Low | 69.1 | Low | 76 Ų | 76 | 126.9 Ų | 126.9 | 40% | 0.398 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -73.1 | -44 | 175.6 | -129.3 | 87.5 | 0 | 0 | 0 | 111.3 | E3 Y4 Q5 E9 K10 I11 F28 | E3-L7 PolarHBondContact O-N 3.08Å; E3-L7 VanDerWaalsContact O-N 3.14Å; Y4-L7 WeakPolarHBondContact O-CB 3.33Å; Y4-L7 PolarHBondContact O-N 3.22Å; Y4-L7 VanDerWaalsContact O-N 3.12Å; Q5-L7 PolarHBondContact O-N 3.32Å; L7-E9 VanDerWaalsContact C-N 3.35Å; L7-E9 PolarHBondContact O-N 2.9Å; L7-K10 PolarHBondContact O-N 2.9Å; L7-I11 HydrophobicContact CD2-CD1 4.38Å; L7-I11 WeakPolarHBondContact O-CD1 3.2Å; L7-I11 VanDerWaalsContact O-CG1 3.24Å; L7-I11 WeakPolarHBondContact O-CG1 3.43Å; L7-I11 PolarHBondContact O-N 3.48Å; L7-F28 HydrophobicContact CD2-CE1 4.34Å; L7-F28 HydrophobicContact CD2-CE2 4.36Å; L7-F28 HydrophobicContact CD2-CZ 3.75Å |
| 8 | E | 70.2 | Confident | 69.5 | Low | 141 Ų | 141 | 126.1 Ų | 126.1 | 66% | 0.659 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -61.3 | -42.2 | 177.5 | -72.9 | -166.4 | 142.5 | 0 | 0 | 112.1 | Y4 Q5 K10 I11 G12 | Y4-E8 PolarHBondContact O-N 2.94Å; Q5-E8 PolarHBondContact O-N 3.43Å; E8-K10 VanDerWaalsContact C-N 3.33Å; E8-K10 PolarHBondContact O-N 3.36Å; E8-I11 PolarHBondContact O-N 3.05Å; E8-G12 PolarHBondContact O-N 2.77Å |
| 9 | E | 71 | Confident | 70.1 | Confident | 150 Ų | 150 | 131.1 Ų | 131.1 | 70% | 0.701 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -62.8 | -39.2 | 176.4 | -166.8 | -176.5 | 174.8 | 0 | 0 | 112 | Q5 L7 N13 | Q5-E9 PolarHBondContact O-N 3.3Å; L7-E9 VanDerWaalsContact C-N 3.35Å; L7-E9 PolarHBondContact O-N 2.9Å; E9-N13 PolarHBondContact O-N 2.75Å |
| 10 | K | 67.3 | Low | 70.6 | Confident | 148 Ų | 148 | 127.6 Ų | 127.6 | 64% | 0.643 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -69.5 | -30.4 | 176 | -79.5 | 178.6 | -179.6 | 177.5 | 0 | 113.4 | K6 L7 E8 | K6-K10 WeakPolarHBondContact O-CG 3.31Å; K6-K10 PolarHBondContact O-N 3.31Å; L7-K10 PolarHBondContact O-N 2.9Å; E8-K10 VanDerWaalsContact C-N 3.33Å; E8-K10 PolarHBondContact O-N 3.36Å |
| 11 | I | 65.3 | Low | 71.2 | Confident | 53 Ų | 53 | 124.5 Ų | 124.5 | 27% | 0.272 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -80.6 | -39.7 | 179.1 | -66 | 162.4 | 0 | 0 | 0 | 110.3 | L7 E8 N13 R14 | L7-I11 HydrophobicContact CD2-CD1 4.38Å; L7-I11 WeakPolarHBondContact O-CD1 3.2Å; L7-I11 VanDerWaalsContact O-CG1 3.24Å; L7-I11 WeakPolarHBondContact O-CG1 3.43Å; L7-I11 PolarHBondContact O-N 3.48Å; E8-I11 PolarHBondContact O-N 3.05Å; I11-N13 PolarHBondContact O-N 2.03Å; I11-R14 PolarHBondContact O-N 2.84Å |
| 12 | G | 65.1 | Low | 72.1 | Confident | 71 Ų | 71 | 118.3 Ų | 118.3 | 73% | 0.732 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -64.3 | -24.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | E8 | E8-G12 PolarHBondContact O-N 2.77Å |
| 13 | N | 66.2 | Low | 72.8 | Confident | 149 Ų | 149 | 117.8 Ų | 117.8 | 80% | 0.797 | 60% | 0.595 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.9 | -1.6 | -179 | -149.5 | 16.5 | 0 | 0 | 0 | 114.2 | E9 I11 | E9-N13 PolarHBondContact O-N 2.75Å; I11-N13 PolarHBondContact O-N 2.03Å |
| 14 | R | 66.6 | Low | 73.3 | Confident | 183 Ų | 183 | 112.5 Ų | 112.5 | 69% | 0.691 | 57% | 0.574 | S | S | * | * | S | Bend | trans | -107.2 | 129.8 | 173 | -69.1 | -176.4 | -179 | -171 | 0 | 107.9 | I11 L16 | I11-R14 PolarHBondContact O-N 2.84Å; R14-L16 HydrophobicContact CB-CD1 4.17Å; R14-L16 PolarHBondContact O-N 3.33Å |
| 15 | N | 64.3 | Low | 74.3 | Confident | 182 Ų | 182 | 109.9 Ų | 109.9 | 97% | 0.973 | 57% | 0.574 | S | S | * | * | trans | -64.4 | 60.8 | 167.2 | -84.1 | -51.8 | 0 | 0 | 0 | 110.6 | ||||
| 16 | L | 64.6 | Low | 75.2 | Confident | 65 Ų | 65 | 107.7 Ų | 107.7 | 34% | 0.34 | 57% | 0.57 | S | S | . | * | trans | -71.7 | 131.5 | 172.8 | -126.2 | 70.3 | 0 | 0 | 0 | 106.9 | R14 T20 V21 | R14-L16 HydrophobicContact CB-CD1 4.17Å; R14-L16 PolarHBondContact O-N 3.33Å; L16-T20 HydrophobicContact CD2-CG2 3.48Å; L16-T20 VanDerWaalsContact CD2-CG2 3.48Å; L16-T20 HydrophobicContact CG-CG2 3.87Å; L16-V21 HydrophobicContact CB-CG2 3.92Å; L16-V21 HydrophobicContact CD2-CG2 4.46Å | ||
| 17 | A | 73.6 | Confident | 76 | Confident | 55 Ų | 55 | 104.3 Ų | 104.3 | 46% | 0.455 | 56% | 0.56 | S | S | . | * | trans | -51.4 | 139 | 177.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | R19 T20 V21 | A17-R19 PolarHBondContact O-N 2.98Å; A17-T20 WeakPolarHBondContact O-CA 3.45Å; A17-T20 WeakPolarHBondContact O-CB 3.3Å; A17-T20 PolarHBondContact O-N 3.45Å; A17-V21 PolarHBondContact O-N 2.87Å | ||
| 18 | P | 77.2 | Confident | 77 | Confident | 112 Ų | 112 | 104.9 Ų | 104.9 | 73% | 0.727 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -55.1 | -26.1 | -176.6 | 18.5 | -31.3 | 0 | 0 | 0 | 112.7 | A22 | P18-A22 WeakPolarHBondContact O-CB 3.37Å; P18-A22 PolarHBondContact O-N 3.43Å; P18-A22 VanDerWaalsContact O-N 3.1Å |
| 19 | R | 81 | Confident | 78.1 | Confident | 220 Ų | 220 | 101.2 Ų | 101.2 | 83% | 0.83 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -64.7 | -40 | 172.4 | -65.8 | -177.3 | 173.5 | 176.7 | -2.1 | 113.5 | A17 F23 | A17-R19 PolarHBondContact O-N 2.98Å; R19-F23 WeakPolarHBondContact O-CB 3.24Å; R19-F23 PolarHBondContact O-N 3.47Å |
| 20 | T | 80.3 | Confident | 79.2 | Confident | 61 Ų | 61 | 97.6 Ų | 97.6 | 37% | 0.374 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -70.1 | -41.5 | 179.4 | -48.8 | 0 | 0 | 0 | 0 | 110.8 | L16 A17 F23 C24 | L16-T20 HydrophobicContact CD2-CG2 3.48Å; L16-T20 VanDerWaalsContact CD2-CG2 3.48Å; L16-T20 HydrophobicContact CG-CG2 3.87Å; A17-T20 WeakPolarHBondContact O-CA 3.45Å; A17-T20 WeakPolarHBondContact O-CB 3.3Å; A17-T20 PolarHBondContact O-N 3.45Å; T20-F23 PolarHBondContact O-N 3.23Å; T20-C24 WeakPolarHBondContact O-CB 3.2Å; T20-C24 PolarHBondContact O-N 3.03Å; T20-C24 PolarHBondContact O-SG 3.17Å; T20-C24 VanDerWaalsContact O-SG 3.32Å |
| 21 | V | 81.4 | Confident | 80.4 | Confident | 64 Ų | 64 | 94.5 Ų | 94.5 | 39% | 0.388 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -61.9 | -45.5 | 175.7 | -177.3 | 0 | 0 | 0 | 0 | 110.7 | L16 A17 F23 C24 S25 | L16-V21 HydrophobicContact CB-CG2 3.92Å; L16-V21 HydrophobicContact CD2-CG2 4.46Å; A17-V21 PolarHBondContact O-N 2.87Å; V21-F23 PolarHBondContact O-N 3.05Å; V21-C24 PolarHBondContact O-N 2.93Å; V21-S25 WeakPolarHBondContact O-CB 2.96Å; V21-S25 PolarHBondContact O-N 3.05Å |
| 22 | A | 85 | Confident | 81.8 | Confident | 58 Ų | 58 | 93.8 Ų | 93.8 | 48% | 0.479 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -60.5 | -45.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | P18 S25 V26 | P18-A22 WeakPolarHBondContact O-CB 3.37Å; P18-A22 PolarHBondContact O-N 3.43Å; P18-A22 VanDerWaalsContact O-N 3.1Å; A22-S25 PolarHBondContact O-N 3.33Å; A22-V26 WeakPolarHBondContact O-CG2 3.43Å; A22-V26 PolarHBondContact O-N 3.16Å; A22-V26 VanDerWaalsContact O-N 3.08Å |
| 23 | F | 88.3 | Confident | 83.2 | Confident | 145 Ų | 145 | 94.5 Ų | 94.5 | 64% | 0.636 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63 | -46.8 | 177.6 | -175.5 | -98.5 | 0 | 0 | 0 | 112.1 | R19 T20 V21 S25 V26 V27 | R19-F23 WeakPolarHBondContact O-CB 3.24Å; R19-F23 PolarHBondContact O-N 3.47Å; T20-F23 PolarHBondContact O-N 3.23Å; V21-F23 PolarHBondContact O-N 3.05Å; F23-S25 VanDerWaalsContact C-N 3.34Å; F23-S25 PolarHBondContact O-N 2.91Å; F23-V26 PolarHBondContact O-N 3.48Å; F23-V27 HydrophobicContact CD1-CG2 4.08Å; F23-V27 HydrophobicContact CE1-CG2 3.7Å; F23-V27 HydrophobicContact CE2-CG2 4.34Å; F23-V27 HydrophobicContact CZ-CG2 3.84Å; F23-V27 WeakPolarHBondContact O-CG2 3.38Å; F23-V27 PolarHBondContact O-N 3.21Å |
| 24 | C | 86.7 | Confident | 84.4 | Confident | 39 Ų | 39 | 91 Ų | 91 | 26% | 0.264 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.1 | -44.5 | 176.3 | -72.5 | 0 | 0 | 0 | 0 | 111.5 | T20 V21 V26 V27 F28 | T20-C24 WeakPolarHBondContact O-CB 3.2Å; T20-C24 PolarHBondContact O-N 3.03Å; T20-C24 PolarHBondContact O-SG 3.17Å; T20-C24 VanDerWaalsContact O-SG 3.32Å; V21-C24 PolarHBondContact O-N 2.93Å; C24-V26 VanDerWaalsContact C-N 3.32Å; C24-V26 PolarHBondContact O-N 3.15Å; C24-V27 PolarHBondContact O-N 3.46Å; C24-F28 HydrophobicContact CB-CD2 4.31Å; C24-F28 HydrophobicContact CB-CE2 4.21Å; C24-F28 WeakPolarHBondContact O-CD2 3.4Å; C24-F28 PolarHBondContact O-N 3.38Å |
| 25 | S | 87.4 | Confident | 85.7 | Confident | 70 Ų | 70 | 84.6 Ų | 84.6 | 49% | 0.49 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.3 | -42 | 177.6 | -173.7 | 0 | 0 | 0 | 0 | 112.5 | V21 A22 F23 S29 | V21-S25 WeakPolarHBondContact O-CB 2.96Å; V21-S25 PolarHBondContact O-N 3.05Å; A22-S25 PolarHBondContact O-N 3.33Å; F23-S25 VanDerWaalsContact C-N 3.34Å; F23-S25 PolarHBondContact O-N 2.91Å; S25-S29 WeakPolarHBondContact O-CB 3.14Å; S25-S29 PolarHBondContact O-N 3.35Å; S25-S29 PolarHBondContact O-OG 2.77Å |
| 26 | V | 92.4 | Very high | 87.2 | Confident | 91 Ų | 91 | 78.8 Ų | 78.8 | 55% | 0.552 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -66.2 | -45.5 | 177.5 | 174.1 | 0 | 0 | 0 | 0 | 110.3 | A22 F23 C24 S29 T30 | A22-V26 WeakPolarHBondContact O-CG2 3.43Å; A22-V26 PolarHBondContact O-N 3.16Å; A22-V26 VanDerWaalsContact O-N 3.08Å; F23-V26 PolarHBondContact O-N 3.48Å; C24-V26 VanDerWaalsContact C-N 3.32Å; C24-V26 PolarHBondContact O-N 3.15Å; V26-S29 PolarHBondContact O-N 3.03Å; V26-T30 HydrophobicContact CG1-CG2 4.41Å; V26-T30 WeakPolarHBondContact O-CG2 3.36Å; V26-T30 PolarHBondContact O-N 3.32Å; V26-T30 PolarHBondContact O-OG1 3.3Å |
| 27 | V | 92.6 | Very high | 88.5 | Confident | 58 Ų | 58 | 81.3 Ų | 81.3 | 35% | 0.352 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -63.5 | -43.7 | 179.5 | 174.2 | 0 | 0 | 0 | 0 | 111.9 | F23 C24 S29 T30 V31 | F23-V27 HydrophobicContact CD1-CG2 4.08Å; F23-V27 HydrophobicContact CE1-CG2 3.7Å; F23-V27 HydrophobicContact CE2-CG2 4.34Å; F23-V27 HydrophobicContact CZ-CG2 3.84Å; F23-V27 WeakPolarHBondContact O-CG2 3.38Å; F23-V27 PolarHBondContact O-N 3.21Å; C24-V27 PolarHBondContact O-N 3.46Å; V27-S29 VanDerWaalsContact C-N 3.32Å; V27-S29 PolarHBondContact O-N 3.47Å; V27-T30 WeakPolarHBondContact CA-OG1 3.31Å; V27-T30 PolarHBondContact O-N 3.28Å; V27-T30 PolarHBondContact O-OG1 3.5Å; V27-V31 HydrophobicContact CG1-CG2 4.41Å; V27-V31 WeakPolarHBondContact O-CB 3.28Å; V27-V31 VanDerWaalsContact O-CG2 3.25Å; V27-V31 WeakPolarHBondContact O-CG2 3.49Å; V27-V31 PolarHBondContact O-N 3.34Å |
| 28 | F | 90.1 | Very high | 89.4 | Confident | 88 Ų | 88 | 84.6 Ų | 84.6 | 39% | 0.386 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.8 | -38.2 | 176.4 | -76.9 | -62.7 | 0 | 0 | 0 | 112.1 | L7 C24 A32 | L7-F28 HydrophobicContact CD2-CE1 4.34Å; L7-F28 HydrophobicContact CD2-CE2 4.36Å; L7-F28 HydrophobicContact CD2-CZ 3.75Å; C24-F28 HydrophobicContact CB-CD2 4.31Å; C24-F28 HydrophobicContact CB-CE2 4.21Å; C24-F28 WeakPolarHBondContact O-CD2 3.4Å; C24-F28 PolarHBondContact O-N 3.38Å; F28-A32 VanDerWaalsContact O-CB 3.29Å; F28-A32 WeakPolarHBondContact O-CB 3.25Å; F28-A32 PolarHBondContact O-N 3.37Å |
| 29 | S | 92.6 | Very high | 90.2 | Very high | 64 Ų | 64 | 82.4 Ų | 82.4 | 45% | 0.448 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -66.8 | -42.6 | 177.5 | -57.1 | 0 | 0 | 0 | 0 | 111.6 | S25 V26 V27 A32 V33 | S25-S29 WeakPolarHBondContact O-CB 3.14Å; S25-S29 PolarHBondContact O-N 3.35Å; S25-S29 PolarHBondContact O-OG 2.77Å; V26-S29 PolarHBondContact O-N 3.03Å; V27-S29 VanDerWaalsContact C-N 3.32Å; V27-S29 PolarHBondContact O-N 3.47Å; S29-A32 PolarHBondContact O-N 3.47Å; S29-V33 WeakPolarHBondContact O-CB 3.41Å; S29-V33 VanDerWaalsContact O-CG2 3.24Å; S29-V33 WeakPolarHBondContact O-CG2 3.29Å; S29-V33 PolarHBondContact O-N 3.41Å |
| 30 | T | 94.1 | Very high | 90.8 | Very high | 73 Ų | 73 | 78.6 Ų | 78.6 | 45% | 0.448 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -67.7 | -40.2 | 178 | 53.1 | 0 | 0 | 0 | 0 | 112 | V26 V27 V33 T34 | V26-T30 HydrophobicContact CG1-CG2 4.41Å; V26-T30 WeakPolarHBondContact O-CG2 3.36Å; V26-T30 PolarHBondContact O-N 3.32Å; V26-T30 PolarHBondContact O-OG1 3.3Å; V27-T30 WeakPolarHBondContact CA-OG1 3.31Å; V27-T30 PolarHBondContact O-N 3.28Å; V27-T30 PolarHBondContact O-OG1 3.5Å; T30-V33 PolarHBondContact O-N 3.13Å; T30-T34 WeakPolarHBondContact O-CB 3.49Å; T30-T34 VanDerWaalsContact O-CG2 3.3Å; T30-T34 WeakPolarHBondContact O-CG2 3.35Å; T30-T34 PolarHBondContact O-N 3.14Å; T30-T34 PolarHBondContact O-OG1 3.45Å |
| 31 | V | 94.4 | Very high | 91.3 | Very high | 83 Ų | 83 | 79.5 Ų | 79.5 | 50% | 0.503 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -64.2 | -43.3 | 174.5 | 173.5 | 0 | 0 | 0 | 0 | 111.2 | V27 T34 A35 | V27-V31 HydrophobicContact CG1-CG2 4.41Å; V27-V31 WeakPolarHBondContact O-CB 3.28Å; V27-V31 VanDerWaalsContact O-CG2 3.25Å; V27-V31 WeakPolarHBondContact O-CG2 3.49Å; V27-V31 PolarHBondContact O-N 3.34Å; V31-T34 WeakPolarHBondContact CA-OG1 3.4Å; V31-T34 PolarHBondContact O-N 3.43Å; V31-T34 PolarHBondContact O-OG1 3.23Å; V31-A35 VanDerWaalsContact O-CB 3.29Å; V31-A35 WeakPolarHBondContact O-CB 3.38Å; V31-A35 PolarHBondContact O-N 2.71Å |
| 32 | A | 93 | Very high | 91.8 | Very high | 39 Ų | 39 | 82.3 Ų | 82.3 | 32% | 0.322 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -63.5 | -45.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | F28 S29 A35 C36 | F28-A32 VanDerWaalsContact O-CB 3.29Å; F28-A32 WeakPolarHBondContact O-CB 3.25Å; F28-A32 PolarHBondContact O-N 3.37Å; S29-A32 PolarHBondContact O-N 3.47Å; A32-A35 PolarHBondContact O-N 3.08Å; A32-C36 WeakPolarHBondContact O-CB 3.45Å; A32-C36 PolarHBondContact O-N 2.06Å; A32-C36 PolarHBondContact O-SG 3.32Å |
| 33 | V | 94.7 | Very high | 92.1 | Very high | 85 Ų | 85 | 84.3 Ų | 84.3 | 52% | 0.515 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64.2 | -44.1 | 178.5 | 172 | 0 | 0 | 0 | 0 | 111.1 | S29 T30 C36 L37 | S29-V33 WeakPolarHBondContact O-CB 3.41Å; S29-V33 VanDerWaalsContact O-CG2 3.24Å; S29-V33 WeakPolarHBondContact O-CG2 3.29Å; S29-V33 PolarHBondContact O-N 3.41Å; T30-V33 PolarHBondContact O-N 3.13Å; V33-C36 PolarHBondContact O-N 3.4Å; V33-L37 HydrophobicContact CG1-CD1 3.89Å; V33-L37 HydrophobicContact CG1-CG 4.3Å; V33-L37 WeakPolarHBondContact O-CB 3.41Å; V33-L37 VanDerWaalsContact O-CG 3.28Å; V33-L37 WeakPolarHBondContact O-CG 3.06Å; V33-L37 PolarHBondContact O-N 3.47Å |
| 34 | T | 93.1 | Very high | 92.3 | Very high | 76 Ų | 76 | 83.5 Ų | 83.5 | 47% | 0.466 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -65.6 | -41.1 | 178 | 49.2 | 0 | 0 | 0 | 0 | 112.3 | T30 V31 C36 L37 L38 | T30-T34 WeakPolarHBondContact O-CB 3.49Å; T30-T34 VanDerWaalsContact O-CG2 3.3Å; T30-T34 WeakPolarHBondContact O-CG2 3.35Å; T30-T34 PolarHBondContact O-N 3.14Å; T30-T34 PolarHBondContact O-OG1 3.45Å; V31-T34 WeakPolarHBondContact CA-OG1 3.4Å; V31-T34 PolarHBondContact O-N 3.43Å; V31-T34 PolarHBondContact O-OG1 3.23Å; T34-C36 PolarHBondContact O-N 3.42Å; T34-L37 PolarHBondContact O-N 3.28Å; T34-L38 VanDerWaalsContact O-CG 3.31Å; T34-L38 WeakPolarHBondContact O-CG 3.43Å; T34-L38 PolarHBondContact O-N 2.81Å |
| 35 | A | 93.7 | Very high | 92.5 | Very high | 49 Ų | 49 | 87.3 Ų | 87.3 | 41% | 0.405 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.4 | -42.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112 | V31 A32 L38 T39 | V31-A35 VanDerWaalsContact O-CB 3.29Å; V31-A35 WeakPolarHBondContact O-CB 3.38Å; V31-A35 PolarHBondContact O-N 2.71Å; A32-A35 PolarHBondContact O-N 3.08Å; A35-L38 PolarHBondContact O-N 2.78Å; A35-T39 WeakPolarHBondContact O-CB 3.24Å; A35-T39 VanDerWaalsContact O-CG2 3.29Å; A35-T39 WeakPolarHBondContact O-CG2 3.42Å; A35-T39 PolarHBondContact O-N 2.96Å; A35-T39 PolarHBondContact O-OG1 3.12Å |
| 36 | C | 94.2 | Very high | 92.7 | Very high | 59 Ų | 59 | 91 Ų | 91 | 40% | 0.399 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.7 | -49.9 | 173.4 | -74 | 0 | 0 | 0 | 0 | 111.3 | A32 V33 T34 L38 T39 F40 | A32-C36 WeakPolarHBondContact O-CB 3.45Å; A32-C36 PolarHBondContact O-N 2.06Å; A32-C36 PolarHBondContact O-SG 3.32Å; V33-C36 PolarHBondContact O-N 3.4Å; T34-C36 PolarHBondContact O-N 3.42Å; C36-L38 PolarHBondContact O-N 2.83Å; C36-T39 WeakPolarHBondContact CA-OG1 3.31Å; C36-T39 PolarHBondContact O-N 2.72Å; C36-T39 PolarHBondContact O-OG1 3.14Å; C36-F40 HydrophobicContact CB-CD2 4.08Å; C36-F40 HydrophobicContact CB-CE2 4.03Å; C36-F40 WeakPolarHBondContact O-CB 3.18Å; C36-F40 WeakPolarHBondContact O-CD2 3.39Å; C36-F40 PolarHBondContact O-N 2.99Å |
| 37 | L | 93.7 | Very high | 92.7 | Very high | 118 Ų | 118 | 90 Ų | 90 | 62% | 0.618 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -62.4 | -28.4 | -179.1 | -70.6 | 175.1 | 0 | 0 | 0 | 113.4 | V33 T34 P41 | V33-L37 HydrophobicContact CG1-CD1 3.89Å; V33-L37 HydrophobicContact CG1-CG 4.3Å; V33-L37 WeakPolarHBondContact O-CB 3.41Å; V33-L37 VanDerWaalsContact O-CG 3.28Å; V33-L37 WeakPolarHBondContact O-CG 3.06Å; V33-L37 PolarHBondContact O-N 3.47Å; T34-L37 PolarHBondContact O-N 3.28Å; L37-P41 WeakPolarHBondContact O-CD 3.44Å; L37-P41 VanDerWaalsContact O-CG 3.3Å; L37-P41 WeakPolarHBondContact O-CG 3.46Å |
| 38 | L | 92.4 | Very high | 92.5 | Very high | 125 Ų | 125 | 91.5 Ų | 91.5 | 65% | 0.654 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -82.1 | -38.3 | 174.9 | -69.1 | 171.1 | 0 | 0 | 0 | 112.8 | T34 A35 C36 L42 | T34-L38 VanDerWaalsContact O-CG 3.31Å; T34-L38 WeakPolarHBondContact O-CG 3.43Å; T34-L38 PolarHBondContact O-N 2.81Å; A35-L38 PolarHBondContact O-N 2.78Å; C36-L38 PolarHBondContact O-N 2.83Å; L38-L42 WeakPolarHBondContact O-CD1 3.22Å; L38-L42 WeakPolarHBondContact O-CG 3.5Å |
| 39 | T | 93 | Very high | 92.4 | Very high | 65 Ų | 65 | 90.8 Ų | 90.8 | 40% | 0.399 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -78.7 | -36.2 | -176.5 | 50.7 | 0 | 0 | 0 | 0 | 113 | A35 C36 L42 I43 | A35-T39 WeakPolarHBondContact O-CB 3.24Å; A35-T39 VanDerWaalsContact O-CG2 3.29Å; A35-T39 WeakPolarHBondContact O-CG2 3.42Å; A35-T39 PolarHBondContact O-N 2.96Å; A35-T39 PolarHBondContact O-OG1 3.12Å; C36-T39 WeakPolarHBondContact CA-OG1 3.31Å; C36-T39 PolarHBondContact O-N 2.72Å; C36-T39 PolarHBondContact O-OG1 3.14Å; T39-L42 PolarHBondContact O-N 3.04Å; T39-I43 WeakPolarHBondContact O-CB 3.16Å; T39-I43 VanDerWaalsContact O-CG1 3.26Å; T39-I43 WeakPolarHBondContact O-CG1 3.43Å; T39-I43 PolarHBondContact O-N 3.21Å |
| 40 | F | 92.9 | Very high | 92.2 | Very high | 141 Ų | 141 | 91.2 Ų | 91.2 | 62% | 0.618 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -57.3 | -49.2 | -179.6 | -88.8 | -68.9 | 0 | 0 | 0 | 113.3 | C36 L42 I43 F44 | C36-F40 HydrophobicContact CB-CD2 4.08Å; C36-F40 HydrophobicContact CB-CE2 4.03Å; C36-F40 WeakPolarHBondContact O-CB 3.18Å; C36-F40 WeakPolarHBondContact O-CD2 3.39Å; C36-F40 PolarHBondContact O-N 2.99Å; F40-L42 PolarHBondContact O-N 3.29Å; F40-I43 PolarHBondContact O-N 2.67Å; F40-F44 WeakPolarHBondContact O-CB 3.33Å; F40-F44 PolarHBondContact O-N 3.2Å |
| 41 | P | 92.6 | Very high | 91.8 | Very high | 79 Ų | 79 | 92.7 Ų | 92.7 | 51% | 0.513 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.3 | -37.4 | 176.8 | -22.5 | 33.7 | 0 | 0 | 0 | 113.2 | L37 F44 H45 | L37-P41 WeakPolarHBondContact O-CD 3.44Å; L37-P41 VanDerWaalsContact O-CG 3.3Å; L37-P41 WeakPolarHBondContact O-CG 3.46Å; P41-F44 PolarHBondContact O-N 3.3Å; P41-H45 VanDerWaalsContact O-CB 3.32Å; P41-H45 WeakPolarHBondContact O-CB 3.38Å; P41-H45 PolarHBondContact O-N 3.18Å |
| 42 | L | 90.4 | Very high | 91.2 | Very high | 124 Ų | 124 | 94.3 Ų | 94.3 | 65% | 0.649 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -65.3 | -44.4 | 177.5 | -71.1 | 172.6 | 0 | 0 | 0 | 111.6 | L38 T39 F40 H45 Y46 | L38-L42 WeakPolarHBondContact O-CD1 3.22Å; L38-L42 WeakPolarHBondContact O-CG 3.5Å; T39-L42 PolarHBondContact O-N 3.04Å; F40-L42 PolarHBondContact O-N 3.29Å; L42-H45 PolarHBondContact O-N 2.89Å; L42-Y46 VanDerWaalsContact O-CB 3.27Å; L42-Y46 WeakPolarHBondContact O-CB 3.42Å; L42-Y46 PolarHBondContact O-N 3.29Å |
| 43 | I | 92.4 | Very high | 90.6 | Very high | 99 Ų | 99 | 95.3 Ų | 95.3 | 51% | 0.508 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.3 | -43.6 | 176.1 | -66 | 165.6 | 0 | 0 | 0 | 109.9 | T39 F40 Y46 V47 | T39-I43 WeakPolarHBondContact O-CB 3.16Å; T39-I43 VanDerWaalsContact O-CG1 3.26Å; T39-I43 WeakPolarHBondContact O-CG1 3.43Å; T39-I43 PolarHBondContact O-N 3.21Å; F40-I43 PolarHBondContact O-N 2.67Å; I43-Y46 PolarHBondContact O-N 2.99Å; I43-V47 HydrophobicContact CG2-CG2 4.31Å; I43-V47 VanDerWaalsContact O-CG2 3.3Å; I43-V47 WeakPolarHBondContact O-CG2 3.25Å; I43-V47 PolarHBondContact O-N 3.22Å |
| 44 | F | 92.5 | Very high | 90.1 | Very high | 129 Ų | 129 | 95 Ų | 95 | 57% | 0.566 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.4 | -46.3 | 177.8 | -174.4 | -102.1 | 0 | 0 | 0 | 111.8 | F40 P41 Y46 V47 Q48 | F40-F44 WeakPolarHBondContact O-CB 3.33Å; F40-F44 PolarHBondContact O-N 3.2Å; P41-F44 PolarHBondContact O-N 3.3Å; F44-Y46 PolarHBondContact O-N 3.44Å; F44-V47 PolarHBondContact O-N 2.96Å; F44-Q48 HydrophobicContact CD1-CG 4.29Å; F44-Q48 HydrophobicContact CE1-CG 4.04Å; F44-Q48 HydrophobicContact CZ-CG 4.24Å; F44-Q48 WeakPolarHBondContact O-CB 3.39Å; F44-Q48 WeakPolarHBondContact O-CG 3.35Å; F44-Q48 PolarHBondContact O-N 3.42Å |
| 45 | H | 90.3 | Very high | 89.4 | Confident | 119 Ų | 119 | 95.5 Ų | 95.5 | 55% | 0.551 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -62.1 | -42.5 | 175.2 | -175.4 | -89.9 | 0 | 0 | 0 | 111.7 | P41 L42 Q48 V49 | P41-H45 VanDerWaalsContact O-CB 3.32Å; P41-H45 WeakPolarHBondContact O-CB 3.38Å; P41-H45 PolarHBondContact O-N 3.18Å; L42-H45 PolarHBondContact O-N 2.89Å; H45-Q48 PolarHBondContact O-N 3.36Å; H45-V49 WeakPolarHBondContact O-CG2 3.47Å; H45-V49 PolarHBondContact O-N 2.98Å |
| 46 | Y | 91.4 | Very high | 88.6 | Confident | 147 Ų | 147 | 94.8 Ų | 94.8 | 58% | 0.576 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -61.2 | -45.9 | 176.1 | -179.8 | -105.6 | 0 | 0 | 0 | 112.1 | L42 I43 F44 V49 L50 | L42-Y46 VanDerWaalsContact O-CB 3.27Å; L42-Y46 WeakPolarHBondContact O-CB 3.42Å; L42-Y46 PolarHBondContact O-N 3.29Å; I43-Y46 PolarHBondContact O-N 2.99Å; F44-Y46 PolarHBondContact O-N 3.44Å; Y46-V49 PolarHBondContact O-N 2.89Å; Y46-L50 HydrophobicContact CD1-CD1 3.78Å; Y46-L50 HydrophobicContact CD1-CG 4.42Å; Y46-L50 HydrophobicContact CE1-CD1 3.25Å; Y46-L50 HydrophobicContact CE1-CG 4.07Å; Y46-L50 HydrophobicContact CE2-CD1 4.39Å; Y46-L50 HydrophobicContact CE2-CG 4.39Å; Y46-L50 WeakPolarHBondContact O-CB 3.06Å; Y46-L50 WeakPolarHBondContact O-CG 3.49Å; Y46-L50 PolarHBondContact O-N 3.49Å |
| 47 | V | 92.6 | Very high | 87.7 | Confident | 69 Ų | 69 | 97.7 Ų | 97.7 | 42% | 0.418 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64 | -40.7 | 176.3 | 173.6 | 0 | 0 | 0 | 0 | 110.8 | I43 F44 L50 Q51 | I43-V47 HydrophobicContact CG2-CG2 4.31Å; I43-V47 VanDerWaalsContact O-CG2 3.3Å; I43-V47 WeakPolarHBondContact O-CG2 3.25Å; I43-V47 PolarHBondContact O-N 3.22Å; F44-V47 PolarHBondContact O-N 2.96Å; V47-L50 PolarHBondContact O-N 3.3Å; V47-Q51 HydrophobicContact CG1-CG 4.29Å; V47-Q51 WeakPolarHBondContact O-CB 3.46Å; V47-Q51 VanDerWaalsContact O-CG 3.25Å; V47-Q51 WeakPolarHBondContact O-CG 3.25Å; V47-Q51 PolarHBondContact O-N 2.91Å |
| 48 | Q | 88.8 | Confident | 87 | Confident | 90 Ų | 90 | 95.8 Ų | 95.8 | 42% | 0.421 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62 | -45.1 | 175.5 | -76.4 | -175.1 | -38.4 | 0 | 0 | 112.4 | F44 H45 L50 Q51 L52 | F44-Q48 HydrophobicContact CD1-CG 4.29Å; F44-Q48 HydrophobicContact CE1-CG 4.04Å; F44-Q48 HydrophobicContact CZ-CG 4.24Å; F44-Q48 WeakPolarHBondContact O-CB 3.39Å; F44-Q48 WeakPolarHBondContact O-CG 3.35Å; F44-Q48 PolarHBondContact O-N 3.42Å; H45-Q48 PolarHBondContact O-N 3.36Å; Q48-L50 VanDerWaalsContact C-N 3.34Å; Q48-L50 PolarHBondContact O-N 2.91Å; Q48-Q51 PolarHBondContact O-N 3.5Å; Q48-L52 WeakPolarHBondContact O-CB 3.44Å; Q48-L52 WeakPolarHBondContact O-CG 3.38Å; Q48-L52 PolarHBondContact O-N 3.15Å |
| 49 | V | 87.6 | Confident | 86.1 | Confident | 73 Ų | 73 | 93.7 Ų | 93.7 | 44% | 0.442 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -63.1 | -41.4 | 176.2 | 171.3 | 0 | 0 | 0 | 0 | 111 | H45 Y46 L52 S53 | H45-V49 WeakPolarHBondContact O-CG2 3.47Å; H45-V49 PolarHBondContact O-N 2.98Å; Y46-V49 PolarHBondContact O-N 2.89Å; V49-L52 PolarHBondContact O-N 3.4Å; V49-S53 VanDerWaalsContact O-CB 3.29Å; V49-S53 WeakPolarHBondContact O-CB 3.23Å; V49-S53 PolarHBondContact O-N 2.97Å |
| 50 | L | 88.9 | Confident | 85.1 | Confident | 73 Ų | 73 | 94.9 Ų | 94.9 | 38% | 0.382 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.8 | -43.2 | 173.9 | -76.8 | 178.9 | 0 | 0 | 0 | 112.1 | Y46 V47 Q48 S53 V54 | Y46-L50 HydrophobicContact CD1-CD1 3.78Å; Y46-L50 HydrophobicContact CD1-CG 4.42Å; Y46-L50 HydrophobicContact CE1-CD1 3.25Å; Y46-L50 HydrophobicContact CE1-CG 4.07Å; Y46-L50 HydrophobicContact CE2-CD1 4.39Å; Y46-L50 HydrophobicContact CE2-CG 4.39Å; Y46-L50 WeakPolarHBondContact O-CB 3.06Å; Y46-L50 WeakPolarHBondContact O-CG 3.49Å; Y46-L50 PolarHBondContact O-N 3.49Å; V47-L50 PolarHBondContact O-N 3.3Å; Q48-L50 VanDerWaalsContact C-N 3.34Å; Q48-L50 PolarHBondContact O-N 2.91Å; L50-S53 PolarHBondContact O-N 3.27Å; L50-V54 WeakPolarHBondContact O-CB 3.39Å; L50-V54 VanDerWaalsContact O-CG2 3.25Å; L50-V54 WeakPolarHBondContact O-CG2 3.15Å; L50-V54 PolarHBondContact O-N 3.42Å |
| 51 | Q | 85 | Confident | 84.3 | Confident | 104 Ų | 104 | 91.9 Ų | 91.9 | 49% | 0.486 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.4 | -46.6 | 176.3 | -72.6 | -69.4 | -43.7 | 0 | 0 | 110.9 | V47 Q48 S53 V54 Q55 | V47-Q51 HydrophobicContact CG1-CG 4.29Å; V47-Q51 WeakPolarHBondContact O-CB 3.46Å; V47-Q51 VanDerWaalsContact O-CG 3.25Å; V47-Q51 WeakPolarHBondContact O-CG 3.25Å; V47-Q51 PolarHBondContact O-N 2.91Å; Q48-Q51 PolarHBondContact O-N 3.5Å; Q51-S53 PolarHBondContact O-N 2.93Å; Q51-V54 PolarHBondContact O-N 2.86Å; Q51-Q55 VanDerWaalsContact O-CB 3.23Å; Q51-Q55 WeakPolarHBondContact O-CB 3.47Å; Q51-Q55 VanDerWaalsContact O-CD 3.23Å; Q51-Q55 WeakPolarHBondContact O-CG 3.39Å; Q51-Q55 PolarHBondContact O-N 2.94Å; Q51-Q55 PolarHBondContact O-OE1 3.5Å |
| 52 | L | 82.6 | Confident | 83.6 | Confident | 117 Ų | 117 | 93.4 Ų | 93.4 | 61% | 0.613 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -62.4 | -42.1 | 177.1 | -72.8 | 169.8 | 0 | 0 | 0 | 112.1 | Q48 V49 Q55 G56 | Q48-L52 WeakPolarHBondContact O-CB 3.44Å; Q48-L52 WeakPolarHBondContact O-CG 3.38Å; Q48-L52 PolarHBondContact O-N 3.15Å; V49-L52 PolarHBondContact O-N 3.4Å; L52-Q55 PolarHBondContact O-N 2.91Å; L52-G56 PolarHBondContact O-N 3.4Å |
| 53 | S | 80.7 | Confident | 82.7 | Confident | 61 Ų | 61 | 92.9 Ų | 92.9 | 43% | 0.427 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.8 | -46.9 | 176.8 | 175.6 | 0 | 0 | 0 | 0 | 111.5 | V49 L50 Q51 G56 E57 | V49-S53 VanDerWaalsContact O-CB 3.29Å; V49-S53 WeakPolarHBondContact O-CB 3.23Å; V49-S53 PolarHBondContact O-N 2.97Å; L50-S53 PolarHBondContact O-N 3.27Å; Q51-S53 PolarHBondContact O-N 2.93Å; S53-G56 PolarHBondContact O-N 3.05Å; S53-E57 WeakPolarHBondContact O-CG 3.3Å; S53-E57 PolarHBondContact O-N 3.43Å |
| 54 | V | 84.1 | Confident | 81.8 | Confident | 77 Ų | 77 | 95.2 Ų | 95.2 | 47% | 0.467 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -66.9 | -38.4 | 177.8 | 172.7 | 0 | 0 | 0 | 0 | 111.3 | L50 Q51 E57 I58 | L50-V54 WeakPolarHBondContact O-CB 3.39Å; L50-V54 VanDerWaalsContact O-CG2 3.25Å; L50-V54 WeakPolarHBondContact O-CG2 3.15Å; L50-V54 PolarHBondContact O-N 3.42Å; Q51-V54 PolarHBondContact O-N 2.86Å; V54-E57 PolarHBondContact O-N 3.39Å; V54-I58 HydrophobicContact CG1-CD1 3.81Å; V54-I58 HydrophobicContact CG1-CG1 4.43Å; V54-I58 WeakPolarHBondContact O-CD1 3.31Å; V54-I58 WeakPolarHBondContact O-CG1 3.49Å; V54-I58 PolarHBondContact O-N 2.86Å |
| 55 | Q | 77.5 | Confident | 81.1 | Confident | 88 Ų | 88 | 92.3 Ų | 92.3 | 41% | 0.411 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -65.3 | -41.7 | 175.4 | -75.4 | 157.3 | -8.5 | 0 | 0 | 111.6 | Q51 L52 E57 I58 D59 | Q51-Q55 VanDerWaalsContact O-CB 3.23Å; Q51-Q55 WeakPolarHBondContact O-CB 3.47Å; Q51-Q55 VanDerWaalsContact O-CD 3.23Å; Q51-Q55 WeakPolarHBondContact O-CG 3.39Å; Q51-Q55 PolarHBondContact O-N 2.94Å; Q51-Q55 PolarHBondContact O-OE1 3.5Å; L52-Q55 PolarHBondContact O-N 2.91Å; Q55-E57 PolarHBondContact O-N 3.17Å; Q55-I58 PolarHBondContact O-N 2.96Å; Q55-D59 WeakPolarHBondContact O-CB 3.45Å; Q55-D59 PolarHBondContact O-N 3.05Å |
| 56 | G | 76.4 | Confident | 80.4 | Confident | 34 Ų | 34 | 93.9 Ų | 93.9 | 35% | 0.351 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.9 | -41.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | L52 S53 D59 T60 | L52-G56 PolarHBondContact O-N 3.4Å; S53-G56 PolarHBondContact O-N 3.05Å; G56-D59 PolarHBondContact O-N 3Å; G56-T60 WeakPolarHBondContact O-CB 3.29Å; G56-T60 PolarHBondContact O-N 3.39Å; G56-T60 PolarHBondContact O-OG1 3.49Å |
| 57 | E | 77 | Confident | 79.6 | Confident | 119 Ų | 119 | 91.3 Ų | 91.3 | 56% | 0.556 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -63.9 | -44.4 | 172.9 | -72.9 | -72.1 | 158.5 | 0 | 0 | 111.9 | S53 V54 Q55 D59 T60 C61 | S53-E57 WeakPolarHBondContact O-CG 3.3Å; S53-E57 PolarHBondContact O-N 3.43Å; V54-E57 PolarHBondContact O-N 3.39Å; Q55-E57 PolarHBondContact O-N 3.17Å; E57-D59 PolarHBondContact O-N 3Å; E57-T60 PolarHBondContact O-N 3.01Å; E57-C61 WeakPolarHBondContact O-CB 3.25Å; E57-C61 PolarHBondContact O-N 2.59Å |
| 58 | I | 78.5 | Confident | 78.6 | Confident | 79 Ų | 79 | 90.5 Ų | 90.5 | 41% | 0.405 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -62.2 | -44.2 | 177 | -70.5 | 165.4 | 0 | 0 | 0 | 110.9 | V54 Q55 C61 K62 | V54-I58 HydrophobicContact CG1-CD1 3.81Å; V54-I58 HydrophobicContact CG1-CG1 4.43Å; V54-I58 WeakPolarHBondContact O-CD1 3.31Å; V54-I58 WeakPolarHBondContact O-CG1 3.49Å; V54-I58 PolarHBondContact O-N 2.86Å; Q55-I58 PolarHBondContact O-N 2.96Å; I58-C61 WeakPolarHBondContact O-CB 3.27Å; I58-C61 PolarHBondContact O-N 3.07Å; I58-K62 HydrophobicContact CG2-CD 4.23Å; I58-K62 HydrophobicContact CG2-CG 4.5Å; I58-K62 WeakPolarHBondContact O-CG 3.26Å; I58-K62 PolarHBondContact O-N 3.37Å |
| 59 | D | 73 | Confident | 78 | Confident | 80 Ų | 80 | 94.9 Ų | 94.9 | 43% | 0.428 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -69.9 | -36.9 | -179 | -72.7 | -22.8 | 0 | 0 | 0 | 111.6 | Q55 G56 E57 C61 K62 L63 | Q55-D59 WeakPolarHBondContact O-CB 3.45Å; Q55-D59 PolarHBondContact O-N 3.05Å; G56-D59 PolarHBondContact O-N 3Å; E57-D59 PolarHBondContact O-N 3Å; D59-C61 VanDerWaalsContact C-N 3.33Å; D59-C61 PolarHBondContact O-N 3.47Å; D59-K62 PolarHBondContact O-N 2.91Å; D59-K62 IonicContact OD1-NZ 3.52Å; D59-L63 VanDerWaalsContact O-CD1 3.25Å; D59-L63 WeakPolarHBondContact O-CD1 2.92Å; D59-L63 PolarHBondContact O-N 2.88Å |
| 60 | T | 73 | Confident | 77.5 | Confident | 90 Ų | 90 | 97.8 Ų | 97.8 | 55% | 0.552 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -60.3 | -44.2 | 170.3 | -58.1 | 0 | 0 | 0 | 0 | 111 | G56 E57 K62 L63 R64 | G56-T60 WeakPolarHBondContact O-CB 3.29Å; G56-T60 PolarHBondContact O-N 3.39Å; G56-T60 PolarHBondContact O-OG1 3.49Å; E57-T60 PolarHBondContact O-N 3.01Å; T60-K62 PolarHBondContact O-N 3.5Å; T60-L63 PolarHBondContact O-N 2.92Å; T60-R64 WeakPolarHBondContact O-CB 3.29Å; T60-R64 PolarHBondContact O-N 3.42Å |
| 61 | C | 74.4 | Confident | 76.7 | Confident | 78 Ų | 78 | 100.2 Ų | 100.2 | 53% | 0.527 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.6 | -39.8 | 175.3 | -171 | 0 | 0 | 0 | 0 | 112.2 | E57 I58 D59 R64 T65 | E57-C61 WeakPolarHBondContact O-CB 3.25Å; E57-C61 PolarHBondContact O-N 2.59Å; I58-C61 WeakPolarHBondContact O-CB 3.27Å; I58-C61 PolarHBondContact O-N 3.07Å; D59-C61 VanDerWaalsContact C-N 3.33Å; D59-C61 PolarHBondContact O-N 3.47Å; C61-R64 PolarHBondContact O-N 3.42Å; C61-T65 WeakPolarHBondContact O-CB 3.47Å; C61-T65 WeakPolarHBondContact O-CG2 3.43Å; C61-T65 PolarHBondContact O-N 2.85Å; C61-T65 PolarHBondContact O-OG1 3.27Å |
| 62 | K | 78.1 | Confident | 76.1 | Confident | 112 Ų | 112 | 100.5 Ų | 100.5 | 49% | 0.487 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65 | -42.1 | 174.8 | -76 | 173.9 | -174.8 | 163.9 | 0 | 113 | I58 D59 T60 T65 K66 | I58-K62 HydrophobicContact CG2-CD 4.23Å; I58-K62 HydrophobicContact CG2-CG 4.5Å; I58-K62 WeakPolarHBondContact O-CG 3.26Å; I58-K62 PolarHBondContact O-N 3.37Å; D59-K62 PolarHBondContact O-N 2.91Å; D59-K62 IonicContact OD1-NZ 3.52Å; T60-K62 PolarHBondContact O-N 3.5Å; K62-T65 VanDerWaalsContact CA-OG1 3.31Å; K62-T65 WeakPolarHBondContact CA-OG1 3.36Å; K62-T65 PolarHBondContact O-OG1 2.95Å; K62-K66 WeakPolarHBondContact O-CG 3.29Å; K62-K66 PolarHBondContact O-N 3.49Å |
| 63 | L | 72.5 | Confident | 75.7 | Confident | 112 Ų | 112 | 99.1 Ų | 99.1 | 59% | 0.586 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.6 | -46.2 | 175.3 | -95.3 | 86.3 | 0 | 0 | 0 | 110.5 | D59 T60 T65 K66 D67 | D59-L63 VanDerWaalsContact O-CD1 3.25Å; D59-L63 WeakPolarHBondContact O-CD1 2.92Å; D59-L63 PolarHBondContact O-N 2.88Å; T60-L63 PolarHBondContact O-N 2.92Å; L63-T65 VanDerWaalsContact C-N 3.34Å; L63-T65 PolarHBondContact O-N 3.48Å; L63-K66 WeakPolarHBondContact O-CB 3.39Å; L63-K66 PolarHBondContact O-N 2.83Å; L63-K66 VanDerWaalsContact O-N 3.15Å; L63-D67 PolarHBondContact O-N 3.23Å |
| 64 | R | 73.4 | Confident | 75.2 | Confident | 149 Ų | 149 | 100.9 Ų | 100.9 | 56% | 0.562 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.6 | -39.5 | -179.2 | -151.8 | 173.4 | -159.9 | -144.5 | 2.7 | 112.3 | T60 C61 D67 L68 | T60-R64 WeakPolarHBondContact O-CB 3.29Å; T60-R64 PolarHBondContact O-N 3.42Å; C61-R64 PolarHBondContact O-N 3.42Å; R64-D67 PolarHBondContact O-N 3.23Å; R64-L68 WeakPolarHBondContact O-CB 3.49Å; R64-L68 WeakPolarHBondContact O-CD1 3.35Å; R64-L68 WeakPolarHBondContact O-CG 3.48Å; R64-L68 PolarHBondContact O-N 2.94Å |
| 65 | T | 76.7 | Confident | 74.3 | Confident | 68 Ų | 68 | 101.5 Ų | 101.5 | 42% | 0.417 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -67.5 | -36 | 174.8 | 47.8 | 0 | 0 | 0 | 0 | 112.6 | C61 K62 L63 L68 W69 | C61-T65 WeakPolarHBondContact O-CB 3.47Å; C61-T65 WeakPolarHBondContact O-CG2 3.43Å; C61-T65 PolarHBondContact O-N 2.85Å; C61-T65 PolarHBondContact O-OG1 3.27Å; K62-T65 VanDerWaalsContact CA-OG1 3.31Å; K62-T65 WeakPolarHBondContact CA-OG1 3.36Å; K62-T65 PolarHBondContact O-OG1 2.95Å; L63-T65 VanDerWaalsContact C-N 3.34Å; L63-T65 PolarHBondContact O-N 3.48Å; T65-L68 PolarHBondContact O-N 3.46Å; T65-W69 WeakPolarHBondContact O-CB 3.42Å; T65-W69 PolarHBondContact O-N 3.38Å |
| 66 | K | 77.1 | Confident | 73.6 | Confident | 152 Ų | 152 | 105.5 Ų | 105.5 | 66% | 0.661 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -64.5 | -44.6 | 171.8 | -78.4 | 178.3 | 177.6 | 178.2 | 0 | 112.1 | K62 L63 L68 W69 K70 | K62-K66 WeakPolarHBondContact O-CG 3.29Å; K62-K66 PolarHBondContact O-N 3.49Å; L63-K66 WeakPolarHBondContact O-CB 3.39Å; L63-K66 PolarHBondContact O-N 2.83Å; L63-K66 VanDerWaalsContact O-N 3.15Å; K66-L68 VanDerWaalsContact C-N 3.34Å; K66-L68 PolarHBondContact O-N 2.81Å; K66-W69 PolarHBondContact O-N 2.89Å; K66-K70 WeakPolarHBondContact O-CB 3.48Å; K66-K70 PolarHBondContact O-N 3.49Å |
| 67 | D | 74 | Confident | 72.7 | Confident | 92 Ų | 92 | 110.3 Ų | 110.3 | 49% | 0.492 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63 | -41.5 | 176.6 | -76.1 | -28.6 | 0 | 0 | 0 | 111.5 | L63 R64 K70 Q71 | L63-D67 PolarHBondContact O-N 3.23Å; R64-D67 PolarHBondContact O-N 3.23Å; D67-K70 PolarHBondContact O-N 3.23Å; D67-Q71 WeakPolarHBondContact O-CG 3.33Å; D67-Q71 PolarHBondContact O-N 3.25Å |
| 68 | L | 72.4 | Confident | 71.4 | Confident | 53 Ų | 53 | 107.7 Ų | 107.7 | 28% | 0.277 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62.1 | -43.4 | 174.1 | -74.1 | 166.1 | 0 | 0 | 0 | 112 | R64 T65 K66 K70 Q71 M72 F95 | R64-L68 WeakPolarHBondContact O-CB 3.49Å; R64-L68 WeakPolarHBondContact O-CD1 3.35Å; R64-L68 WeakPolarHBondContact O-CG 3.48Å; R64-L68 PolarHBondContact O-N 2.94Å; T65-L68 PolarHBondContact O-N 3.46Å; K66-L68 VanDerWaalsContact C-N 3.34Å; K66-L68 PolarHBondContact O-N 2.81Å; L68-K70 VanDerWaalsContact C-N 3.33Å; L68-K70 PolarHBondContact O-N 3.39Å; L68-Q71 PolarHBondContact O-N 3.17Å; L68-M72 WeakPolarHBondContact O-CB 3.5Å; L68-M72 VanDerWaalsContact O-CG 3.28Å; L68-M72 WeakPolarHBondContact O-CG 3.14Å; L68-M72 PolarHBondContact O-N 3.32Å; L68-F95 HydrophobicContact CD2-CE1 4.14Å; L68-F95 HydrophobicContact CD2-CZ 4.31Å |
| 69 | W | 76.1 | Confident | 70 | Confident | 182 Ų | 182 | 109.8 Ų | 109.8 | 69% | 0.689 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -63 | -40 | 175.8 | -106.1 | 88.6 | 0 | 0 | 0 | 112.2 | T65 K66 M72 L73 | T65-W69 WeakPolarHBondContact O-CB 3.42Å; T65-W69 PolarHBondContact O-N 3.38Å; K66-W69 PolarHBondContact O-N 2.89Å; W69-M72 PolarHBondContact O-N 3.38Å; W69-L73 HydrophobicContact CE3-CD1 3.88Å; W69-L73 HydrophobicContact CE3-CG 4.29Å; W69-L73 HydrophobicContact CZ3-CD1 4.41Å; W69-L73 PolarHBondContact O-N 3.18Å |
| 70 | K | 76.5 | Confident | 68.7 | Low | 133 Ų | 133 | 113.3 Ų | 113.3 | 58% | 0.578 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -63.9 | -45.5 | 176.6 | -172.3 | 170.9 | -179.8 | 172.6 | 0 | 111.6 | K66 D67 L68 M72 L73 D74 | K66-K70 WeakPolarHBondContact O-CB 3.48Å; K66-K70 PolarHBondContact O-N 3.49Å; D67-K70 PolarHBondContact O-N 3.23Å; L68-K70 VanDerWaalsContact C-N 3.33Å; L68-K70 PolarHBondContact O-N 3.39Å; K70-M72 VanDerWaalsContact C-N 3.33Å; K70-M72 PolarHBondContact O-N 2.83Å; K70-L73 PolarHBondContact O-N 3.06Å; K70-D74 PolarHBondContact O-N 2.75Å |
| 71 | Q | 72.1 | Confident | 67.2 | Low | 124 Ų | 124 | 112.3 Ų | 112.3 | 58% | 0.579 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -61.8 | -39 | 175.3 | -70.8 | 176.5 | 19.1 | 0 | 0 | 112.5 | D67 L68 T75 | D67-Q71 WeakPolarHBondContact O-CG 3.33Å; D67-Q71 PolarHBondContact O-N 3.25Å; L68-Q71 PolarHBondContact O-N 3.17Å; Q71-T75 WeakPolarHBondContact O-CB 3.46Å; Q71-T75 PolarHBondContact O-N 2.86Å; Q71-T75 PolarHBondContact O-OG1 3.49Å |
| 72 | M | 72.4 | Confident | 65.6 | Low | 111 Ų | 111 | 117.7 Ų | 117.7 | 55% | 0.547 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -64.1 | -41.6 | 174.9 | -74.8 | -96.3 | -82.2 | 0 | 0 | 112 | L68 W69 K70 K76 | L68-M72 WeakPolarHBondContact O-CB 3.5Å; L68-M72 VanDerWaalsContact O-CG 3.28Å; L68-M72 WeakPolarHBondContact O-CG 3.14Å; L68-M72 PolarHBondContact O-N 3.32Å; W69-M72 PolarHBondContact O-N 3.38Å; K70-M72 VanDerWaalsContact C-N 3.33Å; K70-M72 PolarHBondContact O-N 2.83Å; M72-K76 PolarHBondContact O-N 3.34Å; M72-K76 VanDerWaalsContact O-N 3.14Å |
| 73 | L | 73.4 | Confident | 64 | Low | 88 Ų | 88 | 119.7 Ų | 119.7 | 46% | 0.461 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -67 | -44.8 | 176.5 | -81.7 | 156.2 | 0 | 0 | 0 | 112.1 | W69 K70 T75 K76 N77 | W69-L73 HydrophobicContact CE3-CD1 3.88Å; W69-L73 HydrophobicContact CE3-CG 4.29Å; W69-L73 HydrophobicContact CZ3-CD1 4.41Å; W69-L73 PolarHBondContact O-N 3.18Å; K70-L73 PolarHBondContact O-N 3.06Å; L73-T75 VanDerWaalsContact C-N 3.32Å; L73-T75 PolarHBondContact O-N 3.41Å; L73-K76 PolarHBondContact O-N 3.37Å; L73-K76 VanDerWaalsContact O-N 3.13Å; L73-N77 PolarHBondContact O-N 3.5Å |
| 74 | D | 70.2 | Confident | 62.7 | Low | 98 Ų | 98 | 118.8 Ų | 118.8 | 52% | 0.524 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -63.4 | -39 | 177.9 | -74.5 | -25.9 | 0 | 0 | 0 | 111.3 | K70 K76 N77 G78 | K70-D74 PolarHBondContact O-N 2.75Å; D74-K76 VanDerWaalsContact C-N 3.3Å; D74-K76 PolarHBondContact O-N 2.89Å; D74-N77 PolarHBondContact O-N 3.32Å; D74-G78 PolarHBondContact O-N 2.88Å |
| 75 | T | 65.3 | Low | 61.4 | Low | 90 Ų | 90 | 123.1 Ų | 123.1 | 55% | 0.552 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -64.6 | -35.1 | 175.1 | -53.5 | 0 | 0 | 0 | 0 | 111.7 | Q71 L73 N77 G78 | Q71-T75 WeakPolarHBondContact O-CB 3.46Å; Q71-T75 PolarHBondContact O-N 2.86Å; Q71-T75 PolarHBondContact O-OG1 3.49Å; L73-T75 VanDerWaalsContact C-N 3.32Å; L73-T75 PolarHBondContact O-N 3.41Å; T75-N77 VanDerWaalsContact C-N 3.34Å; T75-G78 PolarHBondContact O-N 2.92Å |
| 76 | K | 62.6 | Low | 59.9 | Low | 172 Ų | 172 | 129.5 Ų | 129.5 | 75% | 0.748 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -71.1 | -29 | 179.3 | -149.1 | 179.7 | -175.7 | -176.1 | 0 | 112.7 | M72 L73 D74 | M72-K76 PolarHBondContact O-N 3.34Å; M72-K76 VanDerWaalsContact O-N 3.14Å; L73-K76 PolarHBondContact O-N 3.37Å; L73-K76 VanDerWaalsContact O-N 3.13Å; D74-K76 VanDerWaalsContact C-N 3.3Å; D74-K76 PolarHBondContact O-N 2.89Å |
| 77 | N | 58 | Low | 58.7 | Low | 134 Ų | 134 | 124.9 Ų | 124.9 | 72% | 0.717 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -84.3 | -19.1 | 177.4 | -70 | -20 | 0 | 0 | 0 | 113.5 | L73 D74 T75 | L73-N77 PolarHBondContact O-N 3.5Å; D74-N77 PolarHBondContact O-N 3.32Å; T75-N77 VanDerWaalsContact C-N 3.34Å |
| 78 | G | 50.9 | Low | 57.5 | Low | 64 Ų | 64 | 123.2 Ų | 123.2 | 66% | 0.66 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -88.6 | -5.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | D74 T75 V80 | D74-G78 PolarHBondContact O-N 2.88Å; T75-G78 PolarHBondContact O-N 2.92Å; G78-V80 PolarHBondContact O-N 2.89Å |
| 79 | F | 47.3 | Very low | 56.4 | Low | 124 Ų | 124 | 128.4 Ų | 128.4 | 54% | 0.544 | 67% | 0.671 | S | S | . | * | trans | -106.3 | 67 | -167.7 | -130.4 | -111.8 | 0 | 0 | 0 | 112.9 | Y82 | F79-Y82 HydrophobicContact CE1-CG 4.44Å; F79-Y82 WeakPolarHBondContact CE1-O 3.47Å; F79-Y82 HydrophobicContact CZ-CG 4.17Å | ||
| 80 | V | 46.2 | Very low | 55.1 | Low | 154 Ų | 154 | 124.4 Ų | 124.4 | 93% | 0.933 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -88.6 | 98.3 | 155.2 | -177.6 | 0 | 0 | 0 | 0 | 106.3 | G78 | G78-V80 PolarHBondContact O-N 2.89Š|
| 81 | G | 42 | Very low | 54.1 | Low | 69 Ų | 69 | 122 Ų | 122 | 71% | 0.711 | 66% | 0.655 | S | S | * | * | S | Bend | trans | 126.7 | 15.7 | 160.4 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||
| 82 | Y | 40.8 | Very low | 53 | Low | 191 Ų | 191 | 121.7 Ų | 121.7 | 75% | 0.749 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -127.6 | 133.9 | 169.8 | -104.6 | -95.9 | 0 | 0 | 0 | 112.5 | F79 A84 | F79-Y82 HydrophobicContact CE1-CG 4.44Å; F79-Y82 WeakPolarHBondContact CE1-O 3.47Å; F79-Y82 HydrophobicContact CZ-CG 4.17Å; Y82-A84 PolarHBondContact O-N 2.91Å |
| 83 | D | 43.9 | Very low | 51.9 | Low | 154 Ų | 154 | 123.9 Ų | 123.9 | 82% | 0.824 | 66% | 0.664 | S | S | * | * | trans | -51.3 | 112.5 | -174 | -105.7 | -51.3 | 0 | 0 | 0 | 113.8 | R85 | D83-R85 PolarHBondContact O-N 3.3Å; D83-R85 VanDerWaalsContact O-N 3.08Å | ||
| 84 | A | 45.1 | Very low | 51 | Low | 92 Ų | 92 | 128.4 Ų | 128.4 | 76% | 0.76 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.7 | 24.2 | -173.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | Y82 | Y82-A84 PolarHBondContact O-N 2.91Š|
| 85 | R | 47.3 | Very low | 50 | Low | 241 Ų | 241 | 127.2 Ų | 127.2 | 91% | 0.909 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.1 | -10.2 | -177 | -83.3 | -169.3 | -172.8 | -174.9 | 4.9 | 117 | D83 | D83-R85 PolarHBondContact O-N 3.3Å; D83-R85 VanDerWaalsContact O-N 3.08Å |
| 86 | K | 45.2 | Very low | 49.2 | Very low | 201 Ų | 201 | 126 Ų | 126 | 87% | 0.874 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -109.3 | -7.7 | -178.3 | -84.3 | -171.2 | 175.7 | -178.7 | 0 | 116.6 | ||
| 87 | S | 51.2 | Low | 48.5 | Very low | 56 Ų | 56 | 126.7 Ų | 126.7 | 39% | 0.392 | 66% | 0.656 | S | S | . | * | S | Bend | trans | -103.2 | -1.7 | -172.5 | 70.4 | 0 | 0 | 0 | 0 | 116.2 | Q89 D90 I91 | S87-Q89 VanDerWaalsContact C-N 3.33Å; S87-Q89 PolarHBondContact O-N 3.34Å; S87-D90 PolarHBondContact O-N 3.28Å; S87-D90 VanDerWaalsContact O-N 3.12Å; S87-I91 VanDerWaalsContact O-CG1 3.31Å; S87-I91 WeakPolarHBondContact O-CG1 3.29Å; S87-I91 PolarHBondContact O-N 2.88Å |
| 88 | G | 48.5 | Very low | 48.2 | Very low | 56 Ų | 56 | 126 Ų | 126 | 58% | 0.577 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -60.9 | -39.1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | L92 | G88-L92 PolarHBondContact O-N 3.42Å |
| 89 | Q | 49.2 | Very low | 48.1 | Very low | 162 Ų | 162 | 126.9 Ų | 126.9 | 76% | 0.757 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -74 | -33.2 | 174.1 | -98.4 | 179.4 | -26.2 | 0 | 0 | 112.7 | S87 L92 F93 | S87-Q89 VanDerWaalsContact C-N 3.33Å; S87-Q89 PolarHBondContact O-N 3.34Å; Q89-L92 PolarHBondContact O-N 2.85Å; Q89-F93 WeakPolarHBondContact O-CB 3.35Å; Q89-F93 PolarHBondContact O-N 3.48Å |
| 90 | D | 49.2 | Very low | 48.1 | Very low | 98 Ų | 98 | 126.1 Ų | 126.1 | 52% | 0.524 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -71.2 | -37.5 | -178.5 | -136.1 | -23.6 | 0 | 0 | 0 | 111.4 | S87 F93 R94 | S87-D90 PolarHBondContact O-N 3.28Å; S87-D90 VanDerWaalsContact O-N 3.12Å; D90-F93 PolarHBondContact O-N 3.42Å; D90-R94 WeakPolarHBondContact O-CG 3.36Å; D90-R94 PolarHBondContact O-N 2.73Å |
| 91 | I | 54.3 | Low | 48.1 | Very low | 82 Ų | 82 | 124 Ų | 124 | 42% | 0.421 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -63.1 | -50.4 | 171.1 | -65.3 | 163.9 | 0 | 0 | 0 | 109 | S87 F93 R94 F95 | S87-I91 VanDerWaalsContact O-CG1 3.31Å; S87-I91 WeakPolarHBondContact O-CG1 3.29Å; S87-I91 PolarHBondContact O-N 2.88Å; I91-F93 VanDerWaalsContact C-N 3.3Å; I91-F93 PolarHBondContact O-N 2.88Å; I91-R94 PolarHBondContact O-N 3.21Å; I91-F95 HydrophobicContact CG2-CD2 3.63Å; I91-F95 HydrophobicContact CG2-CE2 3.65Å; I91-F95 WeakPolarHBondContact O-CB 3.36Å; I91-F95 VanDerWaalsContact O-CD2 3.24Å; I91-F95 WeakPolarHBondContact O-CD2 3.24Å; I91-F95 PolarHBondContact O-N 2.87Å |
| 92 | L | 50 | Low | 48.4 | Very low | 119 Ų | 119 | 122.9 Ų | 122.9 | 62% | 0.623 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -61.6 | -36 | 179.9 | -162.8 | 71.3 | 0 | 0 | 0 | 112.8 | G88 Q89 F95 T96 | G88-L92 PolarHBondContact O-N 3.42Å; Q89-L92 PolarHBondContact O-N 2.85Å; L92-F95 WeakPolarHBondContact O-CB 3.44Å; L92-F95 PolarHBondContact O-N 2.89Å; L92-T96 PolarHBondContact O-N 3.3Å; L92-T96 PolarHBondContact O-OG1 2.97Å |
| 93 | F | 49 | Very low | 48.8 | Very low | 157 Ų | 157 | 118.2 Ų | 118.2 | 69% | 0.689 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -70.1 | -39.4 | 175.4 | -116.3 | -88.7 | 0 | 0 | 0 | 112.7 | Q89 D90 I91 F95 T96 R97 | Q89-F93 WeakPolarHBondContact O-CB 3.35Å; Q89-F93 PolarHBondContact O-N 3.48Å; D90-F93 PolarHBondContact O-N 3.42Å; I91-F93 VanDerWaalsContact C-N 3.3Å; I91-F93 PolarHBondContact O-N 2.88Å; F93-F95 VanDerWaalsContact C-N 3.29Å; F93-F95 PolarHBondContact O-N 3.47Å; F93-T96 WeakPolarHBondContact CA-OG1 3.41Å; F93-T96 PolarHBondContact O-N 3.24Å; F93-T96 PolarHBondContact O-OG1 2.93Å; F93-R97 WeakPolarHBondContact O-CB 3.44Å; F93-R97 PolarHBondContact O-N 3.21Å |
| 94 | R | 53.9 | Low | 48.9 | Very low | 183 Ų | 183 | 111.9 Ų | 111.9 | 69% | 0.691 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -63.6 | -36.9 | 170.8 | -73.3 | -172.9 | -176.4 | -154.6 | 2.1 | 111.7 | D90 I91 R97 Q98 | D90-R94 WeakPolarHBondContact O-CG 3.36Å; D90-R94 PolarHBondContact O-N 2.73Å; I91-R94 PolarHBondContact O-N 3.21Å; R94-R97 PolarHBondContact O-N 3.49Å; R94-Q98 PolarHBondContact O-N 2.92Å |
| 95 | F | 49.5 | Very low | 49.3 | Very low | 72 Ų | 72 | 112.9 Ų | 112.9 | 32% | 0.316 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -66.8 | -41.5 | 175.7 | -96.6 | -91.3 | 0 | 0 | 0 | 112.8 | L68 I91 L92 F93 T99 | L68-F95 HydrophobicContact CD2-CE1 4.14Å; L68-F95 HydrophobicContact CD2-CZ 4.31Å; I91-F95 HydrophobicContact CG2-CD2 3.63Å; I91-F95 HydrophobicContact CG2-CE2 3.65Å; I91-F95 WeakPolarHBondContact O-CB 3.36Å; I91-F95 VanDerWaalsContact O-CD2 3.24Å; I91-F95 WeakPolarHBondContact O-CD2 3.24Å; I91-F95 PolarHBondContact O-N 2.87Å; L92-F95 WeakPolarHBondContact O-CB 3.44Å; L92-F95 PolarHBondContact O-N 2.89Å; F93-F95 VanDerWaalsContact C-N 3.29Å; F93-F95 PolarHBondContact O-N 3.47Å; F95-T99 PolarHBondContact O-N 2.95Å; F95-T99 VanDerWaalsContact O-N 3.16Å; F95-T99 PolarHBondContact O-OG1 3.23Å |
| 96 | T | 49.8 | Very low | 49.6 | Very low | 64 Ų | 64 | 105.8 Ų | 105.8 | 39% | 0.393 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -70.1 | -36.7 | 174.8 | 20.9 | 0 | 0 | 0 | 0 | 111.5 | L92 F93 T99 I100 | L92-T96 PolarHBondContact O-N 3.3Å; L92-T96 PolarHBondContact O-OG1 2.97Å; F93-T96 WeakPolarHBondContact CA-OG1 3.41Å; F93-T96 PolarHBondContact O-N 3.24Å; F93-T96 PolarHBondContact O-OG1 2.93Å; T96-T99 VanDerWaalsContact CA-OG1 3.3Å; T96-T99 WeakPolarHBondContact CA-OG1 3.5Å; T96-T99 PolarHBondContact O-N 2.89Å; T96-T99 PolarHBondContact O-OG1 3.32Å; T96-T99 VanDerWaalsContact O-OG1 3.05Å; T96-I100 WeakPolarHBondContact O-CB 3.4Å; T96-I100 WeakPolarHBondContact O-CD1 3.03Å; T96-I100 WeakPolarHBondContact O-CG1 3.46Å; T96-I100 PolarHBondContact O-N 3.49Å |
| 97 | R | 48.2 | Very low | 50 | Low | 188 Ų | 188 | 98.6 Ų | 98.6 | 71% | 0.709 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -65.2 | -40.8 | 175.1 | -160.6 | 171.8 | 172.5 | 156.7 | -0.4 | 112.5 | F93 R94 T99 I100 D101 | F93-R97 WeakPolarHBondContact O-CB 3.44Å; F93-R97 PolarHBondContact O-N 3.21Å; R94-R97 PolarHBondContact O-N 3.49Å; R97-T99 VanDerWaalsContact C-N 3.35Å; R97-T99 PolarHBondContact O-N 3.33Å; R97-I100 PolarHBondContact O-N 3.42Å; R97-D101 WeakPolarHBondContact O-CB 3.44Å; R97-D101 PolarHBondContact O-N 3.44Å |
| 98 | Q | 50.4 | Low | 50.2 | Low | 118 Ų | 118 | 101 Ų | 101 | 55% | 0.551 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -69.3 | -26.8 | 175.3 | -81.9 | -178.1 | -16.2 | 0 | 0 | 114.5 | R94 A102 | R94-Q98 PolarHBondContact O-N 2.92Å; Q98-A102 PolarHBondContact O-N 3.48Å |
| 99 | T | 48.4 | Very low | 50.9 | Low | 83 Ų | 83 | 106.3 Ų | 106.3 | 51% | 0.509 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -84.5 | -28.2 | 176.3 | 41.1 | 0 | 0 | 0 | 0 | 112.3 | F95 T96 R97 S103 | F95-T99 PolarHBondContact O-N 2.95Å; F95-T99 VanDerWaalsContact O-N 3.16Å; F95-T99 PolarHBondContact O-OG1 3.23Å; T96-T99 VanDerWaalsContact CA-OG1 3.3Å; T96-T99 WeakPolarHBondContact CA-OG1 3.5Å; T96-T99 PolarHBondContact O-N 2.89Å; T96-T99 PolarHBondContact O-OG1 3.32Å; T96-T99 VanDerWaalsContact O-OG1 3.05Å; R97-T99 VanDerWaalsContact C-N 3.35Å; R97-T99 PolarHBondContact O-N 3.33Å; T99-S103 PolarHBondContact O-OG 2.94Å |
| 100 | I | 47.7 | Very low | 51.6 | Low | 108 Ų | 108 | 98.8 Ų | 98.8 | 55% | 0.554 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -76.7 | -37.3 | 170.8 | -64.7 | 165.5 | 0 | 0 | 0 | 111.3 | T96 R97 A102 S103 C104 | T96-I100 WeakPolarHBondContact O-CB 3.4Å; T96-I100 WeakPolarHBondContact O-CD1 3.03Å; T96-I100 WeakPolarHBondContact O-CG1 3.46Å; T96-I100 PolarHBondContact O-N 3.49Å; R97-I100 PolarHBondContact O-N 3.42Å; I100-A102 PolarHBondContact O-N 3.42Å; I100-S103 WeakPolarHBondContact CA-OG 3.44Å; I100-S103 PolarHBondContact O-N 2.92Å; I100-S103 PolarHBondContact O-OG 2.99Å; I100-C104 PolarHBondContact O-N 3.41Å |
| 101 | D | 45.8 | Very low | 52.5 | Low | 110 Ų | 110 | 97.7 Ų | 97.7 | 59% | 0.588 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -62.6 | -25.5 | 172.3 | -83.5 | -41.2 | 0 | 0 | 0 | 112.4 | R97 | R97-D101 WeakPolarHBondContact O-CB 3.44Å; R97-D101 PolarHBondContact O-N 3.44Å |
| 102 | A | 48.7 | Very low | 53.4 | Low | 45 Ų | 45 | 97.7 Ų | 97.7 | 37% | 0.372 | 51% | 0.507 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.1 | -15.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 114 | Q98 I100 C105 | Q98-A102 PolarHBondContact O-N 3.48Å; I100-A102 PolarHBondContact O-N 3.42Å; A102-C105 PolarHBondContact O-SG 2.98Å |
| 103 | S | 50 | Low | 54.5 | Low | 93 Ų | 93 | 92.5 Ų | 92.5 | 65% | 0.65 | 48% | 0.483 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.3 | -7.8 | 176.1 | 31.8 | 0 | 0 | 0 | 0 | 112.9 | T99 I100 C105 | T99-S103 PolarHBondContact O-OG 2.94Å; I100-S103 WeakPolarHBondContact CA-OG 3.44Å; I100-S103 PolarHBondContact O-N 2.92Å; I100-S103 PolarHBondContact O-OG 2.99Å; S103-C105 VanDerWaalsContact C-N 3.31Å; S103-C105 PolarHBondContact O-N 3.27Å |
| 104 | C | 46.5 | Very low | 55.8 | Low | 22 Ų | 22 | 88.6 Ų | 88.6 | 15% | 0.149 | 47% | 0.473 | C | S | . | . | trans | -94.5 | 43.9 | 170.1 | -144 | 0 | 0 | 0 | 0 | 113.4 | I100 T106 C107 C153 | I100-C104 PolarHBondContact O-N 3.41Å; C104-T106 PolarHBondContact O-N 2.91Å; C104-C107 PolarHBondContact O-N 3.46Å; C104-C153 HydrophobicContact CB-CB 4.33Å; C104-C153 WeakPolarHBondContact CB-SG 3.49Å; C104-C153 WeakPolarHBondContact SG-CB 3.38Å; C104-C153 CovalentContact SG-SG 2.03Å; C104-C153 PolarHBondContact SG-SG 3.07Å | ||
| 105 | C | 51.8 | Low | 56.8 | Low | 113 Ų | 113 | 83 Ų | 83 | 76% | 0.764 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65 | 18.7 | 176.5 | -80.1 | 0 | 0 | 0 | 0 | 115.2 | A102 S103 | A102-C105 PolarHBondContact O-SG 2.98Å; S103-C105 VanDerWaalsContact C-N 3.31Å; S103-C105 PolarHBondContact O-N 3.27Å |
| 106 | T | 54 | Low | 57.9 | Low | 92 Ų | 92 | 80 Ų | 80 | 56% | 0.564 | 45% | 0.449 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.5 | -14.9 | 171.6 | 57 | 0 | 0 | 0 | 0 | 112.8 | C104 Q108 | C104-T106 PolarHBondContact O-N 2.91Å; T106-Q108 PolarHBondContact O-N 3.05Å |
| 107 | C | 53.7 | Low | 59.2 | Low | 50 Ų | 50 | 80.7 Ų | 80.7 | 34% | 0.338 | 46% | 0.455 | S | S | . | . | trans | -75.3 | 95 | 177.7 | -39.2 | 0 | 0 | 0 | 0 | 109.1 | C104 C155 | C104-C107 PolarHBondContact O-N 3.46Å; C107-C155 HydrophobicContact CB-CB 3.87Å; C107-C155 WeakPolarHBondContact CB-SG 3.47Å; C107-C155 WeakPolarHBondContact SG-CA 3.18Å; C107-C155 WeakPolarHBondContact SG-CB 3.27Å; C107-C155 CovalentContact SG-SG 2.06Å; C107-C155 PolarHBondContact SG-SG 3.03Å | ||
| 108 | Q | 56.1 | Low | 60.4 | Low | 107 Ų | 107 | 74.3 Ų | 74.3 | 50% | 0.5 | 44% | 0.438 | S | S | . | . | P | Polyproline II helix | trans | -60.1 | 138 | 170.9 | -70.1 | 171.6 | 36.2 | 0 | 0 | 108.3 | T106 A140 | T106-Q108 PolarHBondContact O-N 3.05Å; Q108-A140 HydrophobicContact CB-CB 4.36Å; Q108-A140 WeakPolarHBondContact O-CB 3.45Å |
| 109 | R | 62.3 | Low | 61.5 | Low | 166 Ų | 166 | 69.1 Ų | 69.1 | 63% | 0.626 | 42% | 0.416 | S | S | * | . | P | Polyproline II helix | trans | -75.7 | 141.9 | 165.6 | -154.7 | 177.2 | -172.5 | 166.2 | 11.5 | 107.4 | L158 P159 | R109-L158 HydrophobicContact CG-CB 4.38Å; R109-P159 WeakPolarHBondContact CG-O 3.31Å; R109-P159 PolarHBondContact NE-O 3.16Å |
| 110 | G | 64 | Low | 62.7 | Low | 5 Ų | 5 | 74 Ų | 74 | 5% | 0.052 | 43% | 0.425 | C | S | . | . | P | Polyproline II helix | trans | -62.2 | 167.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113 | T138 L158 G160 | G110-T138 WeakPolarHBondContact CA-O 3.32Å; G110-L158 PolarHBondContact N-O 2.92Å; G110-G160 WeakPolarHBondContact O-CA 3.04Å |
| 111 | P | 69.5 | Low | 64.1 | Low | 74 Ų | 74 | 70.8 Ų | 70.8 | 48% | 0.481 | 41% | 0.409 | S | S | . | . | P | Polyproline II helix | trans | -59.4 | 148.1 | 178.3 | 26.8 | -34.6 | 0 | 0 | 0 | 110.8 | G137 T138 G160 | P111-G137 WeakPolarHBondContact O-CA 3.08Å; P111-T138 WeakPolarHBondContact CG-OG1 2.98Å; P111-G160 WeakPolarHBondContact O-CA 3.19Å |
| 112 | P | 72.5 | Confident | 65 | Low | 83 Ų | 83 | 66 Ų | 66 | 54% | 0.539 | 39% | 0.385 | S | S | . | . | P | Polyproline II helix | trans | -52.7 | 143.8 | 174.1 | -23.4 | 32.1 | 0 | 0 | 0 | 111.8 | P161 | P112-P161 VanDerWaalsContact CA-O 3.32Å; P112-P161 WeakPolarHBondContact CA-O 3.33Å; P112-P161 HydrophobicContact CB-CG 4.08Å; P112-P161 HydrophobicContact CG-CG 3.97Å |
| 113 | G | 73.3 | Confident | 65.6 | Low | 10 Ų | 10 | 69.5 Ų | 69.5 | 10% | 0.103 | 39% | 0.393 | C | S | . | . | P | Polyproline II helix | trans | -64.8 | 167.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | S135 G137 P161 G163 | G113-S135 WeakPolarHBondContact CA-O 3.41Å; G113-G137 VanDerWaalsContact CA-CA 3.47Å; G113-G137 VanDerWaalsContact N-CA 3.28Å; G113-P161 PolarHBondContact N-O 2.87Å; G113-G163 WeakPolarHBondContact O-CA 3.2Å |
| 114 | P | 75.3 | Confident | 66.1 | Low | 75 Ų | 75 | 68.4 Ų | 68.4 | 49% | 0.487 | 38% | 0.379 | S | S | . | . | P | Polyproline II helix | trans | -58.6 | 148.8 | 175.8 | 27 | -35 | 0 | 0 | 0 | 110.9 | G134 S135 | P114-G134 WeakPolarHBondContact O-CA 3.46Å; P114-S135 WeakPolarHBondContact CD-OG 3.29Å; P114-S135 WeakPolarHBondContact CG-OG 3.42Å |
| 115 | P | 76.2 | Confident | 66.5 | Low | 66 Ų | 66 | 69.5 Ų | 69.5 | 43% | 0.429 | 39% | 0.394 | S | S | . | . | P | Polyproline II helix | trans | -51.6 | 147 | 172.1 | -25.8 | 34.4 | 0 | 0 | 0 | 112.2 | V164 | P115-V164 HydrophobicContact CB-CG2 3.85Å; P115-V164 HydrophobicContact CG-CG2 3.97Å |
| 116 | G | 72.2 | Confident | 66.9 | Low | 7 Ų | 7 | 66.4 Ų | 66.4 | 7% | 0.072 | 38% | 0.377 | C | S | . | . | P | Polyproline II helix | trans | -66.7 | 162.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113 | P132 G134 V164 G166 | G116-P132 WeakPolarHBondContact CA-O 3.32Å; G116-G134 VanDerWaalsContact CA-CA 3.48Å; G116-G134 VanDerWaalsContact N-CA 3.32Å; G116-V164 PolarHBondContact N-O 2.94Å; G116-G166 WeakPolarHBondContact O-CA 3.44Å |
| 117 | P | 76.5 | Confident | 67.4 | Low | 80 Ų | 80 | 66.9 Ų | 66.9 | 52% | 0.519 | 38% | 0.381 | S | S | . | . | P | Polyproline II helix | trans | -62.7 | 156.4 | 173.5 | 28.5 | -34.9 | 0 | 0 | 0 | 111 | G131 P132 G166 | P117-G131 WeakPolarHBondContact O-CA 3.4Å; P117-P132 HydrophobicContact CG-CG 3.67Å; P117-G166 WeakPolarHBondContact O-CA 3.31Å |
| 118 | P | 74.4 | Confident | 67.9 | Low | 54 Ų | 54 | 65 Ų | 65 | 35% | 0.351 | 37% | 0.371 | S | S | . | . | P | Polyproline II helix | trans | -52.2 | 150.1 | 171.9 | -24.9 | 34.2 | 0 | 0 | 0 | 112.2 | P167 | P118-P167 WeakPolarHBondContact CA-O 3.25Å; P118-P167 HydrophobicContact CB-CG 4.2Å; P118-P167 HydrophobicContact CG-CG 4.18Å |
| 119 | G | 72.6 | Confident | 68.7 | Low | 9 Ų | 9 | 65.1 Ų | 65.1 | 9% | 0.093 | 37% | 0.37 | C | S | . | . | P | Polyproline II helix | trans | -66.7 | 173.8 | 174 | 0 | 0 | 0 | 0 | 0 | 113.1 | K129 G131 P167 | G119-K129 VanDerWaalsContact CA-O 3.27Å; G119-K129 WeakPolarHBondContact CA-O 3.35Å; G119-G131 VanDerWaalsContact CA-CA 3.43Å; G119-G131 VanDerWaalsContact N-CA 3.28Å; G119-P167 PolarHBondContact N-O 3.15Å |
| 120 | R | 74.8 | Confident | 69.3 | Low | 185 Ų | 185 | 62.8 Ų | 62.8 | 70% | 0.698 | 37% | 0.37 | S | S | * | . | P | Polyproline II helix | trans | -76.2 | 136.4 | 174.6 | -67.5 | -179.5 | -168.1 | 172.7 | -5.5 | 108.8 | K129 | R120-K129 HydrophobicContact CB-CD 3.92Å; R120-K129 VanDerWaalsContact CB-CE 3.43Å; R120-K129 HydrophobicContact CB-CG 4.01Å; R120-K129 VanDerWaalsContact CD-NZ 3.26Å; R120-K129 HydrophobicContact CG-CD 4.36Å; R120-K129 PolarHBondContact O-N 2.72Å |
| 121 | D | 76.7 | Confident | 69.6 | Low | 40 Ų | 40 | 62.9 Ų | 62.9 | 21% | 0.214 | 37% | 0.37 | C | S | . | . | P | Polyproline II helix | trans | -58.7 | 148 | 172.7 | -53.3 | -39.3 | 0 | 0 | 0 | 110.8 | Q170 | D121-Q170 CarbonylContact C-O 3.57Å; D121-Q170 VanDerWaalsContact CA-O 3.31Å; D121-Q170 WeakPolarHBondContact CA-O 3.32Å; D121-Q170 PolarHBondContact OD1-N 3.32Å |
| 122 | G | 63.2 | Low | 69.8 | Low | 9 Ų | 9 | 62.9 Ų | 62.9 | 9% | 0.093 | 37% | 0.37 | C | S | . | . | P | Polyproline II helix | trans | -67.4 | 167.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | A126 Q170 G172 | G122-A126 WeakPolarHBondContact CA-O 3.28Å; G122-Q170 PolarHBondContact N-O 3.24Å; G122-G172 VanDerWaalsContact C-CA 3.41Å; G122-G172 VanDerWaalsContact O-CA 3.24Å; G122-G172 WeakPolarHBondContact O-CA 3Å |
| 123 | K | 61.5 | Low | 70 | Confident | 120 Ų | 120 | 66.5 Ų | 66.5 | 52% | 0.522 | 37% | 0.373 | S | S | . | . | S | Bend | trans | -129.5 | 145 | 175.2 | -58.5 | -176.7 | -173.8 | -170.3 | 0 | 109 | G125 A126 P269 | K123-G125 PolarHBondContact O-N 2.98Å; K123-A126 WeakPolarHBondContact O-CB 3.3Å; K123-A126 PolarHBondContact O-N 3.39Å; K123-P269 HydrophobicContact CD-CB 4.29Å; K123-P269 HydrophobicContact CD-CG 3.89Å; K123-P269 HydrophobicContact CG-CB 4.36Å; K123-P269 HydrophobicContact CG-CG 4.46Å; K123-P269 VanDerWaalsContact NZ-CG 3.34Å |
| 124 | D | 61 | Low | 70 | Confident | 70 Ų | 70 | 66.3 Ų | 66.3 | 37% | 0.374 | 37% | 0.371 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 53.8 | 43.5 | 173.6 | -51.2 | -39.7 | 0 | 0 | 0 | 114.5 | A126 S266 G267 | D124-A126 VanDerWaalsContact C-N 3.27Å; D124-A126 PolarHBondContact O-N 3.38Å; D124-S266 WeakPolarHBondContact OD2-CB 3.47Å; D124-S266 PolarHBondContact OD2-OG 3.25Å; D124-G267 PolarHBondContact OD1-N 3.27Å |
| 125 | G | 54.8 | Low | 70 | Confident | 45 Ų | 45 | 65.9 Ų | 65.9 | 46% | 0.464 | 37% | 0.37 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 79.4 | -2.5 | -177 | 0 | 0 | 0 | 0 | 0 | 115.6 | K123 G172 S173 | K123-G125 PolarHBondContact O-N 2.98Å; G125-G172 VanDerWaalsContact CA-O 3.22Å; G125-G172 WeakPolarHBondContact CA-O 3.32Å; G125-G172 PolarHBondContact N-O 3.08Å; G125-S173 PolarHBondContact N-O 3.43Å; G125-S173 VanDerWaalsContact N-O 3.1Å |
| 126 | A | 59.7 | Low | 69.8 | Low | 47 Ų | 47 | 66.8 Ų | 66.8 | 39% | 0.388 | 38% | 0.376 | S | S | . | . | P | Polyproline II helix | trans | -71.6 | 146.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | G122 K123 D124 G172 | G122-A126 WeakPolarHBondContact CA-O 3.28Å; K123-A126 WeakPolarHBondContact O-CB 3.3Å; K123-A126 PolarHBondContact O-N 3.39Å; D124-A126 VanDerWaalsContact C-N 3.27Å; D124-A126 PolarHBondContact O-N 3.38Å; A126-G172 PolarHBondContact O-N 3.23Å |
| 127 | P | 65.6 | Low | 69.6 | Low | 102 Ų | 102 | 66.8 Ų | 66.8 | 66% | 0.662 | 38% | 0.376 | S | S | * | . | P | Polyproline II helix | trans | -61 | 148.6 | 174 | -23.8 | 33.9 | 0 | 0 | 0 | 113 | D171 | P127-D171 VanDerWaalsContact CA-OD1 3.28Å; P127-D171 WeakPolarHBondContact CA-OD1 3.3Å |
| 128 | G | 63.7 | Low | 69.3 | Low | 12 Ų | 12 | 67.6 Ų | 67.6 | 12% | 0.124 | 38% | 0.38 | C | S | . | . | P | Polyproline II helix | trans | -63.3 | 147.3 | 170.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | G169 D171 | G128-G169 WeakPolarHBondContact CA-O 3.4Å; G128-D171 PolarHBondContact N-OD1 3.36Å |
| 129 | K | 73 | Confident | 68.9 | Low | 109 Ų | 109 | 69.5 Ų | 69.5 | 47% | 0.474 | 39% | 0.386 | S | S | . | . | P | Polyproline II helix | trans | -82.3 | 158 | 177.2 | 72.1 | -175.6 | -164.4 | -179.2 | 0 | 110.6 | G119 R120 G169 | G119-K129 VanDerWaalsContact CA-O 3.27Å; G119-K129 WeakPolarHBondContact CA-O 3.35Å; R120-K129 HydrophobicContact CB-CD 3.92Å; R120-K129 VanDerWaalsContact CB-CE 3.43Å; R120-K129 HydrophobicContact CB-CG 4.01Å; R120-K129 VanDerWaalsContact CD-NZ 3.26Å; R120-K129 HydrophobicContact CG-CD 4.36Å; R120-K129 PolarHBondContact O-N 2.72Å; K129-G169 PolarHBondContact O-N 3.33Å |
| 130 | D | 74.8 | Confident | 68.2 | Low | 117 Ų | 117 | 69.7 Ų | 69.7 | 63% | 0.626 | 39% | 0.388 | S | S | * | . | P | Polyproline II helix | trans | -62.3 | 146.4 | 174.6 | -64.9 | -26 | 0 | 0 | 0 | 112.5 | ||
| 131 | G | 70.3 | Confident | 67.4 | Low | 6 Ų | 6 | 69.1 Ų | 69.1 | 6% | 0.062 | 39% | 0.393 | C | S | . | . | P | Polyproline II helix | trans | -65.2 | 143.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | P117 G119 G166 | P117-G131 WeakPolarHBondContact O-CA 3.4Å; G119-G131 VanDerWaalsContact CA-CA 3.43Å; G119-G131 VanDerWaalsContact N-CA 3.28Å; G131-G166 PolarHBondContact N-O 2.93Å |
| 132 | P | 74.7 | Confident | 66.3 | Low | 74 Ų | 74 | 72.1 Ų | 72.1 | 48% | 0.481 | 41% | 0.414 | S | S | . | . | P | Polyproline II helix | trans | -59.7 | 159.6 | 172.1 | 28 | -34.4 | 0 | 0 | 0 | 110.5 | G116 P117 G166 | G116-P132 WeakPolarHBondContact CA-O 3.32Å; P117-P132 HydrophobicContact CG-CG 3.67Å; P132-G166 PolarHBondContact O-N 3.4Å |
| 133 | R | 76.7 | Confident | 65.8 | Low | 159 Ų | 159 | 78.4 Ų | 78.4 | 60% | 0.6 | 44% | 0.439 | S | S | * | . | B | Isolated β-bridge | trans | -62.8 | 144.7 | 176.4 | -163.2 | 173.3 | -174.7 | 170.8 | 2 | 110.9 | P162 G163 | R133-P162 HydrophobicContact CG-CB 4.01Å; R133-P162 PolarHBondContact NE-O 2.9Å; R133-P162 VanDerWaalsContact NE-O 3.1Å; R133-P162 PolarHBondContact NH2-O 3.39Å; R133-G163 WeakPolarHBondContact CG-O 3.28Å; R133-G163 PolarHBondContact NE-O 3.1Å |
| 134 | G | 71.6 | Confident | 65 | Low | 6 Ų | 6 | 80.5 Ų | 80.5 | 6% | 0.062 | 46% | 0.456 | C | S | . | . | P | Polyproline II helix | trans | -57.2 | 160.3 | 171.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | P114 G116 P162 G163 V164 | P114-G134 WeakPolarHBondContact O-CA 3.46Å; G116-G134 VanDerWaalsContact CA-CA 3.48Å; G116-G134 VanDerWaalsContact N-CA 3.32Å; G134-P162 VanDerWaalsContact O-CB 3.29Å; G134-P162 WeakPolarHBondContact O-CB 3.34Å; G134-G163 PolarHBondContact N-O 2.99Å; G134-V164 PolarHBondContact N-O 2.97Å |
| 135 | S | 75.5 | Confident | 64.3 | Low | 66 Ų | 66 | 81.3 Ų | 81.3 | 46% | 0.462 | 46% | 0.464 | S | S | . | . | P | Polyproline II helix | trans | -59.5 | 158.7 | 174.8 | 58.6 | 0 | 0 | 0 | 0 | 111.1 | G113 P114 P162 G163 | G113-S135 WeakPolarHBondContact CA-O 3.41Å; P114-S135 WeakPolarHBondContact CD-OG 3.29Å; P114-S135 WeakPolarHBondContact CG-OG 3.42Å; S135-P162 WeakPolarHBondContact O-CA 3.41Å; S135-G163 PolarHBondContact O-N 3.48Å; S135-G163 VanDerWaalsContact O-N 3.16Å |
| 136 | P | 73.1 | Confident | 64 | Low | 86 Ų | 86 | 87.4 Ų | 87.4 | 56% | 0.558 | 49% | 0.485 | S | S | * | . | P | Polyproline II helix | trans | -51 | 148.3 | 170.4 | -26.6 | 36 | 0 | 0 | 0 | 111.9 | ||
| 137 | G | 66.6 | Low | 63.5 | Low | 6 Ų | 6 | 91.2 Ų | 91.2 | 6% | 0.062 | 50% | 0.498 | C | S | . | . | P | Polyproline II helix | trans | -66.1 | 161.1 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | P111 G113 G160 P161 | P111-G137 WeakPolarHBondContact O-CA 3.08Å; G113-G137 VanDerWaalsContact CA-CA 3.47Å; G113-G137 VanDerWaalsContact N-CA 3.28Å; G137-G160 PolarHBondContact N-O 3.44Å; G137-G160 PolarHBondContact O-N 3.01Å; G137-P161 PolarHBondContact N-O 3.33Å |
| 138 | T | 70.6 | Confident | 62.9 | Low | 98 Ų | 98 | 92.4 Ų | 92.4 | 60% | 0.601 | 51% | 0.505 | S | S | * | . | P | Polyproline II helix | trans | -64.1 | 159 | 172.4 | 57.5 | 0 | 0 | 0 | 0 | 109.9 | G110 P111 G160 | G110-T138 WeakPolarHBondContact CA-O 3.32Å; P111-T138 WeakPolarHBondContact CG-OG1 2.98Å; T138-G160 PolarHBondContact O-N 3.33Å |
| 139 | D | 66.8 | Low | 62 | Low | 93 Ų | 93 | 97.1 Ų | 97.1 | 50% | 0.497 | 53% | 0.526 | S | S | . | . | B | Isolated β-bridge | trans | -61 | 148.4 | 172.2 | -60.7 | -31.8 | 0 | 0 | 0 | 110.3 | Q141 A157 P159 | D139-Q141 PolarHBondContact O-N 3Å; D139-Q141 VanDerWaalsContact O-N 3.17Å; D139-A157 HydrophobicContact CB-CB 3.82Å; D139-P159 WeakPolarHBondContact OD1-CD 3.4Å; D139-P159 VanDerWaalsContact OD1-CG 3.31Å; D139-P159 WeakPolarHBondContact OD1-CG 3.19Å |
| 140 | A | 58.6 | Low | 61 | Low | 14 Ų | 14 | 96.4 Ų | 96.4 | 12% | 0.116 | 53% | 0.532 | C | S | . | . | P | Polyproline II helix | trans | -62.8 | 119 | 171.4 | 0 | 0 | 0 | 0 | 0 | 109.6 | Q108 A157 | Q108-A140 HydrophobicContact CB-CB 4.36Å; Q108-A140 WeakPolarHBondContact O-CB 3.45Å; A140-A157 HydrophobicContact CB-CB 4.38Å; A140-A157 WeakPolarHBondContact O-CB 3.24Å |
| 141 | Q | 57.1 | Low | 60 | Low | 172 Ų | 172 | 97.1 Ų | 97.1 | 80% | 0.804 | 54% | 0.543 | S | S | * | . | P | Polyproline II helix | trans | -61.2 | 132.9 | 168.4 | -70 | -115.7 | -83.2 | 0 | 0 | 108.2 | D139 K143 | D139-Q141 PolarHBondContact O-N 3Å; D139-Q141 VanDerWaalsContact O-N 3.17Å; Q141-K143 PolarHBondContact O-N 3.1Å |
| 142 | P | 53.7 | Low | 59 | Low | 103 Ų | 103 | 105 Ų | 105 | 67% | 0.669 | 58% | 0.579 | S | S | * | * | trans | -55.4 | 115.7 | 163.5 | -14.3 | 26.7 | 0 | 0 | 0 | 105.7 | D144 | P142-D144 PolarHBondContact O-N 3.33Å; P142-D144 VanDerWaalsContact O-N 3.17Å | ||
| 143 | K | 52.1 | Low | 57.8 | Low | 142 Ų | 142 | 104.1 Ų | 104.1 | 62% | 0.617 | 57% | 0.573 | S | S | * | * | trans | -55.6 | 129.1 | 166.5 | -76.7 | -173.6 | 179.7 | -179.4 | 0 | 105.3 | Q141 T145 | Q141-K143 PolarHBondContact O-N 3.1Å; K143-T145 PolarHBondContact O-N 2.94Å; K143-T145 PolarHBondContact O-OG1 3.06Å | ||
| 144 | D | 45.6 | Very low | 56.5 | Low | 163 Ų | 163 | 102.2 Ų | 102.2 | 87% | 0.872 | 58% | 0.582 | S | S | * | * | trans | -57.1 | 73.9 | 171.9 | -66.8 | -46.8 | 0 | 0 | 0 | 109.1 | P142 L146 | P142-D144 PolarHBondContact O-N 3.33Å; P142-D144 VanDerWaalsContact O-N 3.17Å; D144-L146 PolarHBondContact O-N 2.78Å | ||
| 145 | T | 46.3 | Very low | 55.4 | Low | 88 Ų | 88 | 103.9 Ų | 103.9 | 54% | 0.54 | 59% | 0.592 | S | S | . | * | trans | -86.4 | 107 | 169.4 | -39 | 0 | 0 | 0 | 0 | 101 | K143 L147 | K143-T145 PolarHBondContact O-N 2.94Å; K143-T145 PolarHBondContact O-OG1 3.06Å; T145-L147 HydrophobicContact CG2-CB 4.28Å; T145-L147 HydrophobicContact CG2-CD1 4.45Å; T145-L147 HydrophobicContact CG2-CG 4.46Å; T145-L147 PolarHBondContact O-N 3Å | ||
| 146 | L | 49 | Very low | 54.4 | Low | 173 Ų | 173 | 106 Ų | 106 | 91% | 0.906 | 60% | 0.602 | S | S | * | * | S | Bend | trans | -61.3 | 24.8 | 176.1 | -70.3 | 165.3 | 0 | 0 | 0 | 112.9 | D144 | D144-L146 PolarHBondContact O-N 2.78Š|
| 147 | L | 48.7 | Very low | 53.6 | Low | 126 Ų | 126 | 103.5 Ų | 103.5 | 66% | 0.66 | 59% | 0.589 | S | S | * | * | S | Bend | trans | -124.1 | 126.4 | 179.6 | -60.8 | 177.3 | 0 | 0 | 0 | 108.4 | T145 M149 | T145-L147 HydrophobicContact CG2-CB 4.28Å; T145-L147 HydrophobicContact CG2-CD1 4.45Å; T145-L147 HydrophobicContact CG2-CG 4.46Å; T145-L147 PolarHBondContact O-N 3Å; L147-M149 PolarHBondContact O-N 3.45Å |
| 148 | P | 51.8 | Low | 53.1 | Low | 127 Ų | 127 | 108.2 Ų | 108.2 | 83% | 0.825 | 61% | 0.612 | S | S | * | * | trans | -60.1 | 115 | 173.9 | 24 | -30.7 | 0 | 0 | 0 | 108.9 | ||||
| 149 | M | 46.4 | Very low | 52.8 | Low | 111 Ų | 111 | 106.4 Ų | 106.4 | 55% | 0.547 | 60% | 0.602 | S | S | . | * | trans | -58 | 140 | 170.3 | -66.8 | 179.6 | 82.1 | 0 | 0 | 108.6 | L147 | L147-M149 PolarHBondContact O-N 3.45Š| ||
| 150 | P | 51.6 | Low | 52.6 | Low | 95 Ų | 95 | 102.1 Ų | 102.1 | 62% | 0.617 | 58% | 0.579 | S | S | * | * | trans | -57.8 | 136.3 | 174.7 | 22.6 | -31.2 | 0 | 0 | 0 | 109.6 | Q152 | P150-Q152 PolarHBondContact O-N 3.49Š| ||
| 151 | P | 53.8 | Low | 53.1 | Low | 132 Ų | 132 | 103.1 Ų | 103.1 | 86% | 0.857 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.7 | 14.1 | -171.1 | 26.4 | -35.4 | 0 | 0 | 0 | 115.2 | ||
| 152 | Q | 49.7 | Very low | 53.8 | Low | 171 Ų | 171 | 96.9 Ų | 96.9 | 80% | 0.799 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.4 | -5.4 | -168.1 | -51.1 | -168.3 | 42.8 | 0 | 0 | 113.6 | P150 | P150-Q152 PolarHBondContact O-N 3.49Š|
| 153 | C | 48 | Very low | 54.6 | Low | 55 Ų | 55 | 92 Ų | 92 | 37% | 0.372 | 53% | 0.528 | S | S | . | . | trans | -115.3 | 106.6 | 168.3 | -76.9 | 0 | 0 | 0 | 0 | 110.2 | C104 C155 | C104-C153 HydrophobicContact CB-CB 4.33Å; C104-C153 WeakPolarHBondContact CB-SG 3.49Å; C104-C153 WeakPolarHBondContact SG-CB 3.38Å; C104-C153 CovalentContact SG-SG 2.03Å; C104-C153 PolarHBondContact SG-SG 3.07Å; C153-C155 PolarHBondContact O-N 3.49Å | ||
| 154 | P | 49.3 | Very low | 55.7 | Low | 119 Ų | 119 | 90.3 Ų | 90.3 | 77% | 0.773 | 53% | 0.529 | S | S | * | . | trans | -71.2 | 76.2 | 161.1 | 30.8 | -31 | 0 | 0 | 0 | 107.6 | V156 | P154-V156 PolarHBondContact O-N 3.05Š| ||
| 155 | C | 50.2 | Low | 57 | Low | 41 Ų | 41 | 85.5 Ų | 85.5 | 28% | 0.277 | 51% | 0.512 | S | S | . | . | trans | -65.4 | 80.9 | 162.7 | -75.6 | 0 | 0 | 0 | 0 | 107.2 | C107 C153 A157 | C107-C155 HydrophobicContact CB-CB 3.87Å; C107-C155 WeakPolarHBondContact CB-SG 3.47Å; C107-C155 WeakPolarHBondContact SG-CA 3.18Å; C107-C155 WeakPolarHBondContact SG-CB 3.27Å; C107-C155 CovalentContact SG-SG 2.06Å; C107-C155 PolarHBondContact SG-SG 3.03Å; C153-C155 PolarHBondContact O-N 3.49Å; C155-A157 PolarHBondContact O-N 3.4Å; C155-A157 VanDerWaalsContact O-N 3.08Å | ||
| 156 | V | 54.3 | Low | 57.9 | Low | 112 Ų | 112 | 81.5 Ų | 81.5 | 68% | 0.679 | 49% | 0.488 | S | S | * | . | trans | -62.8 | 111.7 | 160.9 | -176.9 | 0 | 0 | 0 | 0 | 104.3 | P154 L158 | P154-V156 PolarHBondContact O-N 3.05Å; V156-L158 PolarHBondContact O-N 2.99Å | ||
| 157 | A | 54.8 | Low | 58.9 | Low | 33 Ų | 33 | 77 Ų | 77 | 27% | 0.273 | 47% | 0.469 | S | S | . | . | trans | -51.4 | 106.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 108.3 | D139 A140 C155 | D139-A157 HydrophobicContact CB-CB 3.82Å; A140-A157 HydrophobicContact CB-CB 4.38Å; A140-A157 WeakPolarHBondContact O-CB 3.24Å; C155-A157 PolarHBondContact O-N 3.4Å; C155-A157 VanDerWaalsContact O-N 3.08Å | ||
| 158 | L | 57.5 | Low | 60 | Low | 105 Ų | 105 | 74.8 Ų | 74.8 | 55% | 0.55 | 46% | 0.462 | S | S | . | . | P | Polyproline II helix | trans | -73.6 | 131.3 | -177.1 | -75.1 | 170.7 | 0 | 0 | 0 | 107.9 | R109 G110 V156 G160 | R109-L158 HydrophobicContact CG-CB 4.38Å; G110-L158 PolarHBondContact N-O 2.92Å; V156-L158 PolarHBondContact O-N 2.99Å; L158-G160 PolarHBondContact O-N 2.77Å |
| 159 | P | 63.2 | Low | 60.5 | Low | 60 Ų | 60 | 69 Ų | 69 | 39% | 0.39 | 43% | 0.426 | S | S | . | . | B | Isolated β-bridge | trans | -49.9 | 137.9 | 171.4 | -25.2 | 29.5 | 0 | 0 | 0 | 110.6 | R109 D139 | R109-P159 WeakPolarHBondContact CG-O 3.31Å; R109-P159 PolarHBondContact NE-O 3.16Å; D139-P159 WeakPolarHBondContact OD1-CD 3.4Å; D139-P159 VanDerWaalsContact OD1-CG 3.31Å; D139-P159 WeakPolarHBondContact OD1-CG 3.19Å |
| 160 | G | 63.5 | Low | 61.6 | Low | 2 Ų | 2 | 70.3 Ų | 70.3 | 2% | 0.021 | 43% | 0.431 | C | S | . | . | P | Polyproline II helix | trans | -52.5 | 155 | 171.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | G110 P111 G137 T138 L158 | G110-G160 WeakPolarHBondContact O-CA 3.04Å; P111-G160 WeakPolarHBondContact O-CA 3.19Å; G137-G160 PolarHBondContact N-O 3.44Å; G137-G160 PolarHBondContact O-N 3.01Å; T138-G160 PolarHBondContact O-N 3.33Å; L158-G160 PolarHBondContact O-N 2.77Å |
| 161 | P | 68.1 | Low | 62.5 | Low | 36 Ų | 36 | 71.4 Ų | 71.4 | 23% | 0.234 | 43% | 0.432 | C | S | . | . | P | Polyproline II helix | trans | -56.7 | 147.4 | 176.2 | 28 | -33.2 | 0 | 0 | 0 | 109.6 | P112 G113 G137 G163 | P112-P161 VanDerWaalsContact CA-O 3.32Å; P112-P161 WeakPolarHBondContact CA-O 3.33Å; P112-P161 HydrophobicContact CB-CG 4.08Å; P112-P161 HydrophobicContact CG-CG 3.97Å; G113-P161 PolarHBondContact N-O 2.87Å; G137-P161 PolarHBondContact N-O 3.33Å; P161-G163 PolarHBondContact O-N 3.34Å |
| 162 | P | 73 | Confident | 62.3 | Low | 41 Ų | 41 | 65.7 Ų | 65.7 | 27% | 0.266 | 40% | 0.397 | S | S | . | . | P | Polyproline II helix | trans | -61.6 | 144.8 | 177.1 | -6.4 | 15.8 | 0 | 0 | 0 | 110.3 | R133 G134 S135 | R133-P162 HydrophobicContact CG-CB 4.01Å; R133-P162 PolarHBondContact NE-O 2.9Å; R133-P162 VanDerWaalsContact NE-O 3.1Å; R133-P162 PolarHBondContact NH2-O 3.39Å; G134-P162 VanDerWaalsContact O-CB 3.29Å; G134-P162 WeakPolarHBondContact O-CB 3.34Å; S135-P162 WeakPolarHBondContact O-CA 3.41Å |
| 163 | G | 68.9 | Low | 62.5 | Low | 1 Ų | 1 | 62 Ų | 62 | 1% | 0.01 | 39% | 0.39 | C | S | . | . | P | Polyproline II helix | trans | -55.2 | 165.5 | -176.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | G113 R133 G134 S135 P161 | G113-G163 WeakPolarHBondContact O-CA 3.2Å; R133-G163 WeakPolarHBondContact CG-O 3.28Å; R133-G163 PolarHBondContact NE-O 3.1Å; G134-G163 PolarHBondContact N-O 2.99Å; S135-G163 PolarHBondContact O-N 3.48Å; S135-G163 VanDerWaalsContact O-N 3.16Å; P161-G163 PolarHBondContact O-N 3.34Å |
| 164 | V | 75.7 | Confident | 62.8 | Low | 105 Ų | 105 | 64.9 Ų | 64.9 | 64% | 0.636 | 41% | 0.408 | S | S | * | . | P | Polyproline II helix | trans | -58.3 | 154.8 | 176.3 | -63.5 | 0 | 0 | 0 | 0 | 111 | P115 G116 G134 | P115-V164 HydrophobicContact CB-CG2 3.85Å; P115-V164 HydrophobicContact CG-CG2 3.97Å; G116-V164 PolarHBondContact N-O 2.94Å; G134-V164 PolarHBondContact N-O 2.97Å |
| 165 | A | 74 | Confident | 62.8 | Low | 62 Ų | 62 | 61.2 Ų | 61.2 | 51% | 0.512 | 39% | 0.392 | S | S | . | . | B | Isolated β-bridge | trans | -57.2 | 141.2 | 170.5 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||
| 166 | G | 64.8 | Low | 62.8 | Low | 5 Ų | 5 | 66.2 Ų | 66.2 | 5% | 0.052 | 42% | 0.416 | C | S | . | . | P | Polyproline II helix | trans | -63.2 | 160.5 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | G116 P117 G131 P132 | G116-G166 WeakPolarHBondContact O-CA 3.44Å; P117-G166 WeakPolarHBondContact O-CA 3.31Å; G131-G166 PolarHBondContact N-O 2.93Å; P132-G166 PolarHBondContact O-N 3.4Å |
| 167 | P | 70.9 | Confident | 62.7 | Low | 77 Ų | 77 | 65.6 Ų | 65.6 | 50% | 0.5 | 42% | 0.423 | S | S | . | . | P | Polyproline II helix | trans | -57.7 | 152.7 | 177.5 | 26.5 | -34.5 | 0 | 0 | 0 | 111 | P118 G119 | P118-P167 WeakPolarHBondContact CA-O 3.25Å; P118-P167 HydrophobicContact CB-CG 4.2Å; P118-P167 HydrophobicContact CG-CG 4.18Å; G119-P167 PolarHBondContact N-O 3.15Å |
| 168 | P | 70.4 | Confident | 62.2 | Low | 80 Ų | 80 | 66 Ų | 66 | 52% | 0.519 | 43% | 0.43 | S | S | . | . | P | Polyproline II helix | trans | -53.3 | 146.8 | 169.6 | -22 | 32.1 | 0 | 0 | 0 | 111 | ||
| 169 | G | 62.7 | Low | 61.6 | Low | 7 Ų | 7 | 65.8 Ų | 65.8 | 7% | 0.072 | 44% | 0.435 | C | S | . | . | P | Polyproline II helix | trans | -59.4 | 163.6 | 167.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | G128 K129 | G128-G169 WeakPolarHBondContact CA-O 3.4Å; K129-G169 PolarHBondContact O-N 3.33Å |
| 170 | Q | 69.4 | Low | 61.1 | Low | 138 Ų | 138 | 69 Ų | 69 | 65% | 0.645 | 46% | 0.455 | S | S | * | . | P | Polyproline II helix | trans | -68 | 150.7 | 174.1 | -63.6 | -174.1 | 13.5 | 0 | 0 | 110.5 | D121 G122 | D121-Q170 CarbonylContact C-O 3.57Å; D121-Q170 VanDerWaalsContact CA-O 3.31Å; D121-Q170 WeakPolarHBondContact CA-O 3.32Å; D121-Q170 PolarHBondContact OD1-N 3.32Å; G122-Q170 PolarHBondContact N-O 3.24Å |
| 171 | D | 71 | Confident | 60 | Low | 117 Ų | 117 | 71 Ų | 71 | 63% | 0.626 | 48% | 0.476 | S | S | * | . | P | Polyproline II helix | trans | -62.9 | 140.2 | 173.3 | -66.4 | -17.2 | 0 | 0 | 0 | 110.2 | P127 G128 S173 | P127-D171 VanDerWaalsContact CA-OD1 3.28Å; P127-D171 WeakPolarHBondContact CA-OD1 3.3Å; G128-D171 PolarHBondContact N-OD1 3.36Å; D171-S173 PolarHBondContact O-N 3.35Å |
| 172 | G | 49.3 | Very low | 59.1 | Low | 12 Ų | 12 | 80.6 Ų | 80.6 | 12% | 0.124 | 51% | 0.507 | C | S | . | . | P | Polyproline II helix | trans | -62.8 | 136.7 | 177 | 0 | 0 | 0 | 0 | 0 | 110.4 | G122 G125 A126 | G122-G172 VanDerWaalsContact C-CA 3.41Å; G122-G172 VanDerWaalsContact O-CA 3.24Å; G122-G172 WeakPolarHBondContact O-CA 3Å; G125-G172 VanDerWaalsContact CA-O 3.22Å; G125-G172 WeakPolarHBondContact CA-O 3.32Å; G125-G172 PolarHBondContact N-O 3.08Å; A126-G172 PolarHBondContact O-N 3.23Å |
| 173 | S | 53.1 | Low | 58.2 | Low | 95 Ų | 95 | 86.3 Ų | 86.3 | 66% | 0.664 | 54% | 0.536 | S | S | * | . | P | Polyproline II helix | trans | -57.3 | 147.2 | 171 | -44.5 | 0 | 0 | 0 | 0 | 110.1 | G125 D171 G175 | G125-S173 PolarHBondContact N-O 3.43Å; G125-S173 VanDerWaalsContact N-O 3.1Å; D171-S173 PolarHBondContact O-N 3.35Å; S173-G175 PolarHBondContact O-N 2.93Å |
| 174 | P | 55.4 | Low | 56.8 | Low | 115 Ų | 115 | 88.3 Ų | 88.3 | 75% | 0.747 | 56% | 0.556 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 135.7 | 170.8 | -24.7 | 34.1 | 0 | 0 | 0 | 110.1 | ||
| 175 | G | 48.3 | Very low | 55.6 | Low | 42 Ų | 42 | 92.6 Ų | 92.6 | 43% | 0.433 | 57% | 0.566 | S | S | . | * | P | Polyproline II helix | trans | -61.4 | 150.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | S173 | S173-G175 PolarHBondContact O-N 2.93Š|
| 176 | D | 50.7 | Low | 54.6 | Low | 145 Ų | 145 | 95.7 Ų | 95.7 | 78% | 0.775 | 58% | 0.581 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 144.5 | 176 | -69.1 | -44.1 | 0 | 0 | 0 | 110.9 | G178 | D176-G178 PolarHBondContact O-N 3.19Š|
| 177 | A | 52.7 | Low | 53.5 | Low | 100 Ų | 100 | 97.8 Ų | 97.8 | 83% | 0.826 | 60% | 0.603 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 134.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||
| 178 | G | 43.7 | Very low | 52.4 | Low | 41 Ų | 41 | 100.4 Ų | 100.4 | 42% | 0.423 | 62% | 0.618 | S | S | . | * | P | Polyproline II helix | trans | -58.8 | 152.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | D176 | D176-G178 PolarHBondContact O-N 3.19Š|
| 179 | P | 44.4 | Very low | 51.5 | Low | 100 Ų | 100 | 105.9 Ų | 105.9 | 65% | 0.649 | 64% | 0.637 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 151 | 177.8 | 26.7 | -34 | 0 | 0 | 0 | 111 | ||
| 180 | P | 52.4 | Low | 50.5 | Low | 127 Ų | 127 | 107.7 Ų | 107.7 | 83% | 0.825 | 66% | 0.656 | S | S | * | * | P | Polyproline II helix | trans | -52.9 | 142.7 | 172.9 | -25.1 | 34 | 0 | 0 | 0 | 111.9 | ||
| 181 | G | 41.7 | Very low | 49.6 | Very low | 44 Ų | 44 | 104.3 Ų | 104.3 | 45% | 0.454 | 66% | 0.657 | S | S | . | * | P | Polyproline II helix | trans | -57.6 | 151.1 | 175 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||
| 182 | R | 48.4 | Very low | 48.8 | Very low | 238 Ų | 238 | 105.1 Ų | 105.1 | 90% | 0.898 | 67% | 0.669 | S | S | * | * | P | Polyproline II helix | trans | -69 | 143.3 | 176.5 | -71.3 | -177.6 | 170.7 | 179.8 | -2.4 | 110.5 | ||
| 183 | D | 54.7 | Low | 48.5 | Very low | 161 Ų | 161 | 107.3 Ų | 107.3 | 86% | 0.861 | 69% | 0.692 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 139.3 | 172.6 | -66 | -39.1 | 0 | 0 | 0 | 111.1 | ||
| 184 | G | 39.3 | Very low | 48.4 | Very low | 43 Ų | 43 | 110.6 Ų | 110.6 | 44% | 0.443 | 70% | 0.702 | S | S | . | * | P | Polyproline II helix | trans | -63.2 | 146.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 185 | K | 50.2 | Low | 48.4 | Very low | 195 Ų | 195 | 111.9 Ų | 111.9 | 85% | 0.848 | 71% | 0.708 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 141.8 | 176.5 | -68.8 | -173 | 177.5 | -176.8 | 0 | 110.6 | ||
| 186 | P | 53.6 | Low | 48.2 | Very low | 127 Ų | 127 | 112.4 Ų | 112.4 | 83% | 0.825 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -54 | 141.5 | 171.4 | -24.8 | 33.8 | 0 | 0 | 0 | 111.7 | ||
| 187 | G | 41.1 | Very low | 48.2 | Very low | 50 Ų | 50 | 111.3 Ų | 111.3 | 52% | 0.515 | 71% | 0.714 | S | S | . | * | P | Polyproline II helix | trans | -63.1 | 152.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||
| 188 | T | 48.2 | Very low | 48.5 | Very low | 132 Ų | 132 | 112.6 Ų | 112.6 | 81% | 0.81 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 139 | 174.8 | 49.1 | 0 | 0 | 0 | 0 | 110.8 | ||
| 189 | Q | 52.1 | Low | 48.6 | Very low | 194 Ų | 194 | 114 Ų | 114 | 91% | 0.907 | 73% | 0.728 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 134.3 | 173.1 | -176 | 175.5 | -23.5 | 0 | 0 | 110.3 | ||
| 190 | G | 41.2 | Very low | 49 | Very low | 46 Ų | 46 | 118.6 Ų | 118.6 | 47% | 0.474 | 74% | 0.741 | S | S | . | * | P | Polyproline II helix | trans | -62.5 | 146.5 | 175 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||
| 191 | G | 49.7 | Very low | 49 | Very low | 66 Ų | 66 | 120.3 Ų | 120.3 | 68% | 0.68 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -66 | 161.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 192 | P | 54.7 | Low | 49.1 | Very low | 135 Ų | 135 | 123 Ų | 123 | 88% | 0.877 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 142.6 | 174 | -21.3 | 32.7 | 0 | 0 | 0 | 112 | ||
| 193 | G | 43.5 | Very low | 49.1 | Very low | 57 Ų | 57 | 120 Ų | 120 | 59% | 0.588 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 157.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 194 | D | 50.2 | Low | 49.2 | Very low | 164 Ų | 164 | 118.1 Ų | 118.1 | 88% | 0.877 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 147.3 | 179.2 | -68.8 | -40.3 | 0 | 0 | 0 | 112.4 | G196 | D194-G196 PolarHBondContact O-N 3Š|
| 195 | T | 55.5 | Low | 49.5 | Very low | 143 Ų | 143 | 119.7 Ų | 119.7 | 88% | 0.877 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 128 | 176 | -55.6 | 0 | 0 | 0 | 0 | 110.1 | ||
| 196 | G | 44.5 | Very low | 49.5 | Very low | 52 Ų | 52 | 120.5 Ų | 120.5 | 54% | 0.536 | 78% | 0.775 | S | S | . | * | P | Polyproline II helix | trans | -61.3 | 157 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | D194 | D194-G196 PolarHBondContact O-N 3Š|
| 197 | P | 50.8 | Low | 49.6 | Very low | 123 Ų | 123 | 124.3 Ų | 124.3 | 80% | 0.799 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 150.4 | -177.8 | 26.7 | -34.2 | 0 | 0 | 0 | 112.4 | ||
| 198 | P | 58 | Low | 49.8 | Very low | 127 Ų | 127 | 124.5 Ų | 124.5 | 83% | 0.825 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 139 | 173.8 | -23.2 | 33 | 0 | 0 | 0 | 112.5 | ||
| 199 | G | 47.4 | Very low | 50.1 | Low | 69 Ų | 69 | 124.1 Ų | 124.1 | 71% | 0.711 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -61 | 141.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 200 | Q | 51.3 | Low | 50.4 | Low | 198 Ų | 198 | 121 Ų | 121 | 93% | 0.925 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 131.9 | 176.7 | -72.4 | 179.6 | -7.1 | 0 | 0 | 111.2 | A202 | Q200-A202 PolarHBondContact O-N 2.96Š|
| 201 | N | 52.3 | Low | 50.8 | Low | 163 Ų | 163 | 121.9 Ų | 121.9 | 87% | 0.872 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 130.4 | 174.4 | -67.5 | -23.8 | 0 | 0 | 0 | 110.7 | ||
| 202 | A | 44.7 | Very low | 50.9 | Low | 99 Ų | 99 | 124.7 Ų | 124.7 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 138.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | Q200 | Q200-A202 PolarHBondContact O-N 2.96Š|
| 203 | M | 49 | Very low | 50.9 | Low | 177 Ų | 177 | 124.2 Ų | 124.2 | 87% | 0.872 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 149.6 | 175 | -81.6 | -171.7 | 83.5 | 0 | 0 | 112.2 | G205 | M203-G205 PolarHBondContact O-N 3.5Š|
| 204 | P | 55.7 | Low | 51 | Low | 121 Ų | 121 | 125.2 Ų | 125.2 | 79% | 0.786 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 136.4 | 173.5 | -23.9 | 33.4 | 0 | 0 | 0 | 112.8 | ||
| 205 | G | 45.8 | Very low | 50.8 | Low | 76 Ų | 76 | 127.2 Ų | 127.2 | 78% | 0.784 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 144.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | M203 | M203-G205 PolarHBondContact O-N 3.5Š|
| 206 | K | 50.8 | Low | 50.2 | Low | 212 Ų | 212 | 128.6 Ų | 128.6 | 92% | 0.922 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 142 | 178 | -67.6 | -176.4 | 177.2 | -179.1 | 0 | 111.3 | ||
| 207 | K | 54.9 | Low | 50.3 | Low | 206 Ų | 206 | 133 Ų | 133 | 90% | 0.896 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -58 | 131.8 | 174.2 | -174.8 | 179.9 | 178.8 | -178 | 0 | 110.6 | ||
| 208 | G | 45.9 | Very low | 49.8 | Very low | 55 Ų | 55 | 133.8 Ų | 133.8 | 57% | 0.567 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 155.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 209 | P | 53.6 | Low | 49 | Very low | 124 Ų | 124 | 131.3 Ų | 131.3 | 81% | 0.805 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -68 | 156.1 | 179.5 | 28 | -33.8 | 0 | 0 | 0 | 112.6 | ||
| 210 | P | 60 | Low | 48.8 | Very low | 129 Ų | 129 | 137.3 Ų | 137.3 | 84% | 0.838 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 144 | 173.5 | -22.1 | 33.2 | 0 | 0 | 0 | 112.6 | ||
| 211 | G | 47.9 | Very low | 48.2 | Very low | 64 Ų | 64 | 135.1 Ų | 135.1 | 66% | 0.66 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 157.4 | 176 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 212 | P | 51.7 | Low | 48 | Very low | 124 Ų | 124 | 130 Ų | 130 | 81% | 0.805 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 146.2 | -177.5 | 26.6 | -33.6 | 0 | 0 | 0 | 112.2 | ||
| 213 | P | 54.9 | Low | 48.1 | Very low | 126 Ų | 126 | 131.5 Ų | 131.5 | 82% | 0.818 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 134.7 | 173.3 | -21.7 | 32.5 | 0 | 0 | 0 | 112.1 | ||
| 214 | G | 46.5 | Very low | 48 | Very low | 77 Ų | 77 | 133 Ų | 133 | 79% | 0.794 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 129.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||
| 215 | K | 46.3 | Very low | 47.6 | Very low | 207 Ų | 207 | 129.8 Ų | 129.8 | 90% | 0.9 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 126.4 | 173 | -74.6 | 177.9 | 174.2 | -180 | 0 | 109.9 | ||
| 216 | L | 42.6 | Very low | 47.9 | Very low | 172 Ų | 172 | 132 Ų | 132 | 90% | 0.901 | 80% | 0.801 | S | S | * | * | trans | -107.1 | 118.1 | 170.4 | -145.3 | 89.7 | 0 | 0 | 0 | 109.5 | ||||
| 217 | N | 45.9 | Very low | 48.2 | Very low | 144 Ų | 144 | 127.9 Ų | 127.9 | 77% | 0.77 | 80% | 0.796 | S | S | * | * | trans | -97.4 | 126.8 | 166.1 | -73.5 | -28.1 | 0 | 0 | 0 | 108.3 | ||||
| 218 | T | 41.9 | Very low | 47.9 | Very low | 139 Ų | 139 | 121.1 Ų | 121.1 | 85% | 0.853 | 79% | 0.785 | S | S | * | * | trans | 28.6 | 129.7 | 149.8 | 42.7 | 0 | 0 | 0 | 0 | 122 | ||||
| 219 | G | 40.2 | Very low | 48.1 | Very low | 75 Ų | 75 | 124.7 Ų | 124.7 | 77% | 0.773 | 80% | 0.798 | S | S | * | * | trans | 98.6 | 117.6 | 141.5 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 220 | E | 43.8 | Very low | 48.1 | Very low | 195 Ų | 195 | 130 Ų | 130 | 91% | 0.911 | 80% | 0.802 | S | S | * | * | trans | 50.6 | 93 | 162.8 | -62.6 | -169.1 | 124.7 | 0 | 0 | 119.3 | G222 | E220-G222 PolarHBondContact O-N 3.37Š| ||
| 221 | T | 38.1 | Very low | 47.4 | Very low | 152 Ų | 152 | 127 Ų | 127 | 93% | 0.933 | 79% | 0.794 | S | S | * | * | trans | -0.1 | 89.1 | 151.3 | -35.1 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 222 | G | 47.3 | Very low | 47.4 | Very low | 55 Ų | 55 | 129.4 Ų | 129.4 | 57% | 0.567 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -97.4 | 158 | 149.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | E220 K224 | E220-G222 PolarHBondContact O-N 3.37Å; G222-K224 PolarHBondContact O-N 2.84Å |
| 223 | P | 47.3 | Very low | 47.3 | Very low | 131 Ų | 131 | 129.7 Ų | 129.7 | 85% | 0.851 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 139 | -176.7 | 24.4 | -32.9 | 0 | 0 | 0 | 111.7 | G225 | P223-G225 PolarHBondContact O-N 2.83Å; P223-G225 VanDerWaalsContact O-N 3.1Å |
| 224 | K | 45.9 | Very low | 47 | Very low | 209 Ų | 209 | 126.7 Ų | 126.7 | 91% | 0.909 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -47.5 | 116.1 | 176.2 | -176.7 | 178.1 | -179.3 | 177.9 | 0 | 109.8 | G222 | G222-K224 PolarHBondContact O-N 2.84Š|
| 225 | G | 49.4 | Very low | 47 | Very low | 54 Ų | 54 | 134.8 Ų | 134.8 | 56% | 0.557 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 149.8 | 175 | 0 | 0 | 0 | 0 | 0 | 111.3 | P223 | P223-G225 PolarHBondContact O-N 2.83Å; P223-G225 VanDerWaalsContact O-N 3.1Å |
| 226 | P | 51.1 | Low | 47.3 | Very low | 121 Ų | 121 | 129.5 Ų | 129.5 | 79% | 0.786 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 153.7 | 179.3 | 24.6 | -33.1 | 0 | 0 | 0 | 111.2 | G228 | P226-G228 PolarHBondContact O-N 2.67Š|
| 227 | P | 57 | Low | 47.5 | Very low | 126 Ų | 126 | 124.9 Ų | 124.9 | 82% | 0.818 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -48.9 | 136.6 | 173 | -25.6 | 33.8 | 0 | 0 | 0 | 111.1 | ||
| 228 | G | 48.5 | Very low | 47.8 | Very low | 65 Ų | 65 | 127.2 Ų | 127.2 | 67% | 0.67 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 149.3 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | P226 | P226-G228 PolarHBondContact O-N 2.67Š|
| 229 | P | 50.2 | Low | 48.3 | Very low | 130 Ų | 130 | 132 Ų | 132 | 84% | 0.844 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 142.5 | -177.9 | 23.3 | -32.7 | 0 | 0 | 0 | 111.2 | G231 | P229-G231 PolarHBondContact O-N 2.99Š|
| 230 | R | 53.9 | Low | 48.8 | Very low | 234 Ų | 234 | 131 Ų | 131 | 88% | 0.883 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 126.3 | 171.5 | -179.5 | 177.5 | -179.8 | 168.5 | 1.1 | 108.4 | S232 | R230-S232 PolarHBondContact O-N 3.33Š|
| 231 | G | 45.8 | Very low | 49.3 | Very low | 66 Ų | 66 | 127.6 Ų | 127.6 | 68% | 0.68 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 137.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | P229 T233 | P229-G231 PolarHBondContact O-N 2.99Å; G231-T233 PolarHBondContact O-N 2.98Å |
| 232 | S | 47.1 | Very low | 50.2 | Low | 116 Ų | 116 | 126.3 Ų | 126.3 | 81% | 0.811 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 136.7 | 178.8 | 41.4 | 0 | 0 | 0 | 0 | 110.4 | R230 G234 | R230-S232 PolarHBondContact O-N 3.33Å; S232-G234 PolarHBondContact O-N 3.37Å |
| 233 | T | 50.6 | Low | 50.2 | Low | 129 Ų | 129 | 127.1 Ų | 127.1 | 79% | 0.791 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 124.9 | 165.5 | -52.7 | 0 | 0 | 0 | 0 | 107.5 | G231 R235 | G231-T233 PolarHBondContact O-N 2.98Å; T233-R235 PolarHBondContact O-N 3.35Å |
| 234 | G | 46.9 | Very low | 50.7 | Low | 63 Ų | 63 | 129.9 Ų | 129.9 | 65% | 0.649 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -53 | 138.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | S232 A236 | S232-G234 PolarHBondContact O-N 3.37Å; G234-A236 PolarHBondContact O-N 3.01Å |
| 235 | R | 48.5 | Very low | 51.3 | Low | 248 Ų | 248 | 125.9 Ų | 125.9 | 94% | 0.936 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 139.6 | 174.7 | -80.1 | -175.8 | 170.6 | -173 | -2.2 | 109 | T233 G237 | T233-R235 PolarHBondContact O-N 3.35Å; R235-G237 PolarHBondContact O-N 3.47Å |
| 236 | A | 51 | Low | 51.2 | Low | 96 Ų | 96 | 126.4 Ų | 126.4 | 79% | 0.793 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 136.1 | 166.3 | 0 | 0 | 0 | 0 | 0 | 108.3 | G234 | G234-A236 PolarHBondContact O-N 3.01Š|
| 237 | G | 47.9 | Very low | 51.4 | Low | 74 Ų | 74 | 129.7 Ų | 129.7 | 76% | 0.763 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 142.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | R235 | R235-G237 PolarHBondContact O-N 3.47Š|
| 238 | E | 50.9 | Low | 51.4 | Low | 194 Ų | 194 | 131.5 Ų | 131.5 | 91% | 0.907 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -58 | 141.8 | 174.8 | -67.8 | -173.4 | 148.8 | 0 | 0 | 109.7 | G240 | E238-G240 PolarHBondContact O-N 3.1Š|
| 239 | R | 52.7 | Low | 51.3 | Low | 240 Ų | 240 | 131 Ų | 131 | 91% | 0.906 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 126.6 | 170.4 | -177.3 | -175.1 | -69.8 | -176.9 | -2.1 | 107 | ||
| 240 | G | 50.9 | Low | 51.4 | Low | 53 Ų | 53 | 129.1 Ų | 129.1 | 55% | 0.546 | 78% | 0.783 | S | S | . | * | P | Polyproline II helix | trans | -53.7 | 151.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111 | E238 | E238-G240 PolarHBondContact O-N 3.1Š|
| 241 | P | 53.7 | Low | 51.4 | Low | 123 Ų | 123 | 124 Ų | 124 | 80% | 0.799 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 152.6 | 178 | 25.2 | -34 | 0 | 0 | 0 | 110.8 | ||
| 242 | P | 57 | Low | 51.4 | Low | 126 Ų | 126 | 123 Ų | 123 | 82% | 0.818 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -50.1 | 143.4 | 168.8 | -23.7 | 33.3 | 0 | 0 | 0 | 110.5 | ||
| 243 | G | 48.4 | Very low | 51.5 | Low | 72 Ų | 72 | 122 Ų | 122 | 74% | 0.742 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 148.7 | 171.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||
| 244 | Q | 56.6 | Low | 51.7 | Low | 189 Ų | 189 | 127.8 Ų | 127.8 | 88% | 0.883 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 145.2 | 174.2 | -75.3 | -178.5 | -13.1 | 0 | 0 | 110.1 | ||
| 245 | P | 59.2 | Low | 51.6 | Low | 125 Ų | 125 | 126 Ų | 126 | 81% | 0.812 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 143.2 | 168.2 | -24.1 | 33.7 | 0 | 0 | 0 | 110.5 | ||
| 246 | G | 48.2 | Very low | 51.7 | Low | 64 Ų | 64 | 120.1 Ų | 120.1 | 66% | 0.66 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 152.4 | 171 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||
| 247 | Q | 54.1 | Low | 51.6 | Low | 191 Ų | 191 | 124 Ų | 124 | 89% | 0.893 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 146.3 | 173.1 | -68 | -177 | -3.6 | 0 | 0 | 110.2 | G249 | Q247-G249 PolarHBondContact O-N 3.33Š|
| 248 | D | 57.4 | Low | 51.3 | Low | 163 Ų | 163 | 122 Ų | 122 | 87% | 0.872 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -55 | 135.2 | 171.8 | -68.4 | -28.8 | 0 | 0 | 0 | 109.7 | ||
| 249 | G | 45.8 | Very low | 51.1 | Low | 54 Ų | 54 | 121.4 Ų | 121.4 | 56% | 0.557 | 73% | 0.733 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 145.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | Q247 | Q247-G249 PolarHBondContact O-N 3.33Š|
| 250 | A | 52.2 | Low | 50.9 | Low | 91 Ų | 91 | 115.8 Ų | 115.8 | 75% | 0.752 | 73% | 0.727 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 145.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111 | G252 | A250-G252 PolarHBondContact O-N 3.38Š|
| 251 | P | 55.4 | Low | 50.4 | Low | 127 Ų | 127 | 115.3 Ų | 115.3 | 83% | 0.825 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 136.9 | 174.2 | -25.7 | 33.8 | 0 | 0 | 0 | 111.4 | ||
| 252 | G | 45.3 | Very low | 49.9 | Very low | 45 Ų | 45 | 117.8 Ų | 117.8 | 46% | 0.464 | 72% | 0.723 | S | S | . | * | P | Polyproline II helix | trans | -56.7 | 149 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | A250 | A250-G252 PolarHBondContact O-N 3.38Š|
| 253 | A | 50 | Low | 49.4 | Very low | 95 Ų | 95 | 117.8 Ų | 117.8 | 79% | 0.785 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 142.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111 | G255 | A253-G255 PolarHBondContact O-N 3.41Š|
| 254 | R | 53.4 | Low | 48.9 | Very low | 250 Ų | 250 | 116.1 Ų | 116.1 | 94% | 0.943 | 71% | 0.706 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 128.2 | 172.7 | -175.5 | 178.3 | 177.4 | 178.3 | -0.1 | 108.5 | ||
| 255 | G | 45.5 | Very low | 48.3 | Very low | 27 Ų | 27 | 116.5 Ų | 116.5 | 28% | 0.278 | 71% | 0.708 | S | S | . | * | P | Polyproline II helix | trans | -57.5 | 158.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112 | A253 | A253-G255 PolarHBondContact O-N 3.41Š|
| 256 | P | 49.1 | Very low | 47.6 | Very low | 124 Ų | 124 | 114.8 Ų | 114.8 | 81% | 0.805 | 70% | 0.699 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 149.3 | 178.1 | 25.3 | -33.7 | 0 | 0 | 0 | 111.2 | G258 | P256-G258 PolarHBondContact O-N 3.5Š|
| 257 | M | 49.4 | Very low | 47.1 | Very low | 177 Ų | 177 | 112.9 Ų | 112.9 | 87% | 0.872 | 68% | 0.68 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 135.1 | 170.7 | -172.9 | 172 | 74.2 | 0 | 0 | 109 | ||
| 258 | G | 41.5 | Very low | 46.5 | Very low | 33 Ų | 33 | 113.6 Ų | 113.6 | 34% | 0.34 | 68% | 0.68 | S | S | . | * | P | Polyproline II helix | trans | -57.9 | 150.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | P256 | P256-G258 PolarHBondContact O-N 3.5Š|
| 259 | E | 47.5 | Very low | 45.9 | Very low | 181 Ų | 181 | 109.3 Ų | 109.3 | 85% | 0.846 | 66% | 0.661 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 145.1 | 175.3 | -66.4 | -164.6 | 132.6 | 0 | 0 | 110.9 | G261 | E259-G261 PolarHBondContact O-N 3.44Š|
| 260 | P | 49.4 | Very low | 45.6 | Very low | 121 Ų | 121 | 109.1 Ų | 109.1 | 79% | 0.786 | 66% | 0.659 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 140.9 | 172 | -24.9 | 34 | 0 | 0 | 0 | 111.5 | ||
| 261 | G | 39.2 | Very low | 45 | Very low | 43 Ų | 43 | 109.9 Ų | 109.9 | 44% | 0.443 | 66% | 0.659 | S | S | . | * | P | Polyproline II helix | trans | -57.8 | 149.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | E259 | E259-G261 PolarHBondContact O-N 3.44Š|
| 262 | Q | 44.4 | Very low | 44.5 | Very low | 175 Ų | 175 | 109.3 Ų | 109.3 | 82% | 0.818 | 66% | 0.655 | S | S | * | * | P | Polyproline II helix | trans | -61 | 146.7 | 172.3 | -71.8 | -172.2 | -9.4 | 0 | 0 | 110.4 | ||
| 263 | P | 45.7 | Very low | 44.2 | Very low | 126 Ų | 126 | 109 Ų | 109 | 82% | 0.818 | 65% | 0.652 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 141.7 | 172.1 | -25.4 | 34.2 | 0 | 0 | 0 | 111.7 | ||
| 264 | G | 38.5 | Very low | 43.7 | Very low | 37 Ų | 37 | 109.1 Ų | 109.1 | 38% | 0.381 | 65% | 0.653 | S | S | . | * | P | Polyproline II helix | trans | -58.6 | 152.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||
| 265 | Q | 42.8 | Very low | 43.3 | Very low | 197 Ų | 197 | 103.6 Ų | 103.6 | 92% | 0.921 | 65% | 0.647 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 142.5 | 171.7 | -67.6 | -175.1 | 18.1 | 0 | 0 | 110 | ||
| 266 | S | 43.8 | Very low | 43 | Very low | 89 Ų | 89 | 104.3 Ų | 104.3 | 62% | 0.622 | 65% | 0.654 | S | S | * | * | P | Polyproline II helix | trans | -47.5 | 140.6 | 172.4 | -72.6 | 0 | 0 | 0 | 0 | 112.6 | D124 | D124-S266 WeakPolarHBondContact OD2-CB 3.47Å; D124-S266 PolarHBondContact OD2-OG 3.25Å |
| 267 | G | 38.7 | Very low | 42.8 | Very low | 25 Ų | 25 | 104.5 Ų | 104.5 | 26% | 0.258 | 66% | 0.655 | S | S | . | * | P | Polyproline II helix | trans | -64.6 | 156.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | D124 | D124-G267 PolarHBondContact OD1-N 3.27Š|
| 268 | K | 42 | Very low | 42.5 | Very low | 205 Ų | 205 | 105.8 Ų | 105.8 | 89% | 0.891 | 66% | 0.656 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 141.4 | 170.9 | -73.5 | -175.5 | 179.3 | 178.8 | 0 | 109.3 | G270 | K268-G270 PolarHBondContact O-N 3.39Š|
| 269 | P | 45.2 | Very low | 42.3 | Very low | 74 Ų | 74 | 105.6 Ų | 105.6 | 48% | 0.481 | 65% | 0.654 | S | S | . | * | P | Polyproline II helix | trans | -57.1 | 140.8 | 176.5 | -21.6 | 33.6 | 0 | 0 | 0 | 111 | K123 | K123-P269 HydrophobicContact CD-CB 4.29Å; K123-P269 HydrophobicContact CD-CG 3.89Å; K123-P269 HydrophobicContact CG-CB 4.36Å; K123-P269 HydrophobicContact CG-CG 4.46Å; K123-P269 VanDerWaalsContact NZ-CG 3.34Å |
| 270 | G | 39.6 | Very low | 42 | Very low | 50 Ų | 50 | 102.6 Ų | 102.6 | 52% | 0.515 | 65% | 0.65 | S | S | . | * | P | Polyproline II helix | trans | -57.3 | 153.3 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | K268 | K268-G270 PolarHBondContact O-N 3.39Š|
| 271 | S | 39.2 | Very low | 41.8 | Very low | 106 Ų | 106 | 102.8 Ų | 102.8 | 74% | 0.741 | 65% | 0.651 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 138.2 | 171.9 | 49.8 | 0 | 0 | 0 | 0 | 110.1 | G273 | S271-G273 PolarHBondContact O-N 3.46Š|
| 272 | P | 45 | Very low | 41.7 | Very low | 116 Ų | 116 | 103.6 Ų | 103.6 | 75% | 0.753 | 66% | 0.66 | S | S | * | * | P | Polyproline II helix | trans | -51.1 | 133.6 | 178.3 | -26.2 | 33.6 | 0 | 0 | 0 | 112.3 | ||
| 273 | G | 39 | Very low | 41.5 | Very low | 38 Ų | 38 | 105 Ų | 105 | 39% | 0.392 | 66% | 0.664 | S | S | . | * | P | Polyproline II helix | trans | -56.9 | 152.2 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | S271 | S271-G273 PolarHBondContact O-N 3.46Š|
| 274 | A | 39.6 | Very low | 41.3 | Very low | 98 Ų | 98 | 104.4 Ų | 104.4 | 81% | 0.81 | 66% | 0.663 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 141.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | G276 | A274-G276 PolarHBondContact O-N 3.41Š|
| 275 | V | 45 | Very low | 41.4 | Very low | 134 Ų | 134 | 106 Ų | 106 | 81% | 0.812 | 68% | 0.678 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 122.4 | 176.1 | 179.1 | 0 | 0 | 0 | 0 | 108.8 | ||
| 276 | G | 39.3 | Very low | 41.2 | Very low | 41 Ų | 41 | 101 Ų | 101 | 42% | 0.423 | 67% | 0.665 | S | S | . | * | P | Polyproline II helix | trans | -59.2 | 153.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | A274 | A274-G276 PolarHBondContact O-N 3.41Š|
| 277 | P | 43.6 | Very low | 41 | Very low | 129 Ų | 129 | 101.9 Ų | 101.9 | 84% | 0.838 | 67% | 0.67 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 145.7 | 177.7 | 25.8 | -33.9 | 0 | 0 | 0 | 110.6 | G279 | P277-G279 PolarHBondContact O-N 3.47Š|
| 278 | K | 43.9 | Very low | 41.2 | Very low | 203 Ų | 203 | 107.3 Ų | 107.3 | 88% | 0.883 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 125.7 | 173.9 | -174.5 | 179.2 | 178.9 | 179.5 | 0 | 109 | ||
| 279 | G | 37.3 | Very low | 41.4 | Very low | 29 Ų | 29 | 106.2 Ų | 106.2 | 30% | 0.299 | 69% | 0.691 | S | S | . | * | P | Polyproline II helix | trans | -57.1 | 152.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | P277 | P277-G279 PolarHBondContact O-N 3.47Š|
| 280 | P | 41.1 | Very low | 41.2 | Very low | 119 Ų | 119 | 107.5 Ų | 107.5 | 77% | 0.773 | 70% | 0.701 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 151.6 | 175.5 | 25.5 | -33.4 | 0 | 0 | 0 | 110.6 | G282 | P280-G282 PolarHBondContact O-N 3.21Š|
| 281 | P | 45.1 | Very low | 41.6 | Very low | 124 Ų | 124 | 109 Ų | 109 | 81% | 0.805 | 70% | 0.702 | S | S | * | * | P | Polyproline II helix | trans | -50.5 | 132.8 | 172.1 | -25 | 33.9 | 0 | 0 | 0 | 110.8 | F283 | P281-F283 PolarHBondContact O-N 3.38Š|
| 282 | G | 36.8 | Very low | 41.9 | Very low | 61 Ų | 61 | 109.7 Ų | 109.7 | 63% | 0.629 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -59 | 135.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | P280 S284 | P280-G282 PolarHBondContact O-N 3.21Å; G282-S284 PolarHBondContact O-N 3.5Å |
| 283 | F | 40.1 | Very low | 42 | Very low | 204 Ų | 204 | 108.6 Ų | 108.6 | 90% | 0.895 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -57 | 129.8 | 173.1 | -80.2 | -89.1 | 0 | 0 | 0 | 109.6 | P281 G285 | P281-F283 PolarHBondContact O-N 3.38Å; F283-G285 PolarHBondContact O-N 3.43Å |
| 284 | S | 42.3 | Very low | 42.3 | Very low | 114 Ų | 114 | 118.2 Ų | 118.2 | 80% | 0.797 | 73% | 0.729 | S | S | * | * | trans | -55.8 | 113.8 | 168.3 | 50.3 | 0 | 0 | 0 | 0 | 108.3 | G282 S286 | G282-S284 PolarHBondContact O-N 3.5Å; S284-S286 PolarHBondContact O-N 3.41Å | ||
| 285 | G | 40.2 | Very low | 42.6 | Very low | 69 Ų | 69 | 121.5 Ų | 121.5 | 71% | 0.711 | 73% | 0.732 | S | S | * | * | trans | -59.4 | 111.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | F283 C287 | F283-G285 PolarHBondContact O-N 3.43Å; G285-C287 PolarHBondContact O-N 3.48Å | ||
| 286 | S | 38.1 | Very low | 42.3 | Very low | 92 Ų | 92 | 119.4 Ų | 119.4 | 64% | 0.643 | 73% | 0.728 | S | S | * | * | trans | -70.3 | 114.1 | 157.5 | 49.2 | 0 | 0 | 0 | 0 | 107 | S284 D288 | S284-S286 PolarHBondContact O-N 3.41Å; S286-D288 PolarHBondContact O-N 3.21Å | ||
| 287 | C | 39.6 | Very low | 42.2 | Very low | 108 Ų | 108 | 123.8 Ų | 123.8 | 73% | 0.73 | 75% | 0.749 | S | S | * | * | trans | -75.1 | 93.6 | 173.9 | -54.8 | 0 | 0 | 0 | 0 | 108.5 | G285 H289 | G285-C287 PolarHBondContact O-N 3.48Å; C287-H289 PolarHBondContact O-N 3.25Å | ||
| 288 | D | 43.5 | Very low | 42 | Very low | 140 Ų | 140 | 120.5 Ų | 120.5 | 75% | 0.749 | 74% | 0.739 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.6 | 13.5 | 169.3 | -65.1 | -55.5 | 0 | 0 | 0 | 113 | S286 | S286-D288 PolarHBondContact O-N 3.21Š|
| 289 | H | 46.6 | Very low | 41.6 | Very low | 181 Ų | 181 | 126 Ų | 126 | 84% | 0.838 | 76% | 0.756 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -125.9 | 27.7 | -176.2 | -77.7 | 71.4 | 0 | 0 | 0 | 113 | C287 | C287-H289 PolarHBondContact O-N 3.25Š|
| 290 | C | 40.6 | Very low | 41.8 | Very low | 102 Ų | 102 | 130.8 Ų | 130.8 | 69% | 0.689 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -103.4 | 120.7 | 167.9 | -147.2 | 0 | 0 | 0 | 0 | 109 | ||
| 291 | P | 47.1 | Very low | 41.8 | Very low | 82 Ų | 82 | 131.4 Ų | 131.4 | 53% | 0.532 | 78% | 0.779 | S | S | . | * | P | Polyproline II helix | trans | -58.3 | 142.3 | 164.7 | 25.1 | -31.1 | 0 | 0 | 0 | 107.9 | A293 | P291-A293 PolarHBondContact O-N 3.41Š|
| 292 | P | 46.9 | Very low | 41.6 | Very low | 120 Ų | 120 | 131.8 Ų | 131.8 | 78% | 0.779 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 123.2 | 178.2 | 22.4 | -31.3 | 0 | 0 | 0 | 107.8 | R294 | P292-R294 PolarHBondContact O-N 3.38Š|
| 293 | A | 47.3 | Very low | 41.9 | Very low | 92 Ų | 92 | 136 Ų | 136 | 76% | 0.76 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -48 | 116.8 | 169.3 | 0 | 0 | 0 | 0 | 0 | 106.7 | P291 L295 | P291-A293 PolarHBondContact O-N 3.41Å; A293-L295 VanDerWaalsContact C-N 3.27Å; A293-L295 PolarHBondContact O-N 3.1Å |
| 294 | R | 43.6 | Very low | 42 | Very low | 241 Ų | 241 | 131.8 Ų | 131.8 | 91% | 0.909 | 78% | 0.78 | S | S | * | * | trans | -58.9 | 101.7 | 168.4 | -74.6 | -173.2 | -170 | -177 | 3.8 | 105.6 | P292 A296 | P292-R294 PolarHBondContact O-N 3.38Å; R294-A296 PolarHBondContact O-N 3.49Å | ||
| 295 | L | 45.9 | Very low | 42 | Very low | 167 Ų | 167 | 132.9 Ų | 132.9 | 87% | 0.874 | 78% | 0.779 | S | S | * | * | trans | -53.2 | 102 | 151.9 | -77.6 | 158.1 | 0 | 0 | 0 | 104.8 | A293 P297 | A293-L295 VanDerWaalsContact C-N 3.27Å; A293-L295 PolarHBondContact O-N 3.1Å; L295-P297 VanDerWaalsContact O-CD 3.29Å; L295-P297 WeakPolarHBondContact O-CD 3.22Å | ||
| 296 | A | 40 | Very low | 42.2 | Very low | 89 Ų | 89 | 137.5 Ų | 137.5 | 74% | 0.736 | 78% | 0.784 | S | S | * | * | trans | -59.8 | 121.5 | 168.5 | 0 | 0 | 0 | 0 | 0 | 106.8 | R294 G298 | R294-A296 PolarHBondContact O-N 3.49Å; A296-G298 PolarHBondContact O-N 3.26Å | ||
| 297 | P | 35.7 | Very low | 42.5 | Very low | 133 Ų | 133 | 141 Ų | 141 | 86% | 0.864 | 79% | 0.794 | S | S | * | * | trans | -79.8 | 107.6 | 165.1 | 26.6 | -17.2 | 0 | 0 | 0 | 106.3 | L295 | L295-P297 VanDerWaalsContact O-CD 3.29Å; L295-P297 WeakPolarHBondContact O-CD 3.22Å | ||
| 298 | G | 40.1 | Very low | 42.7 | Very low | 60 Ų | 60 | 143.8 Ų | 143.8 | 62% | 0.619 | 80% | 0.8 | S | S | * | * | trans | -156.3 | 87.1 | 179.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | A296 | A296-G298 PolarHBondContact O-N 3.26Š| ||
| 299 | Y | 35.3 | Very low | 42.6 | Very low | 318 Ų | 318 | 144.1 Ų | 144.1 | 100% | 1.247 | 80% | 0.804 | S | S | * | * | trans | 59.9 | 0 | 159.6 | -73 | -88.3 | 0 | 0 | 0 | 119.4 |
Retrieved 299 of 299 residues in 162.5 ms
(Link to these results)