| 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 | 60.3 | Low | 86.1 | Confident | 238 Ų | 238 | 105.4 Ų | 105.4 | 100% | 1.172 | 59% | 0.586 | S | S | * | * | 0 | 127.5 | 0 | -72.3 | -65 | -175.1 | 0 | 0 | 108.8 | |||||
| 2 | A | 74.3 | Confident | 86.5 | Confident | 64 Ų | 64 | 106.9 Ų | 106.9 | 53% | 0.529 | 59% | 0.585 | S | S | . | * | trans | -69.1 | 131.4 | 176 | 0 | 0 | 0 | 0 | 0 | 110.9 | K7 | A2-K7 WeakPolarHBondContact O-CE 3.42Š| ||
| 3 | S | 86.1 | Confident | 86.7 | Confident | 73 Ų | 73 | 110 Ų | 110 | 51% | 0.51 | 59% | 0.59 | S | S | . | * | trans | -63 | 153.5 | -177.6 | 65.9 | 0 | 0 | 0 | 0 | 112.1 | A5 S6 K7 | S3-A5 VanDerWaalsContact C-N 3.3Å; S3-A5 PolarHBondContact O-N 3.07Å; S3-S6 WeakPolarHBondContact O-CB 3.37Å; S3-S6 PolarHBondContact O-N 3.37Å; S3-S6 PolarHBondContact OG-N 3.18Å; S3-K7 PolarHBondContact O-N 3.42Å | ||
| 4 | L | 87.6 | Confident | 86.9 | Confident | 142 Ų | 142 | 107.6 Ų | 107.6 | 74% | 0.743 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -59 | -41.4 | -179.9 | -70.2 | 172.8 | 0 | 0 | 0 | 111.8 | S6 K7 D8 | L4-S6 VanDerWaalsContact C-N 3.3Å; L4-S6 PolarHBondContact O-N 2.99Å; L4-K7 WeakPolarHBondContact O-CB 3.45Å; L4-K7 PolarHBondContact O-N 3.46Å; L4-K7 VanDerWaalsContact O-N 3.09Å; L4-D8 PolarHBondContact O-N 3.49Å |
| 5 | A | 88.7 | Confident | 86.8 | Confident | 74 Ų | 74 | 104 Ų | 104 | 61% | 0.612 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -58.5 | -38.1 | 174 | 0 | 0 | 0 | 0 | 0 | 113.1 | S3 K7 D8 S9 | S3-A5 VanDerWaalsContact C-N 3.3Å; S3-A5 PolarHBondContact O-N 3.07Å; A5-K7 VanDerWaalsContact C-N 3.34Å; A5-K7 PolarHBondContact O-N 3.06Å; A5-D8 PolarHBondContact O-N 3.4Å; A5-S9 WeakPolarHBondContact O-CB 3.49Å; A5-S9 PolarHBondContact O-N 3.09Å; A5-S9 PolarHBondContact O-OG 3.35Å |
| 6 | S | 89.6 | Confident | 86.3 | Confident | 62 Ų | 62 | 102.2 Ų | 102.2 | 43% | 0.434 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -66.7 | -36.5 | 175.8 | -171.7 | 0 | 0 | 0 | 0 | 112 | S3 L4 S9 Y10 | S3-S6 WeakPolarHBondContact O-CB 3.37Å; S3-S6 PolarHBondContact O-N 3.37Å; S3-S6 PolarHBondContact OG-N 3.18Å; L4-S6 VanDerWaalsContact C-N 3.3Å; L4-S6 PolarHBondContact O-N 2.99Å; S6-S9 PolarHBondContact O-OG 3.36Å; S6-S9 VanDerWaalsContact O-OG 3.06Å; S6-Y10 PolarHBondContact O-N 3.16Å |
| 7 | K | 90.6 | Very high | 85.9 | Confident | 112 Ų | 112 | 105.7 Ų | 105.7 | 49% | 0.487 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -70.3 | -41.8 | 176.3 | -64.5 | 175.3 | -176.6 | 173.6 | 0 | 111.7 | A2 S3 L4 A5 Y10 L11 | A2-K7 WeakPolarHBondContact O-CE 3.42Å; S3-K7 PolarHBondContact O-N 3.42Å; L4-K7 WeakPolarHBondContact O-CB 3.45Å; L4-K7 PolarHBondContact O-N 3.46Å; L4-K7 VanDerWaalsContact O-N 3.09Å; A5-K7 VanDerWaalsContact C-N 3.34Å; A5-K7 PolarHBondContact O-N 3.06Å; K7-Y10 WeakPolarHBondContact O-CB 3.47Å; K7-Y10 PolarHBondContact O-N 2.97Å; K7-L11 WeakPolarHBondContact O-CG 3.44Å; K7-L11 PolarHBondContact O-N 3.21Å |
| 8 | D | 91.9 | Very high | 85.3 | Confident | 88 Ų | 88 | 104.7 Ų | 104.7 | 47% | 0.471 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -67.8 | -43.5 | -179.9 | -166.6 | 33.6 | 0 | 0 | 0 | 111.8 | L4 A5 Y10 L11 Q12 | L4-D8 PolarHBondContact O-N 3.49Å; A5-D8 PolarHBondContact O-N 3.4Å; D8-Y10 PolarHBondContact O-N 3.31Å; D8-L11 PolarHBondContact O-N 2.92Å; D8-L11 VanDerWaalsContact O-N 3.08Å; D8-Q12 PolarHBondContact O-N 2.87Å |
| 9 | S | 92.9 | Very high | 84.4 | Confident | 49 Ų | 49 | 103.1 Ų | 103.1 | 34% | 0.343 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -59.9 | -31.8 | 173.5 | 75.9 | 0 | 0 | 0 | 0 | 113.2 | A5 S6 K13 | A5-S9 WeakPolarHBondContact O-CB 3.49Å; A5-S9 PolarHBondContact O-N 3.09Å; A5-S9 PolarHBondContact O-OG 3.35Å; S6-S9 PolarHBondContact O-OG 3.36Å; S6-S9 VanDerWaalsContact O-OG 3.06Å; S9-K13 WeakPolarHBondContact O-CB 3.44Å; S9-K13 WeakPolarHBondContact O-CD 3.46Å; S9-K13 VanDerWaalsContact O-CG 3.25Å; S9-K13 WeakPolarHBondContact O-CG 3.47Å; S9-K13 PolarHBondContact O-N 3.08Å; S9-K13 VanDerWaalsContact O-N 3.16Å |
| 10 | Y | 92.3 | Very high | 83.1 | Confident | 153 Ų | 153 | 101.2 Ų | 101.2 | 60% | 0.6 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -71.1 | -42.8 | 174 | 175.9 | -102.8 | 0 | 0 | 0 | 111.8 | S6 K7 D8 K13 L14 | S6-Y10 PolarHBondContact O-N 3.16Å; K7-Y10 WeakPolarHBondContact O-CB 3.47Å; K7-Y10 PolarHBondContact O-N 2.97Å; D8-Y10 PolarHBondContact O-N 3.31Å; Y10-K13 PolarHBondContact O-N 3.01Å; Y10-L14 HydrophobicContact CD1-CD1 4.12Å; Y10-L14 HydrophobicContact CE1-CD1 3.46Å; Y10-L14 VanDerWaalsContact CE1-CD1 3.46Å; Y10-L14 HydrophobicContact CE2-CD1 4.42Å; Y10-L14 PolarHBondContact O-N 3.27Å |
| 11 | L | 92.4 | Very high | 81.9 | Confident | 104 Ų | 104 | 104.5 Ų | 104.5 | 55% | 0.545 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -65.1 | -41.6 | 176.3 | -69.5 | 172.7 | 0 | 0 | 0 | 112.3 | K7 D8 L14 A15 | K7-L11 WeakPolarHBondContact O-CG 3.44Å; K7-L11 PolarHBondContact O-N 3.21Å; D8-L11 PolarHBondContact O-N 2.92Å; D8-L11 VanDerWaalsContact O-N 3.08Å; L11-L14 WeakPolarHBondContact O-CB 3.25Å; L11-L14 PolarHBondContact O-N 3.26Å; L11-A15 WeakPolarHBondContact O-CB 3.43Å; L11-A15 PolarHBondContact O-N 3.35Å |
| 12 | Q | 91 | Very high | 81.7 | Confident | 124 Ų | 124 | 101 Ų | 101 | 58% | 0.579 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -62.3 | -41.6 | 174 | -71.1 | -175.6 | 2.2 | 0 | 0 | 112.3 | D8 L14 A15 S16 | D8-Q12 PolarHBondContact O-N 2.87Å; Q12-L14 VanDerWaalsContact C-N 3.31Å; Q12-L14 PolarHBondContact O-N 3Å; Q12-A15 PolarHBondContact O-N 2.87Å; Q12-S16 PolarHBondContact O-N 3.46Å; Q12-S16 PolarHBondContact O-OG 3.33Å |
| 13 | K | 89.8 | Confident | 80.7 | Confident | 147 Ų | 147 | 105.4 Ų | 105.4 | 64% | 0.639 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -64.9 | -33.1 | 174.3 | -75.6 | 171.1 | -177.5 | 174.2 | 0 | 112.7 | S9 Y10 S16 K17 | S9-K13 WeakPolarHBondContact O-CB 3.44Å; S9-K13 WeakPolarHBondContact O-CD 3.46Å; S9-K13 VanDerWaalsContact O-CG 3.25Å; S9-K13 WeakPolarHBondContact O-CG 3.47Å; S9-K13 PolarHBondContact O-N 3.08Å; S9-K13 VanDerWaalsContact O-N 3.16Å; Y10-K13 PolarHBondContact O-N 3.01Å; K13-S16 PolarHBondContact O-OG 3.01Å; K13-K17 WeakPolarHBondContact O-CB 3.42Å; K13-K17 PolarHBondContact O-N 3.15Å |
| 14 | L | 89.1 | Confident | 79.3 | Confident | 76 Ų | 76 | 109.7 Ų | 109.7 | 40% | 0.398 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -69.1 | -46.5 | 172.7 | -109.1 | 162.7 | 0 | 0 | 0 | 111.8 | Y10 L11 Q12 K17 V18 | Y10-L14 HydrophobicContact CD1-CD1 4.12Å; Y10-L14 HydrophobicContact CE1-CD1 3.46Å; Y10-L14 VanDerWaalsContact CE1-CD1 3.46Å; Y10-L14 HydrophobicContact CE2-CD1 4.42Å; Y10-L14 PolarHBondContact O-N 3.27Å; L11-L14 WeakPolarHBondContact O-CB 3.25Å; L11-L14 PolarHBondContact O-N 3.26Å; Q12-L14 VanDerWaalsContact C-N 3.31Å; Q12-L14 PolarHBondContact O-N 3Å; L14-K17 PolarHBondContact O-N 3.48Å; L14-V18 WeakPolarHBondContact O-CG2 3.27Å; L14-V18 PolarHBondContact O-N 3.35Å |
| 15 | A | 85.8 | Confident | 77.5 | Confident | 54 Ų | 54 | 107.6 Ų | 107.6 | 45% | 0.446 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -61.4 | -45.1 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L11 Q12 K17 V18 C19 | L11-A15 WeakPolarHBondContact O-CB 3.43Å; L11-A15 PolarHBondContact O-N 3.35Å; Q12-A15 PolarHBondContact O-N 2.87Å; A15-K17 PolarHBondContact O-N 2.93Å; A15-V18 PolarHBondContact O-N 3.07Å; A15-C19 WeakPolarHBondContact O-CB 3.4Å; A15-C19 PolarHBondContact O-N 3.47Å |
| 16 | S | 78.4 | Confident | 76.1 | Confident | 75 Ų | 75 | 113.7 Ų | 113.7 | 52% | 0.524 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -63.7 | -39.9 | 177.3 | 62.4 | 0 | 0 | 0 | 0 | 112.4 | Q12 K13 V18 A20 | Q12-S16 PolarHBondContact O-N 3.46Å; Q12-S16 PolarHBondContact O-OG 3.33Å; K13-S16 PolarHBondContact O-OG 3.01Å; S16-V18 PolarHBondContact O-N 3.21Å; S16-A20 VanDerWaalsContact O-CB 3.27Å; S16-A20 WeakPolarHBondContact O-CB 3.39Å; S16-A20 PolarHBondContact O-N 3.31Å |
| 17 | K | 79.4 | Confident | 74.5 | Confident | 162 Ų | 162 | 117.6 Ų | 117.6 | 70% | 0.704 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -63.2 | -40.6 | 176.8 | -151.5 | 76.3 | 176.1 | -177.6 | 0 | 112.5 | K13 L14 A15 | K13-K17 WeakPolarHBondContact O-CB 3.42Å; K13-K17 PolarHBondContact O-N 3.15Å; L14-K17 PolarHBondContact O-N 3.48Å; A15-K17 PolarHBondContact O-N 2.93Å |
| 18 | V | 75.7 | Confident | 73.2 | Confident | 87 Ų | 87 | 122 Ų | 122 | 53% | 0.527 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -76 | -39.8 | -179.2 | 174.7 | 0 | 0 | 0 | 0 | 112 | L14 A15 S16 Q21 | L14-V18 WeakPolarHBondContact O-CG2 3.27Å; L14-V18 PolarHBondContact O-N 3.35Å; A15-V18 PolarHBondContact O-N 3.07Å; S16-V18 PolarHBondContact O-N 3.21Å; V18-Q21 PolarHBondContact O-N 3.34Å |
| 19 | C | 67.1 | Low | 71.8 | Confident | 74 Ų | 74 | 123.1 Ų | 123.1 | 50% | 0.5 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -68.2 | -41.8 | 177 | -76.5 | 0 | 0 | 0 | 0 | 112.7 | A15 Q21 Q22 Q23 | A15-C19 WeakPolarHBondContact O-CB 3.4Å; A15-C19 PolarHBondContact O-N 3.47Å; C19-Q21 PolarHBondContact O-N 3.28Å; C19-Q22 PolarHBondContact O-N 3.4Å; C19-Q23 PolarHBondContact O-N 3.02Å |
| 20 | A | 59.9 | Low | 70.4 | Confident | 66 Ų | 66 | 129.8 Ų | 129.8 | 55% | 0.545 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -58.2 | -35.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | S16 Q22 Q23 | S16-A20 VanDerWaalsContact O-CB 3.27Å; S16-A20 WeakPolarHBondContact O-CB 3.39Å; S16-A20 PolarHBondContact O-N 3.31Å; A20-Q22 PolarHBondContact O-N 3.49Å; A20-Q23 PolarHBondContact O-N 3.24Å |
| 21 | Q | 57.3 | Low | 69 | Low | 171 Ų | 171 | 128.1 Ų | 128.1 | 80% | 0.799 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.6 | -10.7 | 178.8 | -164.5 | 167.3 | 0.6 | 0 | 0 | 114.2 | V18 C19 | V18-Q21 PolarHBondContact O-N 3.34Å; C19-Q21 PolarHBondContact O-N 3.28Å |
| 22 | Q | 55.5 | Low | 67 | Low | 165 Ų | 165 | 127.3 Ų | 127.3 | 77% | 0.771 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.6 | -13.8 | 175.7 | -68.5 | -78.5 | -18.6 | 0 | 0 | 113.3 | C19 A20 | C19-Q22 PolarHBondContact O-N 3.4Å; A20-Q22 PolarHBondContact O-N 3.49Å |
| 23 | Q | 53.6 | Low | 64.7 | Low | 156 Ų | 156 | 130.8 Ų | 130.8 | 73% | 0.729 | 67% | 0.666 | S | S | * | * | trans | -112.8 | 21.3 | -167.6 | -73.1 | -170.7 | -15.3 | 0 | 0 | 115.4 | C19 A20 P25 | C19-Q23 PolarHBondContact O-N 3.02Å; A20-Q23 PolarHBondContact O-N 3.24Å; Q23-P25 WeakPolarHBondContact O-CD 3.12Å | ||
| 24 | E | 56.1 | Low | 62.6 | Low | 162 Ų | 162 | 132.3 Ų | 132.3 | 76% | 0.757 | 68% | 0.675 | S | S | * | * | trans | -74.3 | 112.5 | 160.1 | -80.3 | -163.6 | 164.4 | 0 | 0 | 110.2 | R26 | E24-R26 PolarHBondContact O-N 3.17Š| ||
| 25 | P | 50.3 | Low | 60.7 | Low | 99 Ų | 99 | 131.8 Ų | 131.8 | 64% | 0.643 | 69% | 0.689 | S | S | * | * | trans | -67.1 | 108.5 | 170.3 | 29 | -33.2 | 0 | 0 | 0 | 108.3 | Q23 N27 | Q23-P25 WeakPolarHBondContact O-CD 3.12Å; P25-N27 PolarHBondContact O-N 2.75Å | ||
| 26 | R | 59.1 | Low | 58.3 | Low | 201 Ų | 201 | 132.4 Ų | 132.4 | 76% | 0.758 | 70% | 0.7 | S | S | * | * | trans | -71 | 70.6 | 173 | -75.5 | -175.7 | 170.8 | 179.4 | -0.5 | 110.9 | E24 R28 | E24-R26 PolarHBondContact O-N 3.17Å; R26-R28 PolarHBondContact O-N 3.01Å | ||
| 27 | N | 56.2 | Low | 56.8 | Low | 145 Ų | 145 | 140.7 Ų | 140.7 | 78% | 0.775 | 72% | 0.72 | S | S | * | * | trans | -70.1 | 66.5 | 169.1 | -70.3 | -20.5 | 0 | 0 | 0 | 109.9 | P25 | P25-N27 PolarHBondContact O-N 2.75Š| ||
| 28 | R | 63.6 | Low | 54.9 | Low | 205 Ų | 205 | 139.5 Ų | 139.5 | 77% | 0.774 | 73% | 0.726 | S | S | * | * | trans | -91.5 | 117.5 | 165.2 | -68.5 | -174.1 | 178.2 | -170.2 | -2.7 | 107.3 | R26 | R26-R28 PolarHBondContact O-N 3.01Š| ||
| 29 | P | 62 | Low | 53.7 | Low | 111 Ų | 111 | 140.4 Ų | 140.4 | 72% | 0.721 | 74% | 0.742 | S | S | * | * | trans | -59.1 | 142.2 | 174.8 | 24.5 | -32.9 | 0 | 0 | 0 | 110.1 | V31 | P29-V31 PolarHBondContact O-N 2.79Š| ||
| 30 | F | 63.4 | Low | 52.5 | Low | 188 Ų | 188 | 139.9 Ų | 139.9 | 83% | 0.825 | 75% | 0.749 | S | S | * | * | trans | -69.1 | 100.7 | 176.9 | 175.2 | -97.2 | 0 | 0 | 0 | 109.4 | P32 | F30-P32 HydrophobicContact CE1-CG 4.5Å; F30-P32 WeakPolarHBondContact O-CD 3.4Å | ||
| 31 | V | 62.5 | Low | 51.8 | Low | 118 Ų | 118 | 142.4 Ų | 142.4 | 72% | 0.715 | 76% | 0.76 | S | S | * | * | trans | -81.7 | 118.5 | 174 | -176 | 0 | 0 | 0 | 0 | 108.9 | P29 F33 | P29-V31 PolarHBondContact O-N 2.79Å; V31-F33 PolarHBondContact O-N 3.43Å | ||
| 32 | P | 50.3 | Low | 51.2 | Low | 88 Ų | 88 | 140.4 Ų | 140.4 | 57% | 0.571 | 76% | 0.762 | S | S | * | * | trans | -61.5 | 132.5 | 171.9 | -20.4 | 33.3 | 0 | 0 | 0 | 109.9 | F30 Q34 | F30-P32 HydrophobicContact CE1-CG 4.5Å; F30-P32 WeakPolarHBondContact O-CD 3.4Å; P32-Q34 PolarHBondContact O-N 2.61Å | ||
| 33 | F | 44.7 | Very low | 50.5 | Low | 197 Ų | 197 | 142.3 Ų | 142.3 | 86% | 0.864 | 77% | 0.768 | S | S | * | * | trans | -65.2 | 93.7 | 178 | 177.1 | -99.6 | 0 | 0 | 0 | 110.6 | V31 | V31-F33 PolarHBondContact O-N 3.43Š| ||
| 34 | Q | 43.8 | Very low | 49.8 | Very low | 178 Ų | 178 | 144.3 Ų | 144.3 | 83% | 0.832 | 77% | 0.774 | S | S | * | * | trans | -72.1 | 128.2 | 167.7 | -68.2 | -159.4 | 6.9 | 0 | 0 | 109.6 | P32 G36 | P32-Q34 PolarHBondContact O-N 2.61Å; Q34-G36 VanDerWaalsContact C-N 3.35Å; Q34-G36 PolarHBondContact O-N 3.32Å | ||
| 35 | G | 49.2 | Very low | 49.2 | Very low | 66 Ų | 66 | 148.1 Ų | 148.1 | 68% | 0.68 | 78% | 0.782 | S | S | * | * | trans | -74.2 | 77.4 | -172.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | R37 | G35-R37 PolarHBondContact O-N 3.36Š| ||
| 36 | G | 36 | Very low | 48.6 | Very low | 66 Ų | 66 | 150.6 Ų | 150.6 | 68% | 0.68 | 79% | 0.789 | S | S | * | * | trans | -64.5 | 122.1 | 170.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q34 V38 | Q34-G36 VanDerWaalsContact C-N 3.35Å; Q34-G36 PolarHBondContact O-N 3.32Å; G36-V38 PolarHBondContact O-N 2.94Å | ||
| 37 | R | 48.2 | Very low | 47.5 | Very low | 249 Ų | 249 | 150.1 Ų | 150.1 | 94% | 0.94 | 79% | 0.793 | S | S | * | * | trans | -79.5 | 98.4 | 175.3 | -64.6 | 179.4 | -173.4 | -122.3 | 3.3 | 110.2 | G35 | G35-R37 PolarHBondContact O-N 3.36Š| ||
| 38 | V | 39 | Very low | 46.6 | Very low | 138 Ų | 138 | 149.2 Ų | 149.2 | 84% | 0.836 | 79% | 0.793 | S | S | * | * | trans | -126.2 | 131.4 | 164.8 | -175.6 | 0 | 0 | 0 | 0 | 109.2 | G36 G40 | G36-V38 PolarHBondContact O-N 2.94Å; V38-G40 PolarHBondContact O-N 3.23Å; V38-G40 VanDerWaalsContact O-N 3.07Å | ||
| 39 | A | 49.8 | Very low | 45.3 | Very low | 105 Ų | 105 | 146.2 Ų | 146.2 | 87% | 0.868 | 79% | 0.792 | S | S | * | * | trans | -74.7 | 97.7 | -172.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 40 | G | 42.3 | Very low | 44.1 | Very low | 63 Ų | 63 | 149.4 Ų | 149.4 | 65% | 0.649 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 152.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | V38 | V38-G40 PolarHBondContact O-N 3.23Å; V38-G40 VanDerWaalsContact O-N 3.07Å |
| 41 | P | 45.7 | Very low | 43 | Very low | 120 Ų | 120 | 149.3 Ų | 149.3 | 78% | 0.779 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 151.9 | -172.5 | 26.5 | -35.4 | 0 | 0 | 0 | 114 | K43 | P41-K43 PolarHBondContact O-N 3.43Š|
| 42 | P | 44.1 | Very low | 41.8 | Very low | 128 Ų | 128 | 152.5 Ų | 152.5 | 83% | 0.831 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 127.5 | -169.9 | 24.9 | -33.9 | 0 | 0 | 0 | 113.4 | K44 | P42-K44 PolarHBondContact O-N 3.08Š|
| 43 | K | 41.4 | Very low | 41.1 | Very low | 205 Ų | 205 | 155.3 Ų | 155.3 | 89% | 0.891 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 120.6 | 178.2 | -67.9 | 177.5 | -179.8 | 174.2 | 0 | 111.1 | P41 R45 | P41-K43 PolarHBondContact O-N 3.43Å; K43-R45 PolarHBondContact O-N 3.35Å |
| 44 | K | 38.1 | Very low | 40.5 | Very low | 198 Ų | 198 | 150.8 Ų | 150.8 | 86% | 0.861 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 123.9 | 175.7 | -72.5 | -178.2 | 176.1 | 177.6 | 0 | 111.1 | P42 N46 | P42-K44 PolarHBondContact O-N 3.08Å; K44-N46 PolarHBondContact O-N 2.84Å |
| 45 | R | 42.6 | Very low | 40 | Very low | 243 Ų | 243 | 148.2 Ų | 148.2 | 92% | 0.917 | 80% | 0.801 | S | S | * | * | trans | -66.6 | 112.7 | 170.9 | -96.2 | 164.8 | 56 | -164.7 | -1.9 | 110.1 | K43 K47 | K43-R45 PolarHBondContact O-N 3.35Å; R45-K47 PolarHBondContact O-N 3.29Å | ||
| 46 | N | 39.3 | Very low | 39.3 | Very low | 150 Ų | 150 | 151.8 Ų | 151.8 | 80% | 0.802 | 81% | 0.805 | S | S | * | * | trans | -69.6 | 118.2 | 167.7 | -74.9 | -18.9 | 0 | 0 | 0 | 109.6 | K44 T48 | K44-N46 PolarHBondContact O-N 2.84Å; N46-T48 PolarHBondContact O-N 3.03Å | ||
| 47 | K | 35.3 | Very low | 39.2 | Very low | 191 Ų | 191 | 153.8 Ų | 153.8 | 83% | 0.83 | 81% | 0.808 | S | S | * | * | trans | -81.1 | 97.3 | 176.9 | -154.7 | 178.1 | -172.9 | -176.8 | 0 | 108.2 | R45 N49 | R45-K47 PolarHBondContact O-N 3.29Å; K47-N49 PolarHBondContact O-N 3.28Å | ||
| 48 | T | 38.4 | Very low | 38.6 | Very low | 127 Ų | 127 | 149.5 Ų | 149.5 | 78% | 0.779 | 80% | 0.804 | S | S | * | * | trans | -74.6 | 108.1 | 174.3 | 44.8 | 0 | 0 | 0 | 0 | 109.9 | N46 H50 | N46-T48 PolarHBondContact O-N 3.03Å; T48-H50 PolarHBondContact O-N 2.98Å | ||
| 49 | N | 36.2 | Very low | 38.3 | Very low | 142 Ų | 142 | 149.8 Ų | 149.8 | 76% | 0.759 | 81% | 0.806 | S | S | * | * | trans | -71.2 | 111.6 | 172.3 | -69.3 | -16.8 | 0 | 0 | 0 | 109.3 | K47 K51 | K47-N49 PolarHBondContact O-N 3.28Å; N49-K51 PolarHBondContact O-N 3.32Å | ||
| 50 | H | 36.8 | Very low | 37.4 | Very low | 178 Ų | 178 | 148.8 Ų | 148.8 | 82% | 0.824 | 80% | 0.797 | S | S | * | * | trans | -73.6 | 103.1 | 172.5 | -131.8 | -63.4 | 0 | 0 | 0 | 108.3 | T48 | T48-H50 PolarHBondContact O-N 2.98Š| ||
| 51 | K | 38.8 | Very low | 36.9 | Very low | 185 Ų | 185 | 155.2 Ų | 155.2 | 80% | 0.804 | 81% | 0.807 | S | S | * | * | trans | -75.2 | 122.4 | 158.2 | -76.7 | -168.5 | 171.9 | -167.9 | 0 | 107 | N49 | N49-K51 PolarHBondContact O-N 3.32Š| ||
| 52 | Q | 37 | Very low | 36.4 | Very low | 186 Ų | 186 | 158.7 Ų | 158.7 | 87% | 0.869 | 81% | 0.812 | S | S | * | * | trans | -71.9 | 126.3 | 165.4 | -67.3 | -170.6 | -4.2 | 0 | 0 | 107.6 | ||||
| 53 | I | 37.3 | Very low | 36 | Very low | 146 Ų | 146 | 161.8 Ų | 161.8 | 75% | 0.749 | 82% | 0.816 | S | S | * | * | trans | -101.2 | 110.1 | 164.7 | -66.1 | 172.2 | 0 | 0 | 0 | 104 | ||||
| 54 | S | 32.4 | Very low | 35.5 | Very low | 103 Ų | 103 | 161.3 Ų | 161.3 | 72% | 0.72 | 81% | 0.814 | S | S | * | * | trans | -64.7 | 135.6 | 167.2 | 48.1 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 55 | V | 33.4 | Very low | 35.1 | Very low | 123 Ų | 123 | 159.6 Ų | 159.6 | 75% | 0.745 | 81% | 0.813 | S | S | * | * | trans | -115.3 | 101.2 | 174.6 | -167.9 | 0 | 0 | 0 | 0 | 106.2 | S57 | V55-S57 PolarHBondContact O-N 3.08Å; V55-S57 VanDerWaalsContact O-N 3.15Å | ||
| 56 | N | 34.3 | Very low | 34.8 | Very low | 142 Ų | 142 | 153.4 Ų | 153.4 | 76% | 0.759 | 80% | 0.804 | S | S | * | * | trans | -67.5 | 111.1 | 173.8 | -74.9 | 1.1 | 0 | 0 | 0 | 108.7 | N58 | N56-N58 PolarHBondContact O-N 3.14Š| ||
| 57 | S | 33.6 | Very low | 34.3 | Very low | 107 Ų | 107 | 154.7 Ų | 154.7 | 75% | 0.748 | 81% | 0.81 | S | S | * | * | trans | -85.6 | 94.4 | 172.2 | 54.3 | 0 | 0 | 0 | 0 | 109.9 | V55 | V55-S57 PolarHBondContact O-N 3.08Å; V55-S57 VanDerWaalsContact O-N 3.15Å | ||
| 58 | N | 35.4 | Very low | 34.2 | Very low | 159 Ų | 159 | 155 Ų | 155 | 85% | 0.85 | 81% | 0.812 | S | S | * | * | trans | -71.9 | 139.1 | 169.3 | -85.7 | -18.6 | 0 | 0 | 0 | 111 | N56 | N56-N58 PolarHBondContact O-N 3.14Š| ||
| 59 | V | 32 | Very low | 34.3 | Very low | 145 Ų | 145 | 154.3 Ų | 154.3 | 88% | 0.879 | 81% | 0.809 | S | S | * | * | trans | -76.9 | 131 | -172.8 | 173.7 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 60 | A | 31 | Very low | 34 | Very low | 83 Ų | 83 | 154.6 Ų | 154.6 | 69% | 0.686 | 81% | 0.811 | S | S | * | * | trans | -145.1 | 95.8 | 167.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 61 | K | 33.1 | Very low | 33.9 | Very low | 199 Ų | 199 | 155.6 Ų | 155.6 | 87% | 0.865 | 81% | 0.813 | S | S | * | * | trans | 29.3 | 110.2 | 145.3 | -59.4 | 176.7 | -179.4 | 179.1 | 0 | 118.2 | ||||
| 62 | H | 33.3 | Very low | 33.4 | Very low | 192 Ų | 192 | 156.4 Ų | 156.4 | 89% | 0.889 | 82% | 0.816 | S | S | * | * | trans | -113.1 | 143.2 | 151.4 | -86.8 | -75.5 | 0 | 0 | 0 | 110.8 | ||||
| 63 | Q | 36.7 | Very low | 33.1 | Very low | 194 Ų | 194 | 156.4 Ų | 156.4 | 91% | 0.907 | 82% | 0.821 | S | S | * | * | trans | -86.5 | 157.9 | -176.1 | -66.4 | 169.5 | -9.3 | 0 | 0 | 111.7 | ||||
| 64 | K | 30.8 | Very low | 32.6 | Very low | 194 Ų | 194 | 153.6 Ų | 153.6 | 84% | 0.843 | 82% | 0.82 | S | S | * | * | trans | -74.5 | 161.7 | -176.6 | -66.2 | 174.4 | 175.7 | 177.7 | 0 | 112.8 | ||||
| 65 | L | 29.3 | Very low | 32.7 | Very low | 162 Ų | 162 | 157 Ų | 157 | 85% | 0.848 | 83% | 0.828 | S | S | * | * | 162.2 | 163.6 | 121.9 | -82.4 | 172.7 | 0 | 0 | 0 | 110 | |||||
| 66 | P | 36.1 | Very low | 32.7 | Very low | 113 Ų | 113 | 157.3 Ų | 157.3 | 73% | 0.734 | 83% | 0.831 | S | S | * | * | -122.4 | 162.6 | -92.5 | 31.5 | -11.3 | 0 | 0 | 0 | 114.9 | |||||
| 67 | L | 29.3 | Very low | 33.1 | Very low | 177 Ų | 177 | 156.4 Ų | 156.4 | 93% | 0.927 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -83.2 | 134.4 | 170.5 | -78.3 | 149.8 | 0 | 0 | 0 | 110.9 | ||
| 68 | K | 33.8 | Very low | 32.8 | Very low | 199 Ų | 199 | 156.1 Ų | 156.1 | 87% | 0.865 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -101.3 | 142.4 | 160.3 | -78.7 | -169.5 | 176.5 | -175.6 | 0 | 109.8 | ||
| 69 | P | 39 | Very low | 32.8 | Very low | 111 Ų | 111 | 156.8 Ų | 156.8 | 72% | 0.721 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -87.8 | 151.3 | 179.5 | 35.8 | -34.3 | 0 | 0 | 0 | 111.4 | ||
| 70 | N | 31.1 | Very low | 32.6 | Very low | 149 Ų | 149 | 161.2 Ų | 161.2 | 80% | 0.797 | 84% | 0.835 | S | S | * | * | trans | 179 | 111.1 | 144.2 | -105.8 | -32.6 | 0 | 0 | 0 | 114 | ||||
| 71 | K | 34.3 | Very low | 32.5 | Very low | 199 Ų | 199 | 161.5 Ų | 161.5 | 87% | 0.865 | 84% | 0.838 | S | S | * | * | 157 | 134.2 | 107.1 | -94.5 | 168.7 | -178.6 | -174.5 | 0 | 111.8 | |||||
| 72 | K | 29.1 | Very low | 32.9 | Very low | 202 Ų | 202 | 158.3 Ų | 158.3 | 88% | 0.878 | 84% | 0.837 | S | S | * | * | trans | -76.6 | 145.5 | 173.7 | -54.8 | 171.5 | 179.9 | 178.2 | 0 | 109.4 | ||||
| 73 | L | 29.8 | Very low | 32.7 | Very low | 185 Ų | 185 | 152.1 Ų | 152.1 | 97% | 0.969 | 83% | 0.826 | S | S | * | * | trans | -136.8 | 129.2 | 138.1 | -84.8 | 178.4 | 0 | 0 | 0 | 107.6 | ||||
| 74 | A | 27.6 | Very low | 32.3 | Very low | 88 Ų | 88 | 149.6 Ų | 149.6 | 73% | 0.727 | 82% | 0.823 | S | S | * | * | trans | -110.6 | 144.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 75 | I | 34.3 | Very low | 32.4 | Very low | 174 Ų | 174 | 147.1 Ų | 147.1 | 89% | 0.892 | 82% | 0.824 | S | S | * | * | trans | -130.3 | 137.8 | 155.2 | -61.4 | -177.5 | 0 | 0 | 0 | 106.6 | ||||
| 76 | T | 33.3 | Very low | 32.4 | Very low | 129 Ų | 129 | 146.1 Ų | 146.1 | 79% | 0.791 | 82% | 0.815 | S | S | * | * | trans | -89.3 | 170.7 | -164.6 | 26.8 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 77 | P | 41.8 | Very low | 32.3 | Very low | 123 Ų | 123 | 150.1 Ų | 150.1 | 80% | 0.799 | 82% | 0.824 | S | S | * | * | trans | -99.9 | 171.9 | -161.5 | 39.6 | -36.3 | 0 | 0 | 0 | 114.5 | ||||
| 78 | A | 28.5 | Very low | 32.3 | Very low | 101 Ų | 101 | 149.7 Ų | 149.7 | 84% | 0.835 | 82% | 0.815 | S | S | * | * | trans | -132.9 | 140.5 | 163 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 79 | Q | 34.7 | Very low | 32.1 | Very low | 174 Ų | 174 | 148.1 Ų | 148.1 | 81% | 0.813 | 81% | 0.814 | S | S | * | * | trans | -85.7 | 171.6 | 177.1 | -56.8 | 161.7 | -19.4 | 0 | 0 | 108.8 | ||||
| 80 | R | 27.3 | Very low | 31.7 | Very low | 237 Ų | 237 | 148 Ų | 148 | 89% | 0.894 | 82% | 0.816 | S | S | * | * | cis | -162.6 | 170.1 | 36.4 | -132.7 | 166.1 | -169 | -176.4 | 1.8 | 109.9 | ||||
| 81 | A | 29.9 | Very low | 31.6 | Very low | 89 Ų | 89 | 150.9 Ų | 150.9 | 74% | 0.736 | 82% | 0.821 | S | S | * | * | trans | -99.1 | -157.2 | -175 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 82 | P | 41.9 | Very low | 31.2 | Very low | 132 Ų | 132 | 146.2 Ų | 146.2 | 86% | 0.857 | 82% | 0.82 | S | S | * | * | cis | -140.9 | -173.6 | -6.6 | 39.6 | -18.2 | 0 | 0 | 0 | 116.9 | ||||
| 83 | G | 27.3 | Very low | 31 | Very low | 63 Ų | 63 | 143 Ų | 143 | 65% | 0.649 | 82% | 0.818 | S | S | * | * | trans | 140.7 | 92.5 | 166.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 84 | V | 29.5 | Very low | 31.2 | Very low | 140 Ų | 140 | 140.3 Ų | 140.3 | 85% | 0.848 | 81% | 0.809 | S | S | * | * | 66.4 | 125.7 | 86.7 | 174 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 85 | V | 32.3 | Very low | 31.8 | Very low | 142 Ų | 142 | 141.3 Ų | 141.3 | 86% | 0.861 | 81% | 0.808 | S | S | * | * | cis | -120.3 | -175.9 | 25.3 | -164.6 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 86 | E | 28.8 | Very low | 31.6 | Very low | 142 Ų | 142 | 140.8 Ų | 140.8 | 66% | 0.664 | 81% | 0.807 | S | S | * | * | trans | -108.2 | 157.7 | -171.5 | -174.6 | 178.6 | -153.6 | 0 | 0 | 113 | K88 | E86-K88 IonicContact OE1-NZ 2.68Š| ||
| 87 | Q | 34.7 | Very low | 31.3 | Very low | 196 Ų | 196 | 138.5 Ų | 138.5 | 92% | 0.916 | 81% | 0.808 | S | S | * | * | trans | -169.4 | 139.7 | 133.7 | -106.1 | 177.2 | 9.7 | 0 | 0 | 112.3 | ||||
| 88 | K | 29.7 | Very low | 30.8 | Very low | 169 Ų | 169 | 138.8 Ų | 138.8 | 74% | 0.735 | 81% | 0.808 | S | S | * | * | trans | -112.2 | -170.4 | -176.2 | -70.8 | 172.3 | -180 | 149.6 | 0 | 111 | E86 | E86-K88 IonicContact OE1-NZ 2.68Š| ||
| 89 | I | 29.3 | Very low | 30.8 | Very low | 165 Ų | 165 | 141 Ų | 141 | 85% | 0.846 | 81% | 0.81 | S | S | * | * | trans | 99 | 131.3 | 166.9 | -54.5 | 161 | 0 | 0 | 0 | 113.1 | ||||
| 90 | S | 31.5 | Very low | 30.7 | Very low | 109 Ų | 109 | 137.5 Ų | 137.5 | 76% | 0.762 | 80% | 0.801 | S | S | * | * | cis | -158.8 | 168.5 | -29.9 | 59.1 | 0 | 0 | 0 | 0 | 108 | ||||
| 91 | K | 28.9 | Very low | 30.8 | Very low | 209 Ų | 209 | 134.1 Ų | 134.1 | 91% | 0.909 | 80% | 0.795 | S | S | * | * | trans | -99 | 143.6 | 170.8 | -74.4 | 176.3 | 176 | 173.6 | 0 | 110.1 | ||||
| 92 | A | 25.1 | Very low | 30.8 | Very low | 102 Ų | 102 | 134.9 Ų | 134.9 | 84% | 0.843 | 79% | 0.791 | S | S | * | * | trans | -144.7 | 159.8 | 158.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 93 | T | 24.7 | Very low | 30.4 | Very low | 135 Ų | 135 | 137.9 Ų | 137.9 | 83% | 0.828 | 79% | 0.79 | S | S | * | * | trans | -119 | 152.8 | -162.7 | -59.1 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 94 | V | 34.7 | Very low | 30.8 | Very low | 128 Ų | 128 | 143.9 Ų | 143.9 | 78% | 0.776 | 80% | 0.801 | S | S | * | * | trans | -51.2 | 160 | 169.3 | -109.6 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 95 | P | 40.3 | Very low | 31.1 | Very low | 109 Ų | 109 | 146.6 Ų | 146.6 | 71% | 0.708 | 80% | 0.802 | S | S | * | * | -156.7 | 171.1 | 58.7 | 42.7 | -21.1 | 0 | 0 | 0 | 121 | |||||
| 96 | N | 29.1 | Very low | 31.8 | Very low | 163 Ų | 163 | 144.9 Ų | 144.9 | 87% | 0.872 | 79% | 0.794 | S | S | * | * | trans | 53.8 | 140.7 | 147 | -67 | -2.9 | 0 | 0 | 0 | 123.6 | ||||
| 97 | G | 28.2 | Very low | 32 | Very low | 80 Ų | 80 | 148.1 Ų | 148.1 | 83% | 0.825 | 81% | 0.805 | S | S | * | * | trans | 168.8 | 119.3 | 159.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 98 | V | 29.5 | Very low | 31.8 | Very low | 129 Ų | 129 | 142.7 Ų | 142.7 | 78% | 0.782 | 80% | 0.803 | S | S | * | * | trans | -104.2 | 134.9 | -179.5 | 170.4 | 0 | 0 | 0 | 0 | 110.5 | V100 | V98-V100 HydrophobicContact CG1-CG2 4.22Š| ||
| 99 | V | 29.6 | Very low | 31.9 | Very low | 147 Ų | 147 | 138.4 Ų | 138.4 | 89% | 0.891 | 81% | 0.806 | S | S | * | * | trans | -139.2 | 146.4 | 152.1 | 179.8 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 100 | V | 31.8 | Very low | 32.3 | Very low | 101 Ų | 101 | 140.3 Ų | 140.3 | 61% | 0.612 | 81% | 0.808 | S | S | * | * | trans | -116.5 | 164.4 | -172.9 | 162.2 | 0 | 0 | 0 | 0 | 109.5 | V98 | V98-V100 HydrophobicContact CG1-CG2 4.22Š| ||
| 101 | E | 31 | Very low | 33.2 | Very low | 167 Ų | 167 | 141.1 Ų | 141.1 | 78% | 0.78 | 81% | 0.811 | S | S | * | * | trans | 73.6 | 155.8 | 166.8 | -90.7 | 163 | -135.7 | 0 | 0 | 116.9 | ||||
| 102 | T | 28.3 | Very low | 33.7 | Very low | 104 Ų | 104 | 134 Ų | 134 | 64% | 0.638 | 80% | 0.796 | S | S | * | * | cis | -155.8 | 166.9 | 19.2 | -7.6 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 103 | K | 33.6 | Very low | 35.3 | Very low | 196 Ų | 196 | 134.8 Ų | 134.8 | 85% | 0.852 | 79% | 0.791 | S | S | * | * | trans | 80.2 | 155.6 | 148.2 | -55.2 | -113.6 | 176.2 | 172.3 | 0 | 120.7 | ||||
| 104 | Q | 36.3 | Very low | 36.9 | Very low | 189 Ų | 189 | 137.5 Ų | 137.5 | 88% | 0.883 | 79% | 0.792 | S | S | * | * | trans | -113 | 158.2 | -165.2 | -62.1 | 166.4 | -5.7 | 0 | 0 | 111.4 | ||||
| 105 | K | 36.5 | Very low | 38.1 | Very low | 196 Ų | 196 | 138.5 Ų | 138.5 | 85% | 0.852 | 79% | 0.786 | S | S | * | * | trans | -16.3 | 155.8 | 150.9 | -111 | 179.3 | -176.5 | -179.8 | 0 | 116.3 | ||||
| 106 | P | 46.5 | Very low | 39.8 | Very low | 107 Ų | 107 | 135.4 Ų | 135.4 | 70% | 0.695 | 77% | 0.767 | S | S | * | * | -159.5 | 169.5 | 77.3 | 46.4 | -27.8 | 0 | 0 | 0 | 119.6 | |||||
| 107 | K | 33.2 | Very low | 42.2 | Very low | 209 Ų | 209 | 133.2 Ų | 133.2 | 91% | 0.909 | 76% | 0.759 | S | S | * | * | trans | 53.3 | 150.6 | 162.9 | -41 | -159.7 | -176.9 | 174.4 | 0 | 118.2 | ||||
| 108 | G | 30.3 | Very low | 44.9 | Very low | 83 Ų | 83 | 132.8 Ų | 132.8 | 86% | 0.856 | 74% | 0.74 | S | S | * | * | cis | 176.7 | 140.7 | -8.4 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 109 | G | 32 | Very low | 47.8 | Very low | 78 Ų | 78 | 130.3 Ų | 130.3 | 80% | 0.804 | 72% | 0.723 | S | S | * | * | trans | -156.8 | 140.2 | -178.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 110 | K | 37.8 | Very low | 50.6 | Low | 205 Ų | 205 | 126.4 Ų | 126.4 | 89% | 0.891 | 70% | 0.696 | S | S | * | * | trans | -65.2 | 156.7 | -170.4 | -79.5 | -174.8 | 178.2 | -179.4 | 0 | 113.4 | G112 | K110-G112 PolarHBondContact O-N 3.45Š| ||
| 111 | P | 48.9 | Very low | 53.4 | Low | 126 Ų | 126 | 127.2 Ų | 127.2 | 82% | 0.818 | 70% | 0.697 | S | S | * | * | trans | -80.6 | 75.3 | -165.6 | 34.1 | -37.3 | 0 | 0 | 0 | 112.9 | T113 | P111-T113 PolarHBondContact O-N 2.89Š| ||
| 112 | G | 40.7 | Very low | 56.3 | Low | 59 Ų | 59 | 126.3 Ų | 126.3 | 61% | 0.608 | 69% | 0.686 | S | S | * | * | trans | -63.8 | 128.9 | 158.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | K110 K114 | K110-G112 PolarHBondContact O-N 3.45Å; G112-K114 PolarHBondContact O-N 2.88Å | ||
| 113 | T | 59.1 | Low | 59.3 | Low | 120 Ų | 120 | 127 Ų | 127 | 74% | 0.736 | 68% | 0.682 | S | S | * | * | trans | -64.5 | 74.2 | -176.2 | 37.7 | 0 | 0 | 0 | 0 | 112.8 | P111 F115 | P111-T113 PolarHBondContact O-N 2.89Å; T113-F115 VanDerWaalsContact C-N 3.26Å; T113-F115 PolarHBondContact O-N 2.93Å | ||
| 114 | K | 57.2 | Low | 62.1 | Low | 192 Ų | 192 | 125.9 Ų | 125.9 | 84% | 0.835 | 67% | 0.672 | S | S | * | * | trans | -70.9 | 87.5 | 164.6 | -64.4 | -176.8 | -175.2 | -176.6 | 0 | 107.8 | G112 S116 | G112-K114 PolarHBondContact O-N 2.88Å; K114-S116 PolarHBondContact O-N 3.29Å | ||
| 115 | F | 60 | Low | 64.7 | Low | 149 Ų | 149 | 121.5 Ų | 121.5 | 65% | 0.654 | 66% | 0.655 | S | S | * | * | trans | -61.2 | 83.8 | 164.5 | -82.4 | -85.2 | 0 | 0 | 0 | 108.7 | T113 T117 I120 | T113-F115 VanDerWaalsContact C-N 3.26Å; T113-F115 PolarHBondContact O-N 2.93Å; F115-T117 PolarHBondContact O-N 3.19Å; F115-I120 HydrophobicContact CB-CD1 4.2Å; F115-I120 HydrophobicContact CD1-CD1 4.34Å; F115-I120 HydrophobicContact CD1-CG1 4.21Å | ||
| 116 | S | 77.3 | Confident | 67.1 | Low | 44 Ų | 44 | 117.4 Ų | 117.4 | 31% | 0.308 | 64% | 0.638 | S | S | . | * | trans | -60.8 | 132.8 | 173.6 | -174.1 | 0 | 0 | 0 | 0 | 107.8 | K114 V118 D119 I120 | K114-S116 PolarHBondContact O-N 3.29Å; S116-V118 PolarHBondContact O-N 3.37Å; S116-V118 VanDerWaalsContact O-N 3.11Å; S116-V118 PolarHBondContact OG-N 3.03Å; S116-D119 WeakPolarHBondContact CB-OD2 3.39Å; S116-D119 WeakPolarHBondContact O-CA 3.33Å; S116-D119 PolarHBondContact O-N 3.38Å; S116-I120 PolarHBondContact O-N 3.36Å | ||
| 117 | T | 78.3 | Confident | 69.1 | Low | 117 Ų | 117 | 117.5 Ų | 117.5 | 72% | 0.718 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -56.3 | -27.9 | 172.1 | 53 | 0 | 0 | 0 | 0 | 111.3 | F115 L121 | F115-T117 PolarHBondContact O-N 3.19Å; T117-L121 VanDerWaalsContact O-CB 3.23Å; T117-L121 WeakPolarHBondContact O-CB 3.34Å; T117-L121 PolarHBondContact O-N 3.16Å |
| 118 | V | 86.2 | Confident | 71.7 | Confident | 70 Ų | 70 | 113.9 Ų | 113.9 | 42% | 0.424 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -68.2 | -36.7 | 172.3 | -177.3 | 0 | 0 | 0 | 0 | 112 | S116 L121 R122 | S116-V118 PolarHBondContact O-N 3.37Å; S116-V118 VanDerWaalsContact O-N 3.11Å; S116-V118 PolarHBondContact OG-N 3.03Å; V118-L121 PolarHBondContact O-N 2.92Å; V118-R122 VanDerWaalsContact O-CG 3.23Å; V118-R122 WeakPolarHBondContact O-CG 3.25Å; V118-R122 PolarHBondContact O-N 2.62Å |
| 119 | D | 89 | Confident | 74.1 | Confident | 77 Ų | 77 | 113.1 Ų | 113.1 | 41% | 0.412 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -79 | -37.5 | -178.8 | -63.3 | -31.3 | 0 | 0 | 0 | 111.4 | S116 L121 R122 Q123 | S116-D119 WeakPolarHBondContact CB-OD2 3.39Å; S116-D119 WeakPolarHBondContact O-CA 3.33Å; S116-D119 PolarHBondContact O-N 3.38Å; D119-L121 VanDerWaalsContact C-N 3.27Å; D119-L121 PolarHBondContact O-N 3.14Å; D119-R122 PolarHBondContact O-N 2.96Å; D119-R122 IonicContact OD1-NE 3.5Å; D119-Q123 WeakPolarHBondContact O-CB 3.44Å; D119-Q123 WeakPolarHBondContact O-CG 3.47Å; D119-Q123 PolarHBondContact O-N 2.81Å |
| 120 | I | 87.9 | Confident | 76.4 | Confident | 66 Ų | 66 | 115.1 Ų | 115.1 | 34% | 0.338 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -60.2 | -40.2 | 166.8 | -62.9 | 171.2 | 0 | 0 | 0 | 110.4 | F115 S116 Q123 R124 | F115-I120 HydrophobicContact CB-CD1 4.2Å; F115-I120 HydrophobicContact CD1-CD1 4.34Å; F115-I120 HydrophobicContact CD1-CG1 4.21Å; S116-I120 PolarHBondContact O-N 3.36Å; I120-Q123 PolarHBondContact O-N 3.33Å; I120-R124 WeakPolarHBondContact O-CB 3.42Å; I120-R124 PolarHBondContact O-N 3.41Å |
| 121 | L | 91.4 | Very high | 78.3 | Confident | 118 Ų | 118 | 110 Ų | 110 | 62% | 0.618 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -67.9 | -37.4 | 175.8 | -177.3 | 63.2 | 0 | 0 | 0 | 112.2 | T117 V118 D119 L125 | T117-L121 VanDerWaalsContact O-CB 3.23Å; T117-L121 WeakPolarHBondContact O-CB 3.34Å; T117-L121 PolarHBondContact O-N 3.16Å; V118-L121 PolarHBondContact O-N 2.92Å; D119-L121 VanDerWaalsContact C-N 3.27Å; D119-L121 PolarHBondContact O-N 3.14Å; L121-L125 WeakPolarHBondContact O-CB 3.01Å; L121-L125 PolarHBondContact O-N 3.15Å |
| 122 | R | 91.3 | Very high | 79.3 | Confident | 147 Ų | 147 | 107.8 Ų | 107.8 | 56% | 0.555 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -64.6 | -44.1 | 172.6 | -74.3 | 167 | -172.5 | -82.4 | 0.4 | 111.2 | V118 D119 L125 H126 | V118-R122 VanDerWaalsContact O-CG 3.23Å; V118-R122 WeakPolarHBondContact O-CG 3.25Å; V118-R122 PolarHBondContact O-N 2.62Å; D119-R122 PolarHBondContact O-N 2.96Å; D119-R122 IonicContact OD1-NE 3.5Å; R122-L125 WeakPolarHBondContact O-CB 3.37Å; R122-L125 PolarHBondContact O-N 3.06Å; R122-H126 WeakPolarHBondContact O-CB 3.34Å; R122-H126 PolarHBondContact O-CD2 2.94Å; R122-H126 PolarHBondContact O-N 3.05Å |
| 123 | Q | 91.4 | Very high | 80.5 | Confident | 120 Ų | 120 | 113.2 Ų | 113.2 | 56% | 0.561 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -60.5 | -54.2 | 175.9 | -74.8 | 170.5 | -17.1 | 0 | 0 | 110.6 | D119 I120 L125 H126 E127 | D119-Q123 WeakPolarHBondContact O-CB 3.44Å; D119-Q123 WeakPolarHBondContact O-CG 3.47Å; D119-Q123 PolarHBondContact O-N 2.81Å; I120-Q123 PolarHBondContact O-N 3.33Å; Q123-L125 VanDerWaalsContact C-N 3.26Å; Q123-L125 PolarHBondContact O-N 3.09Å; Q123-H126 PolarHBondContact O-N 3.19Å; Q123-H126 VanDerWaalsContact O-N 3.08Å; Q123-E127 VanDerWaalsContact O-CB 3.3Å; Q123-E127 WeakPolarHBondContact O-CB 3.42Å; Q123-E127 PolarHBondContact O-N 3.32Å |
| 124 | R | 92.2 | Very high | 80.4 | Confident | 171 Ų | 171 | 109.9 Ų | 109.9 | 65% | 0.645 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -58.1 | -34.7 | 174 | -88.3 | -177.3 | 168 | 155.6 | -0.9 | 113.5 | I120 K128 | I120-R124 WeakPolarHBondContact O-CB 3.42Å; I120-R124 PolarHBondContact O-N 3.41Å; R124-K128 VanDerWaalsContact O-CB 3.26Å; R124-K128 WeakPolarHBondContact O-CB 3.41Å; R124-K128 PolarHBondContact O-N 3.37Å |
| 125 | L | 91.4 | Very high | 80.5 | Confident | 98 Ų | 98 | 109.3 Ų | 109.3 | 51% | 0.513 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -67.4 | -44.1 | 175.4 | -176.7 | 77.7 | 0 | 0 | 0 | 111.1 | L121 R122 Q123 K128 I129 | L121-L125 WeakPolarHBondContact O-CB 3.01Å; L121-L125 PolarHBondContact O-N 3.15Å; R122-L125 WeakPolarHBondContact O-CB 3.37Å; R122-L125 PolarHBondContact O-N 3.06Å; Q123-L125 VanDerWaalsContact C-N 3.26Å; Q123-L125 PolarHBondContact O-N 3.09Å; L125-K128 PolarHBondContact O-N 3.31Å; L125-I129 HydrophobicContact CD1-CD1 4.43Å; L125-I129 HydrophobicContact CD2-CD1 4.41Å; L125-I129 HydrophobicContact CG-CD1 3.91Å; L125-I129 WeakPolarHBondContact O-CB 3.46Å; L125-I129 WeakPolarHBondContact O-CD1 3.49Å; L125-I129 WeakPolarHBondContact O-CG1 3.41Å; L125-I129 PolarHBondContact O-N 3.24Å |
| 126 | H | 87.1 | Confident | 80.4 | Confident | 109 Ų | 109 | 104.1 Ų | 104.1 | 51% | 0.505 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65.3 | -47.9 | 178.1 | -78.9 | -139 | 0 | 0 | 0 | 110.8 | R122 Q123 K128 I129 E130 | R122-H126 WeakPolarHBondContact O-CB 3.34Å; R122-H126 PolarHBondContact O-CD2 2.94Å; R122-H126 PolarHBondContact O-N 3.05Å; Q123-H126 PolarHBondContact O-N 3.19Å; Q123-H126 VanDerWaalsContact O-N 3.08Å; H126-K128 PolarHBondContact O-N 2.97Å; H126-I129 CarbonylContact O-C 3.59Å; H126-I129 WeakPolarHBondContact O-CA 3.44Å; H126-I129 WeakPolarHBondContact O-CB 3.48Å; H126-I129 PolarHBondContact O-N 2.85Å; H126-E130 PolarHBondContact O-N 2.81Å |
| 127 | E | 88.8 | Confident | 79.4 | Confident | 110 Ų | 110 | 108.1 Ų | 108.1 | 51% | 0.514 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -54.3 | -49.2 | 172.9 | -171.6 | 175.7 | -137.7 | 0 | 0 | 111 | Q123 I129 E130 E131 | Q123-E127 VanDerWaalsContact O-CB 3.3Å; Q123-E127 WeakPolarHBondContact O-CB 3.42Å; Q123-E127 PolarHBondContact O-N 3.32Å; E127-I129 VanDerWaalsContact C-N 3.31Å; E127-I129 PolarHBondContact O-N 3.07Å; E127-E130 PolarHBondContact O-N 3.41Å; E127-E130 VanDerWaalsContact O-N 3.14Å; E127-E131 WeakPolarHBondContact O-CB 3.27Å; E127-E131 WeakPolarHBondContact O-CG 3.31Å; E127-E131 PolarHBondContact O-N 3.18Å |
| 128 | K | 87.8 | Confident | 78.1 | Confident | 133 Ų | 133 | 107.2 Ų | 107.2 | 58% | 0.578 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -63.7 | -32.3 | 174.8 | -149.4 | 78.1 | -152.5 | 158.5 | 0 | 113.5 | R124 L125 H126 E131 S132 | R124-K128 VanDerWaalsContact O-CB 3.26Å; R124-K128 WeakPolarHBondContact O-CB 3.41Å; R124-K128 PolarHBondContact O-N 3.37Å; L125-K128 PolarHBondContact O-N 3.31Å; H126-K128 PolarHBondContact O-N 2.97Å; K128-E131 VanDerWaalsContact CD-OE2 3.3Å; K128-E131 WeakPolarHBondContact CD-OE2 3.3Å; K128-E131 WeakPolarHBondContact CE-OE2 3.46Å; K128-E131 IonicContact NZ-OE1 2.68Å; K128-E131 IonicContact NZ-OE2 3.3Å; K128-E131 PolarHBondContact NZ-OE2 2.87Å; K128-S132 VanDerWaalsContact O-CB 3.25Å; K128-S132 WeakPolarHBondContact O-CB 3.46Å; K128-S132 PolarHBondContact O-N 2.82Å; K128-S132 VanDerWaalsContact O-N 3.09Å; K128-S132 PolarHBondContact O-OG 2.85Å |
| 129 | I | 80.6 | Confident | 76.7 | Confident | 66 Ų | 66 | 108.8 Ų | 108.8 | 34% | 0.338 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -71.7 | -34.6 | 175.5 | -75 | 166.3 | 0 | 0 | 0 | 110.7 | L125 H126 E127 S132 R133 | L125-I129 HydrophobicContact CD1-CD1 4.43Å; L125-I129 HydrophobicContact CD2-CD1 4.41Å; L125-I129 HydrophobicContact CG-CD1 3.91Å; L125-I129 WeakPolarHBondContact O-CB 3.46Å; L125-I129 WeakPolarHBondContact O-CD1 3.49Å; L125-I129 WeakPolarHBondContact O-CG1 3.41Å; L125-I129 PolarHBondContact O-N 3.24Å; H126-I129 CarbonylContact O-C 3.59Å; H126-I129 WeakPolarHBondContact O-CA 3.44Å; H126-I129 WeakPolarHBondContact O-CB 3.48Å; H126-I129 PolarHBondContact O-N 2.85Å; E127-I129 VanDerWaalsContact C-N 3.31Å; E127-I129 PolarHBondContact O-N 3.07Å; I129-S132 WeakPolarHBondContact CA-OG 3.29Å; I129-S132 PolarHBondContact O-OG 3Å; I129-R133 WeakPolarHBondContact O-CB 3.43Å; I129-R133 WeakPolarHBondContact O-CD 3.31Å; I129-R133 WeakPolarHBondContact O-CG 3.22Å; I129-R133 PolarHBondContact O-N 3.05Å |
| 130 | E | 79.7 | Confident | 75.4 | Confident | 120 Ų | 120 | 110.2 Ų | 110.2 | 56% | 0.561 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -78.5 | -45 | 178.8 | -73.7 | 174.9 | 177.6 | 0 | 0 | 111.8 | H126 E127 S132 R133 G134 | H126-E130 PolarHBondContact O-N 2.81Å; E127-E130 PolarHBondContact O-N 3.41Å; E127-E130 VanDerWaalsContact O-N 3.14Å; E130-S132 VanDerWaalsContact C-N 3.29Å; E130-S132 PolarHBondContact O-N 3.36Å; E130-R133 WeakPolarHBondContact O-CA 2.94Å; E130-R133 WeakPolarHBondContact O-CB 3.42Å; E130-R133 PolarHBondContact O-N 3.11Å; E130-G134 PolarHBondContact O-N 3.43Å |
| 131 | E | 78 | Confident | 74.1 | Confident | 97 Ų | 97 | 112.3 Ų | 112.3 | 45% | 0.453 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -52.9 | -46.5 | 168.6 | -73.1 | 177.1 | 165.3 | 0 | 0 | 111.9 | E127 K128 R133 G134 Q135 | E127-E131 WeakPolarHBondContact O-CB 3.27Å; E127-E131 WeakPolarHBondContact O-CG 3.31Å; E127-E131 PolarHBondContact O-N 3.18Å; K128-E131 VanDerWaalsContact CD-OE2 3.3Å; K128-E131 WeakPolarHBondContact CD-OE2 3.3Å; K128-E131 WeakPolarHBondContact CE-OE2 3.46Å; K128-E131 IonicContact NZ-OE1 2.68Å; K128-E131 IonicContact NZ-OE2 3.3Å; K128-E131 PolarHBondContact NZ-OE2 2.87Å; E131-R133 VanDerWaalsContact C-N 3.3Å; E131-R133 PolarHBondContact O-N 3.24Å; E131-G134 PolarHBondContact O-N 2.91Å; E131-Q135 PolarHBondContact O-N 2.83Å |
| 132 | S | 70.3 | Confident | 72.6 | Confident | 80 Ų | 80 | 111 Ų | 111 | 56% | 0.559 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -75.8 | -15.1 | 179.3 | 61.9 | 0 | 0 | 0 | 0 | 113.9 | K128 I129 E130 | K128-S132 VanDerWaalsContact O-CB 3.25Å; K128-S132 WeakPolarHBondContact O-CB 3.46Å; K128-S132 PolarHBondContact O-N 2.82Å; K128-S132 VanDerWaalsContact O-N 3.09Å; K128-S132 PolarHBondContact O-OG 2.85Å; I129-S132 WeakPolarHBondContact CA-OG 3.29Å; I129-S132 PolarHBondContact O-OG 3Å; E130-S132 VanDerWaalsContact C-N 3.29Å; E130-S132 PolarHBondContact O-N 3.36Å |
| 133 | R | 65.4 | Low | 71.8 | Confident | 173 Ų | 173 | 106 Ų | 106 | 65% | 0.653 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -76.6 | -36.3 | 165.3 | -78.9 | 165 | 177.7 | -175.1 | 2 | 111.6 | I129 E130 E131 Q135 G136 | I129-R133 WeakPolarHBondContact O-CB 3.43Å; I129-R133 WeakPolarHBondContact O-CD 3.31Å; I129-R133 WeakPolarHBondContact O-CG 3.22Å; I129-R133 PolarHBondContact O-N 3.05Å; E130-R133 WeakPolarHBondContact O-CA 2.94Å; E130-R133 WeakPolarHBondContact O-CB 3.42Å; E130-R133 PolarHBondContact O-N 3.11Å; E131-R133 VanDerWaalsContact C-N 3.3Å; E131-R133 PolarHBondContact O-N 3.24Å; R133-Q135 VanDerWaalsContact C-N 3.26Å; R133-Q135 PolarHBondContact O-N 3.04Å; R133-G136 PolarHBondContact O-N 2.8Å |
| 134 | G | 56.4 | Low | 71.1 | Confident | 51 Ų | 51 | 106.3 Ų | 106.3 | 53% | 0.526 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -66 | -22.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | E130 E131 G136 | E130-G134 PolarHBondContact O-N 3.43Å; E131-G134 PolarHBondContact O-N 2.91Å; G134-G136 PolarHBondContact O-N 3.37Å |
| 135 | Q | 59.2 | Low | 70.1 | Confident | 180 Ų | 180 | 103.9 Ų | 103.9 | 84% | 0.841 | 56% | 0.556 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.7 | 9 | 174.7 | -68 | -67.5 | -43.4 | 0 | 0 | 114.2 | E131 R133 | E131-Q135 PolarHBondContact O-N 2.83Å; R133-Q135 VanDerWaalsContact C-N 3.26Å; R133-Q135 PolarHBondContact O-N 3.04Å |
| 136 | G | 59.4 | Low | 69.3 | Low | 39 Ų | 39 | 101 Ų | 101 | 40% | 0.402 | 54% | 0.543 | S | S | . | . | S | Bend | trans | -137.3 | 157.4 | 165.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | R133 G134 P138 | R133-G136 PolarHBondContact O-N 2.8Å; G134-G136 PolarHBondContact O-N 3.37Å; G136-P138 WeakPolarHBondContact O-CD 3.43Å |
| 137 | T | 55.2 | Low | 69.1 | Low | 128 Ų | 128 | 99.8 Ų | 99.8 | 79% | 0.785 | 54% | 0.537 | S | S | * | . | trans | -49.2 | 117.8 | -176.6 | 46.1 | 0 | 0 | 0 | 0 | 111.5 | K139 | T137-K139 PolarHBondContact O-N 2.92Š| ||
| 138 | P | 51.2 | Low | 68.8 | Low | 99 Ų | 99 | 99.7 Ų | 99.7 | 64% | 0.643 | 54% | 0.535 | S | S | * | . | trans | -57.9 | 132.5 | 179.2 | -24.3 | 33.7 | 0 | 0 | 0 | 109.6 | G136 | G136-P138 WeakPolarHBondContact O-CD 3.43Š| ||
| 139 | K | 56.6 | Low | 68.5 | Low | 103 Ų | 103 | 99.4 Ų | 99.4 | 45% | 0.448 | 53% | 0.534 | S | S | . | . | trans | -157.6 | 79.1 | 172.1 | -114.2 | 141.8 | -176.5 | 154.7 | 0 | 108 | T137 E145 V146 | T137-K139 PolarHBondContact O-N 2.92Å; K139-E145 VanDerWaalsContact CE-CD 3.49Å; K139-E145 WeakPolarHBondContact CE-OE2 3.44Å; K139-E145 IonicContact NZ-OE1 3.65Å; K139-E145 IonicContact NZ-OE2 3.72Å; K139-E145 PolarHBondContact NZ-OE2 2.87Å; K139-V146 HydrophobicContact CB-CG2 3.53Å; K139-V146 HydrophobicContact CG-CG2 3.52Å | ||
| 140 | D | 63 | Low | 68.6 | Low | 106 Ų | 106 | 105 Ų | 105 | 57% | 0.567 | 55% | 0.551 | S | S | * | * | trans | -50.7 | 145.6 | 177 | -60.4 | -65 | 0 | 0 | 0 | 110.6 | S142 S143 V146 | D140-S142 PolarHBondContact O-N 2.96Å; D140-S143 WeakPolarHBondContact O-CB 3.34Å; D140-S143 PolarHBondContact O-N 3.19Å; D140-V146 WeakPolarHBondContact O-CG2 3.42Å | ||
| 141 | P | 59.4 | Low | 69 | Low | 110 Ų | 110 | 104 Ų | 104 | 71% | 0.714 | 55% | 0.546 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.8 | -19.2 | -179.3 | 26.3 | -34.9 | 0 | 0 | 0 | 112.9 | ||
| 142 | S | 59.6 | Low | 69.5 | Low | 92 Ų | 92 | 106.5 Ų | 106.5 | 64% | 0.643 | 56% | 0.556 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.9 | -17.2 | 174.7 | -153.3 | 0 | 0 | 0 | 0 | 114.2 | D140 E144 Q147 | D140-S142 PolarHBondContact O-N 2.96Å; S142-E144 PolarHBondContact O-N 3.25Å; S142-Q147 PolarHBondContact O-NE2 3.27Å |
| 143 | S | 74.6 | Confident | 70.3 | Confident | 41 Ų | 41 | 109.5 Ų | 109.5 | 29% | 0.287 | 56% | 0.555 | S | S | . | * | S | Bend | trans | -60.1 | 127.6 | 178.8 | 173.5 | 0 | 0 | 0 | 0 | 110.5 | D140 E145 V146 Q147 | D140-S143 WeakPolarHBondContact O-CB 3.34Å; D140-S143 PolarHBondContact O-N 3.19Å; S143-E145 PolarHBondContact O-N 3.2Å; S143-E145 VanDerWaalsContact O-N 3.09Å; S143-V146 WeakPolarHBondContact O-CA 3.43Å; S143-V146 WeakPolarHBondContact O-CB 3.45Å; S143-V146 PolarHBondContact O-N 2.84Å; S143-Q147 PolarHBondContact O-N 2.95Å |
| 144 | E | 76.8 | Confident | 71.6 | Confident | 126 Ų | 126 | 107.5 Ų | 107.5 | 59% | 0.589 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -53.7 | -35.7 | -174.9 | -62.8 | -169.5 | 173.8 | 0 | 0 | 113.1 | S142 V146 Q147 K148 | S142-E144 PolarHBondContact O-N 3.25Å; E144-V146 PolarHBondContact O-N 3.39Å; E144-Q147 PolarHBondContact O-N 3.17Å; E144-K148 HydrophobicContact CB-CD 4.31Å; E144-K148 VanDerWaalsContact O-CB 3.31Å; E144-K148 WeakPolarHBondContact O-CB 3.37Å; E144-K148 VanDerWaalsContact O-CG 3.27Å; E144-K148 WeakPolarHBondContact O-CG 3.49Å; E144-K148 PolarHBondContact O-N 2.95Å; E144-K148 IonicContact OE2-NZ 2.61Å; E144-K148 PolarHBondContact OE2-NZ 3.23Å |
| 145 | E | 72.2 | Confident | 73.2 | Confident | 121 Ų | 121 | 111.1 Ų | 111.1 | 57% | 0.565 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -61.2 | -33.8 | 177.1 | -73.3 | -165 | -135.9 | 0 | 0 | 112.7 | K139 S143 K149 | K139-E145 VanDerWaalsContact CE-CD 3.49Å; K139-E145 WeakPolarHBondContact CE-OE2 3.44Å; K139-E145 IonicContact NZ-OE1 3.65Å; K139-E145 IonicContact NZ-OE2 3.72Å; K139-E145 PolarHBondContact NZ-OE2 2.87Å; S143-E145 PolarHBondContact O-N 3.2Å; S143-E145 VanDerWaalsContact O-N 3.09Å; E145-K149 WeakPolarHBondContact O-CB 3.39Å; E145-K149 PolarHBondContact O-N 3.01Å |
| 146 | V | 75.2 | Confident | 74.7 | Confident | 37 Ų | 37 | 106.9 Ų | 106.9 | 22% | 0.224 | 53% | 0.534 | C | S | . | . | H | α-helix | trans | -73.1 | -40.6 | 176.2 | -174.2 | 0 | 0 | 0 | 0 | 110.5 | K139 D140 S143 E144 K149 R150 | K139-V146 HydrophobicContact CB-CG2 3.53Å; K139-V146 HydrophobicContact CG-CG2 3.52Å; D140-V146 WeakPolarHBondContact O-CG2 3.42Å; S143-V146 WeakPolarHBondContact O-CA 3.43Å; S143-V146 WeakPolarHBondContact O-CB 3.45Å; S143-V146 PolarHBondContact O-N 2.84Å; E144-V146 PolarHBondContact O-N 3.39Å; V146-K149 PolarHBondContact O-N 2.81Å; V146-R150 VanDerWaalsContact O-CB 3.31Å; V146-R150 WeakPolarHBondContact O-CB 3.42Å; V146-R150 PolarHBondContact O-N 3.12Å |
| 147 | Q | 81.3 | Confident | 76.2 | Confident | 84 Ų | 84 | 113.5 Ų | 113.5 | 39% | 0.393 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -63.5 | -55.7 | 176.6 | -57.2 | -170.7 | 12.2 | 0 | 0 | 110.5 | S142 S143 E144 K149 R150 E151 | S142-Q147 PolarHBondContact O-NE2 3.27Å; S143-Q147 PolarHBondContact O-N 2.95Å; E144-Q147 PolarHBondContact O-N 3.17Å; Q147-K149 PolarHBondContact O-N 3.42Å; Q147-K149 VanDerWaalsContact O-N 3.15Å; Q147-R150 CarbonylContact O-C 3.6Å; Q147-R150 WeakPolarHBondContact O-CA 3.17Å; Q147-R150 WeakPolarHBondContact O-CB 3.28Å; Q147-R150 PolarHBondContact O-N 2.93Å; Q147-E151 WeakPolarHBondContact O-CG 3.37Å; Q147-E151 PolarHBondContact O-N 3.29Å |
| 148 | K | 84 | Confident | 77.9 | Confident | 107 Ų | 107 | 111.1 Ų | 111.1 | 47% | 0.465 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -53.4 | -37.1 | 174.6 | -69.6 | 164.1 | 179.1 | 169 | 0 | 111.9 | E144 K152 | E144-K148 HydrophobicContact CB-CD 4.31Å; E144-K148 VanDerWaalsContact O-CB 3.31Å; E144-K148 WeakPolarHBondContact O-CB 3.37Å; E144-K148 VanDerWaalsContact O-CG 3.27Å; E144-K148 WeakPolarHBondContact O-CG 3.49Å; E144-K148 PolarHBondContact O-N 2.95Å; E144-K148 IonicContact OE2-NZ 2.61Å; E144-K148 PolarHBondContact OE2-NZ 3.23Å; K148-K152 WeakPolarHBondContact O-CB 3.47Å; K148-K152 VanDerWaalsContact O-CG 3.3Å; K148-K152 WeakPolarHBondContact O-CG 3.3Å; K148-K152 PolarHBondContact O-N 2.86Å |
| 149 | K | 80.9 | Confident | 79.9 | Confident | 128 Ų | 128 | 114.6 Ų | 114.6 | 56% | 0.557 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -75 | -30.8 | 175 | -170.8 | 171.6 | -169.1 | 165.8 | 0 | 113.8 | E145 V146 Q147 R153 | E145-K149 WeakPolarHBondContact O-CB 3.39Å; E145-K149 PolarHBondContact O-N 3.01Å; V146-K149 PolarHBondContact O-N 2.81Å; Q147-K149 PolarHBondContact O-N 3.42Å; Q147-K149 VanDerWaalsContact O-N 3.15Å; K149-R153 WeakPolarHBondContact O-CD 3.35Å; K149-R153 VanDerWaalsContact O-CG 3.3Å; K149-R153 WeakPolarHBondContact O-CG 3.34Å; K149-R153 PolarHBondContact O-N 2.68Å |
| 150 | R | 82.6 | Confident | 81.6 | Confident | 182 Ų | 182 | 115.1 Ų | 115.1 | 69% | 0.687 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -73.6 | -38.9 | 174.2 | -179.3 | 179.6 | -84 | -166.4 | -3.5 | 110.9 | V146 Q147 R153 K154 | V146-R150 VanDerWaalsContact O-CB 3.31Å; V146-R150 WeakPolarHBondContact O-CB 3.42Å; V146-R150 PolarHBondContact O-N 3.12Å; Q147-R150 CarbonylContact O-C 3.6Å; Q147-R150 WeakPolarHBondContact O-CA 3.17Å; Q147-R150 WeakPolarHBondContact O-CB 3.28Å; Q147-R150 PolarHBondContact O-N 2.93Å; R150-R153 CarbonylContact O-C 3.52Å; R150-R153 WeakPolarHBondContact O-CB 3.48Å; R150-R153 PolarHBondContact O-N 3.03Å; R150-K154 PolarHBondContact O-N 3.45Å |
| 151 | E | 87.8 | Confident | 83 | Confident | 101 Ų | 101 | 116.9 Ų | 116.9 | 47% | 0.472 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.2 | -49.3 | 174.1 | -71.6 | 166.5 | 175.3 | 0 | 0 | 112.1 | Q147 R153 K154 Q155 | Q147-E151 WeakPolarHBondContact O-CG 3.37Å; Q147-E151 PolarHBondContact O-N 3.29Å; E151-R153 PolarHBondContact O-N 2.86Å; E151-K154 CarbonylContact O-C 3.58Å; E151-K154 WeakPolarHBondContact O-CA 3.5Å; E151-K154 WeakPolarHBondContact O-CB 3.29Å; E151-K154 PolarHBondContact O-N 3.13Å; E151-Q155 PolarHBondContact O-N 3.12Å |
| 152 | K | 88.9 | Confident | 84.5 | Confident | 149 Ų | 149 | 119.7 Ų | 119.7 | 65% | 0.648 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -53.4 | -39.3 | 172.4 | -75.8 | 175.8 | 179.5 | -178.5 | 0 | 111.7 | K148 E156 | K148-K152 WeakPolarHBondContact O-CB 3.47Å; K148-K152 VanDerWaalsContact O-CG 3.3Å; K148-K152 WeakPolarHBondContact O-CG 3.3Å; K148-K152 PolarHBondContact O-N 2.86Å; K152-E156 VanDerWaalsContact O-CB 3.29Å; K152-E156 WeakPolarHBondContact O-CB 3.48Å; K152-E156 PolarHBondContact O-N 3.08Å |
| 153 | R | 86.6 | Confident | 86 | Confident | 143 Ų | 143 | 121 Ų | 121 | 54% | 0.54 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -70.2 | -30.9 | 173.2 | -74.2 | 170 | 171.5 | 179.8 | -1.7 | 113.9 | K149 R150 E151 R157 | K149-R153 WeakPolarHBondContact O-CD 3.35Å; K149-R153 VanDerWaalsContact O-CG 3.3Å; K149-R153 WeakPolarHBondContact O-CG 3.34Å; K149-R153 PolarHBondContact O-N 2.68Å; R150-R153 CarbonylContact O-C 3.52Å; R150-R153 WeakPolarHBondContact O-CB 3.48Å; R150-R153 PolarHBondContact O-N 3.03Å; E151-R153 PolarHBondContact O-N 2.86Å; R153-R157 WeakPolarHBondContact O-CB 3.24Å; R153-R157 WeakPolarHBondContact O-CD 3.48Å; R153-R157 WeakPolarHBondContact O-CG 3.04Å; R153-R157 PolarHBondContact O-N 2.74Å; R153-R157 VanDerWaalsContact O-N 3.15Å |
| 154 | K | 92.8 | Very high | 86.8 | Confident | 131 Ų | 131 | 128.4 Ų | 128.4 | 57% | 0.57 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -68.9 | -51.3 | 174.1 | -173.1 | -175.2 | 174.3 | -169.4 | 0 | 110 | R150 E151 E156 R157 E158 | R150-K154 PolarHBondContact O-N 3.45Å; E151-K154 CarbonylContact O-C 3.58Å; E151-K154 WeakPolarHBondContact O-CA 3.5Å; E151-K154 WeakPolarHBondContact O-CB 3.29Å; E151-K154 PolarHBondContact O-N 3.13Å; K154-E156 PolarHBondContact O-N 3.46Å; K154-R157 WeakPolarHBondContact O-CB 3.5Å; K154-R157 PolarHBondContact O-N 2.83Å; K154-R157 VanDerWaalsContact O-N 3.14Å; K154-E158 VanDerWaalsContact CE-OE1 3.28Å; K154-E158 WeakPolarHBondContact CE-OE1 3.46Å; K154-E158 PolarHBondContact O-N 3.18Å |
| 155 | Q | 90.2 | Very high | 87.5 | Confident | 126 Ų | 126 | 129.4 Ų | 129.4 | 59% | 0.589 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -57.6 | -43.9 | 174.9 | -67.3 | 174.3 | -5.4 | 0 | 0 | 112.1 | E151 R157 E158 R159 | E151-Q155 PolarHBondContact O-N 3.12Å; Q155-R157 PolarHBondContact O-N 3.05Å; Q155-E158 PolarHBondContact O-N 3.35Å; Q155-R159 WeakPolarHBondContact O-CB 3.4Å; Q155-R159 PolarHBondContact O-N 3.16Å |
| 156 | E | 89.7 | Confident | 88.3 | Confident | 92 Ų | 92 | 128.8 Ų | 128.8 | 43% | 0.43 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -61.6 | -41.4 | 176 | -166.9 | -151.2 | 167 | 0 | 0 | 112.2 | K152 K154 K160 | K152-E156 VanDerWaalsContact O-CB 3.29Å; K152-E156 WeakPolarHBondContact O-CB 3.48Å; K152-E156 PolarHBondContact O-N 3.08Å; K154-E156 PolarHBondContact O-N 3.46Å; E156-K160 WeakPolarHBondContact O-CB 3.16Å; E156-K160 WeakPolarHBondContact O-CG 3.31Å; E156-K160 PolarHBondContact O-N 3.37Å; E156-K160 VanDerWaalsContact OE1-CE 3.28Å; E156-K160 WeakPolarHBondContact OE1-CE 3.23Å; E156-K160 IonicContact OE1-NZ 3.9Å; E156-K160 PolarHBondContact OE1-NZ 3.03Å |
| 157 | R | 90.8 | Very high | 88.9 | Confident | 178 Ų | 178 | 133 Ų | 133 | 67% | 0.672 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -65.3 | -40.1 | 175.1 | -74.9 | 167.3 | 179.2 | -167.2 | -1 | 111.6 | R153 K154 Q155 K160 K161 | R153-R157 WeakPolarHBondContact O-CB 3.24Å; R153-R157 WeakPolarHBondContact O-CD 3.48Å; R153-R157 WeakPolarHBondContact O-CG 3.04Å; R153-R157 PolarHBondContact O-N 2.74Å; R153-R157 VanDerWaalsContact O-N 3.15Å; K154-R157 WeakPolarHBondContact O-CB 3.5Å; K154-R157 PolarHBondContact O-N 2.83Å; K154-R157 VanDerWaalsContact O-N 3.14Å; Q155-R157 PolarHBondContact O-N 3.05Å; R157-K160 PolarHBondContact O-N 2.7Å; R157-K161 WeakPolarHBondContact O-CG 3.14Å; R157-K161 PolarHBondContact O-N 3.3Å |
| 158 | E | 92.6 | Very high | 89.4 | Confident | 78 Ų | 78 | 134.1 Ų | 134.1 | 36% | 0.364 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -67.4 | -46.2 | 177.2 | -74.9 | 173.9 | -159.6 | 0 | 0 | 111.6 | K154 Q155 K160 K161 R162 | K154-E158 VanDerWaalsContact CE-OE1 3.28Å; K154-E158 WeakPolarHBondContact CE-OE1 3.46Å; K154-E158 PolarHBondContact O-N 3.18Å; Q155-E158 PolarHBondContact O-N 3.35Å; E158-K160 VanDerWaalsContact C-N 3.28Å; E158-K160 PolarHBondContact O-N 3.06Å; E158-K161 CarbonylContact O-C 3.56Å; E158-K161 WeakPolarHBondContact O-CA 3.5Å; E158-K161 WeakPolarHBondContact O-CB 3.22Å; E158-K161 PolarHBondContact O-N 3.16Å; E158-R162 WeakPolarHBondContact O-CG 3.25Å; E158-R162 PolarHBondContact O-N 2.87Å |
| 159 | R | 92 | Very high | 89.6 | Confident | 172 Ų | 172 | 134.4 Ų | 134.4 | 65% | 0.649 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -55.6 | -40.9 | 170.9 | 175.9 | 173 | 155.3 | 144 | -6.2 | 112 | Q155 K163 | Q155-R159 WeakPolarHBondContact O-CB 3.4Å; Q155-R159 PolarHBondContact O-N 3.16Å; R159-K163 WeakPolarHBondContact O-CG 3.37Å; R159-K163 PolarHBondContact O-N 2.9Å |
| 160 | K | 91.9 | Very high | 90 | Very high | 114 Ų | 114 | 135.7 Ų | 135.7 | 50% | 0.496 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -69 | -32.2 | 174.1 | -76.8 | 173.5 | 175.3 | 173.5 | 0 | 113.3 | E156 R157 E158 R164 | E156-K160 WeakPolarHBondContact O-CB 3.16Å; E156-K160 WeakPolarHBondContact O-CG 3.31Å; E156-K160 PolarHBondContact O-N 3.37Å; E156-K160 VanDerWaalsContact OE1-CE 3.28Å; E156-K160 WeakPolarHBondContact OE1-CE 3.23Å; E156-K160 IonicContact OE1-NZ 3.9Å; E156-K160 PolarHBondContact OE1-NZ 3.03Å; R157-K160 PolarHBondContact O-N 2.7Å; E158-K160 VanDerWaalsContact C-N 3.28Å; E158-K160 PolarHBondContact O-N 3.06Å; K160-R164 VanDerWaalsContact O-CG 3.25Å; K160-R164 WeakPolarHBondContact O-CG 3.32Å; K160-R164 PolarHBondContact O-N 3.11Å |
| 161 | K | 92.4 | Very high | 90.1 | Very high | 142 Ų | 142 | 131.6 Ų | 131.6 | 62% | 0.617 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -70.1 | -45.4 | 172.6 | -77.6 | 179.1 | 176.5 | -174.3 | 0 | 111.4 | R157 E158 R164 K165 | R157-K161 WeakPolarHBondContact O-CG 3.14Å; R157-K161 PolarHBondContact O-N 3.3Å; E158-K161 CarbonylContact O-C 3.56Å; E158-K161 WeakPolarHBondContact O-CA 3.5Å; E158-K161 WeakPolarHBondContact O-CB 3.22Å; E158-K161 PolarHBondContact O-N 3.16Å; K161-R164 PolarHBondContact O-N 3.34Å; K161-K165 PolarHBondContact O-N 2.59Å |
| 162 | R | 90.9 | Very high | 90 | Very high | 169 Ų | 169 | 131.7 Ų | 131.7 | 64% | 0.638 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -57 | -54.3 | 176.3 | -68 | -175.1 | -171 | -164.1 | 3 | 110.7 | E158 R164 K165 E166 | E158-R162 WeakPolarHBondContact O-CG 3.25Å; E158-R162 PolarHBondContact O-N 2.87Å; R162-R164 VanDerWaalsContact C-N 3.25Å; R162-R164 PolarHBondContact O-N 3.26Å; R162-R164 VanDerWaalsContact O-N 3.11Å; R162-K165 CarbonylContact O-C 3.57Å; R162-K165 WeakPolarHBondContact O-CA 3.37Å; R162-K165 WeakPolarHBondContact O-CB 3.27Å; R162-K165 PolarHBondContact O-N 2.67Å; R162-E166 WeakPolarHBondContact CB-OE1 3.47Å; R162-E166 WeakPolarHBondContact O-CG 3.35Å; R162-E166 PolarHBondContact O-N 3.03Å |
| 163 | K | 91.9 | Very high | 89.6 | Confident | 121 Ų | 121 | 125.9 Ų | 125.9 | 53% | 0.526 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -55.8 | -32.7 | 174.2 | -70.2 | -168.3 | 176 | -138.5 | 0 | 115.1 | R159 E166 F167 | R159-K163 WeakPolarHBondContact O-CG 3.37Å; R159-K163 PolarHBondContact O-N 2.9Å; K163-E166 WeakPolarHBondContact CA-OE2 3.1Å; K163-E166 PolarHBondContact N-OE1 2.88Å; K163-F167 VanDerWaalsContact O-CB 3.22Å; K163-F167 WeakPolarHBondContact O-CB 3.4Å; K163-F167 PolarHBondContact O-N 3.3Å |
| 164 | R | 90.4 | Very high | 89.1 | Confident | 195 Ų | 195 | 126 Ų | 126 | 74% | 0.736 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -74.4 | -36 | 174.2 | -77 | 174 | 179.4 | -163.4 | -0.5 | 112.7 | K160 K161 R162 L168 | K160-R164 VanDerWaalsContact O-CG 3.25Å; K160-R164 WeakPolarHBondContact O-CG 3.32Å; K160-R164 PolarHBondContact O-N 3.11Å; K161-R164 PolarHBondContact O-N 3.34Å; R162-R164 VanDerWaalsContact C-N 3.25Å; R162-R164 PolarHBondContact O-N 3.26Å; R162-R164 VanDerWaalsContact O-N 3.11Å; R164-L168 VanDerWaalsContact O-CB 3.29Å; R164-L168 WeakPolarHBondContact O-CB 3.31Å; R164-L168 PolarHBondContact O-N 3.19Å |
| 165 | K | 91.7 | Very high | 88.1 | Confident | 148 Ų | 148 | 128.5 Ų | 128.5 | 64% | 0.643 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -67.6 | -50.3 | 172.7 | -73 | -173.1 | 170.8 | -164.3 | 0 | 110.5 | K161 R162 F167 L168 I169 | K161-K165 PolarHBondContact O-N 2.59Å; R162-K165 CarbonylContact O-C 3.57Å; R162-K165 WeakPolarHBondContact O-CA 3.37Å; R162-K165 WeakPolarHBondContact O-CB 3.27Å; R162-K165 PolarHBondContact O-N 2.67Å; K165-F167 VanDerWaalsContact C-N 3.33Å; K165-F167 PolarHBondContact O-N 3.31Å; K165-L168 CarbonylContact O-C 3.59Å; K165-L168 WeakPolarHBondContact O-CB 3.43Å; K165-L168 PolarHBondContact O-N 3.25Å; K165-I169 WeakPolarHBondContact O-CB 3.28Å; K165-I169 VanDerWaalsContact O-CG1 3.3Å; K165-I169 WeakPolarHBondContact O-CG1 3.33Å; K165-I169 PolarHBondContact O-N 3.29Å |
| 166 | E | 90.1 | Very high | 87.3 | Confident | 108 Ų | 108 | 125.9 Ų | 125.9 | 51% | 0.505 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -52.1 | -49 | 174.3 | -68.6 | 151 | -142.7 | 0 | 0 | 111.5 | R162 K163 L168 I169 K170 | R162-E166 WeakPolarHBondContact CB-OE1 3.47Å; R162-E166 WeakPolarHBondContact O-CG 3.35Å; R162-E166 PolarHBondContact O-N 3.03Å; K163-E166 WeakPolarHBondContact CA-OE2 3.1Å; K163-E166 PolarHBondContact N-OE1 2.88Å; E166-L168 VanDerWaalsContact C-N 3.33Å; E166-L168 PolarHBondContact O-N 3.25Å; E166-I169 PolarHBondContact O-N 2.85Å; E166-K170 WeakPolarHBondContact O-CB 3.33Å; E166-K170 PolarHBondContact O-N 2.86Å |
| 167 | F | 88.1 | Confident | 85.7 | Confident | 126 Ų | 126 | 124.8 Ų | 124.8 | 55% | 0.553 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -69 | -28 | 178.3 | -170.8 | -106.1 | 0 | 0 | 0 | 113.7 | K163 K165 K171 | K163-F167 VanDerWaalsContact O-CB 3.22Å; K163-F167 WeakPolarHBondContact O-CB 3.4Å; K163-F167 PolarHBondContact O-N 3.3Å; K165-F167 VanDerWaalsContact C-N 3.33Å; K165-F167 PolarHBondContact O-N 3.31Å; F167-K171 HydrophobicContact CD1-CD 4.23Å; F167-K171 HydrophobicContact CE1-CD 3.81Å; F167-K171 VanDerWaalsContact CE1-CE 3.45Å; F167-K171 HydrophobicContact CZ-CD 4.21Å; F167-K171 VanDerWaalsContact CZ-CE 3.45Å; F167-K171 WeakPolarHBondContact O-CB 3.47Å; F167-K171 WeakPolarHBondContact O-CG 3.3Å; F167-K171 PolarHBondContact O-N 3.14Å |
| 168 | L | 91.1 | Very high | 83.9 | Confident | 107 Ų | 107 | 122.5 Ų | 122.5 | 56% | 0.56 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -74.4 | -43.4 | 173.5 | -177 | 64 | 0 | 0 | 0 | 111.1 | R164 K165 E166 K171 L172 | R164-L168 VanDerWaalsContact O-CB 3.29Å; R164-L168 WeakPolarHBondContact O-CB 3.31Å; R164-L168 PolarHBondContact O-N 3.19Å; K165-L168 CarbonylContact O-C 3.59Å; K165-L168 WeakPolarHBondContact O-CB 3.43Å; K165-L168 PolarHBondContact O-N 3.25Å; E166-L168 VanDerWaalsContact C-N 3.33Å; E166-L168 PolarHBondContact O-N 3.25Å; L168-K171 CarbonylContact O-C 3.55Å; L168-K171 PolarHBondContact O-N 3.44Å; L168-L172 HydrophobicContact CG-CD1 4.2Å; L168-L172 WeakPolarHBondContact O-CG 3.44Å; L168-L172 PolarHBondContact O-N 2.84Å |
| 169 | I | 89.3 | Confident | 81.8 | Confident | 113 Ų | 113 | 128.1 Ų | 128.1 | 58% | 0.579 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -62.2 | -49.6 | 175.6 | -67.9 | 163.2 | 0 | 0 | 0 | 109.6 | K165 E166 K171 L172 A173 | K165-I169 WeakPolarHBondContact O-CB 3.28Å; K165-I169 VanDerWaalsContact O-CG1 3.3Å; K165-I169 WeakPolarHBondContact O-CG1 3.33Å; K165-I169 PolarHBondContact O-N 3.29Å; E166-I169 PolarHBondContact O-N 2.85Å; I169-K171 VanDerWaalsContact C-N 3.25Å; I169-K171 PolarHBondContact O-N 3.01Å; I169-L172 WeakPolarHBondContact O-CA 3.38Å; I169-L172 PolarHBondContact O-N 2.92Å; I169-A173 PolarHBondContact O-N 3.15Å |
| 170 | K | 87.9 | Confident | 79.7 | Confident | 154 Ų | 154 | 129.1 Ų | 129.1 | 67% | 0.67 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -56.9 | -38.7 | 175.4 | -175.5 | 162.8 | -175.4 | 159.6 | 0 | 112.2 | E166 E174 | E166-K170 WeakPolarHBondContact O-CB 3.33Å; E166-K170 PolarHBondContact O-N 2.86Å; K170-E174 WeakPolarHBondContact O-CB 3.43Å; K170-E174 PolarHBondContact O-N 3.04Å |
| 171 | K | 85.6 | Confident | 77.5 | Confident | 97 Ų | 97 | 131.4 Ų | 131.4 | 42% | 0.422 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -73.3 | -22.5 | 174.6 | -83.7 | -171 | 165.7 | -167.4 | 0 | 115.2 | F167 L168 I169 K175 | F167-K171 HydrophobicContact CD1-CD 4.23Å; F167-K171 HydrophobicContact CE1-CD 3.81Å; F167-K171 VanDerWaalsContact CE1-CE 3.45Å; F167-K171 HydrophobicContact CZ-CD 4.21Å; F167-K171 VanDerWaalsContact CZ-CE 3.45Å; F167-K171 WeakPolarHBondContact O-CB 3.47Å; F167-K171 WeakPolarHBondContact O-CG 3.3Å; F167-K171 PolarHBondContact O-N 3.14Å; L168-K171 CarbonylContact O-C 3.55Å; L168-K171 PolarHBondContact O-N 3.44Å; I169-K171 VanDerWaalsContact C-N 3.25Å; I169-K171 PolarHBondContact O-N 3.01Å; K171-K175 WeakPolarHBondContact O-CB 3.35Å; K171-K175 WeakPolarHBondContact O-CD 3.45Å; K171-K175 WeakPolarHBondContact O-CG 3.17Å; K171-K175 PolarHBondContact O-N 2.99Å |
| 172 | L | 85.3 | Confident | 75.3 | Confident | 103 Ų | 103 | 128.5 Ų | 128.5 | 54% | 0.539 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -80.9 | -41.4 | 173.1 | -73.2 | 167.3 | 0 | 0 | 0 | 109.7 | L168 I169 K175 A176 | L168-L172 HydrophobicContact CG-CD1 4.2Å; L168-L172 WeakPolarHBondContact O-CG 3.44Å; L168-L172 PolarHBondContact O-N 2.84Å; I169-L172 WeakPolarHBondContact O-CA 3.38Å; I169-L172 PolarHBondContact O-N 2.92Å; L172-K175 CarbonylContact O-C 3.49Å; L172-K175 PolarHBondContact O-N 2.85Å; L172-A176 VanDerWaalsContact O-CB 3.29Å; L172-A176 WeakPolarHBondContact O-CB 3.39Å; L172-A176 PolarHBondContact O-N 2.91Å |
| 173 | A | 80.9 | Confident | 73 | Confident | 26 Ų | 26 | 129.5 Ų | 129.5 | 22% | 0.215 | 63% | 0.631 | C | S | . | * | H | α-helix | trans | -61 | -49.5 | 172 | 0 | 0 | 0 | 0 | 0 | 112.1 | I169 K175 A176 G177 L178 | I169-A173 PolarHBondContact O-N 3.15Å; A173-K175 PolarHBondContact O-N 3.4Å; A173-K175 VanDerWaalsContact O-N 3.17Å; A173-A176 CarbonylContact O-C 3.59Å; A173-A176 PolarHBondContact O-N 2.87Å; A173-G177 PolarHBondContact O-N 2.94Å; A173-L178 PolarHBondContact O-N 2.9Å |
| 174 | E | 76.2 | Confident | 70.6 | Confident | 146 Ų | 146 | 131.2 Ų | 131.2 | 68% | 0.682 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -56.7 | -30.5 | 173.3 | -176.9 | -173.7 | -176.7 | 0 | 0 | 112.7 | K170 | K170-E174 WeakPolarHBondContact O-CB 3.43Å; K170-E174 PolarHBondContact O-N 3.04Å |
| 175 | K | 70.8 | Confident | 67.9 | Low | 183 Ų | 183 | 131 Ų | 131 | 80% | 0.796 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -85.1 | -23.4 | 174.6 | -80.6 | -179.9 | 170.1 | -161.3 | 0 | 114.3 | K171 L172 A173 | K171-K175 WeakPolarHBondContact O-CB 3.35Å; K171-K175 WeakPolarHBondContact O-CD 3.45Å; K171-K175 WeakPolarHBondContact O-CG 3.17Å; K171-K175 PolarHBondContact O-N 2.99Å; L172-K175 CarbonylContact O-C 3.49Å; L172-K175 PolarHBondContact O-N 2.85Å; A173-K175 PolarHBondContact O-N 3.4Å; A173-K175 VanDerWaalsContact O-N 3.17Å |
| 176 | A | 74.1 | Confident | 65 | Low | 71 Ų | 71 | 134.9 Ų | 134.9 | 59% | 0.587 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -91.4 | -4.5 | 178 | 0 | 0 | 0 | 0 | 0 | 112.5 | L172 A173 L178 | L172-A176 VanDerWaalsContact O-CB 3.29Å; L172-A176 WeakPolarHBondContact O-CB 3.39Å; L172-A176 PolarHBondContact O-N 2.91Å; A173-A176 CarbonylContact O-C 3.59Å; A173-A176 PolarHBondContact O-N 2.87Å; A176-L178 PolarHBondContact O-N 3.27Å |
| 177 | G | 55.8 | Low | 62.5 | Low | 70 Ų | 70 | 138.9 Ų | 138.9 | 72% | 0.722 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 73.9 | 10.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | A173 | A173-G177 PolarHBondContact O-N 2.94Š|
| 178 | L | 53.5 | Low | 59.9 | Low | 130 Ų | 130 | 142.5 Ų | 142.5 | 68% | 0.681 | 70% | 0.697 | S | S | * | * | trans | -98.5 | 114.7 | 178.8 | -77.1 | 164.5 | 0 | 0 | 0 | 110.1 | A173 A176 | A173-L178 PolarHBondContact O-N 2.9Å; A176-L178 PolarHBondContact O-N 3.27Å | ||
| 179 | E | 47.7 | Very low | 57.1 | Low | 196 Ų | 196 | 141.6 Ų | 141.6 | 92% | 0.916 | 71% | 0.705 | S | S | * | * | trans | -70.6 | 138.4 | 166.9 | -62.3 | -165.7 | 136.1 | 0 | 0 | 109.6 | ||||
| 180 | Y | 47.4 | Very low | 55.3 | Low | 193 Ų | 193 | 141.8 Ų | 141.8 | 76% | 0.757 | 71% | 0.714 | S | S | * | * | trans | -104 | 92.8 | -179.6 | 178.3 | -99.7 | 0 | 0 | 0 | 109.4 | P182 | Y180-P182 HydrophobicContact CE1-CB 4.03Š| ||
| 181 | E | 47.4 | Very low | 53.6 | Low | 161 Ų | 161 | 139.8 Ų | 139.8 | 75% | 0.752 | 72% | 0.716 | S | S | * | * | trans | -84.6 | 128.8 | 157.7 | -80.7 | -62.5 | 158.1 | 0 | 0 | 109.1 | E183 | E181-E183 PolarHBondContact O-N 2.71Å; E181-E183 VanDerWaalsContact O-N 3.17Å | ||
| 182 | P | 45.6 | Very low | 51.9 | Low | 82 Ų | 82 | 140 Ų | 140 | 53% | 0.532 | 73% | 0.728 | S | S | . | * | trans | -85.7 | 75.7 | 175.6 | 34.4 | -32.9 | 0 | 0 | 0 | 110.9 | Y180 | Y180-P182 HydrophobicContact CE1-CB 4.03Š| ||
| 183 | E | 42.5 | Very low | 49.5 | Very low | 189 Ų | 189 | 141.8 Ų | 141.8 | 88% | 0.883 | 74% | 0.743 | S | S | * | * | trans | -72.3 | 135.6 | 172.6 | -86.4 | -162.1 | 131.5 | 0 | 0 | 112.9 | E181 | E181-E183 PolarHBondContact O-N 2.71Å; E181-E183 VanDerWaalsContact O-N 3.17Å | ||
| 184 | I | 40.3 | Very low | 47.4 | Very low | 158 Ų | 158 | 145 Ų | 145 | 81% | 0.81 | 77% | 0.769 | S | S | * | * | trans | -107.2 | 111.5 | 175.1 | -62 | 167.3 | 0 | 0 | 0 | 108.2 | ||||
| 185 | K | 35.3 | Very low | 45.8 | Very low | 190 Ų | 190 | 144.2 Ų | 144.2 | 83% | 0.826 | 78% | 0.777 | S | S | * | * | trans | 169.3 | 148.5 | 159.3 | -93.7 | 146.9 | -174.8 | 179.8 | 0 | 106.2 | ||||
| 186 | R | 30.7 | Very low | 44 | Very low | 229 Ų | 229 | 140.3 Ų | 140.3 | 86% | 0.864 | 78% | 0.779 | S | S | * | * | cis | -175.6 | 138.8 | -11.8 | -113.3 | -174.5 | -178.1 | -176 | -2 | 101.9 | ||||
| 187 | E | 36 | Very low | 42.2 | Very low | 193 Ų | 193 | 141.7 Ų | 141.7 | 90% | 0.902 | 79% | 0.791 | S | S | * | * | trans | -72.4 | 134.9 | 171.9 | -66.6 | 168.2 | 126 | 0 | 0 | 110 | ||||
| 188 | E | 33.4 | Very low | 41.5 | Very low | 201 Ų | 201 | 142.1 Ų | 142.1 | 94% | 0.939 | 80% | 0.795 | S | S | * | * | trans | -168.6 | 155.3 | 131 | -116.2 | 176.9 | 170.8 | 0 | 0 | 111.8 | ||||
| 189 | A | 34.1 | Very low | 41.2 | Very low | 88 Ų | 88 | 145.7 Ų | 145.7 | 73% | 0.727 | 81% | 0.805 | S | S | * | * | trans | -164.7 | 170.5 | -177.9 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 190 | P | 49.7 | Very low | 40.9 | Very low | 118 Ų | 118 | 147.8 Ų | 147.8 | 77% | 0.766 | 80% | 0.804 | S | S | * | * | cis | -126.8 | -134.1 | -39.9 | 39.5 | -20.9 | 0 | 0 | 0 | 107.9 | ||||
| 191 | P | 53.5 | Low | 40.8 | Very low | 112 Ų | 112 | 145.1 Ų | 145.1 | 73% | 0.727 | 80% | 0.803 | S | S | * | * | cis | -123.7 | -142.2 | -39.6 | 42.8 | -24.4 | 0 | 0 | 0 | 109.8 | ||||
| 192 | P | 49.6 | Very low | 41.2 | Very low | 102 Ų | 102 | 147.1 Ų | 147.1 | 66% | 0.662 | 81% | 0.812 | S | S | * | * | cis | -132.6 | -167.1 | -23.7 | 36.7 | -15.8 | 0 | 0 | 0 | 115.8 | ||||
| 193 | T | 34.5 | Very low | 41.8 | Very low | 139 Ų | 139 | 148.8 Ų | 148.8 | 85% | 0.853 | 82% | 0.821 | S | S | * | * | trans | 81.8 | 137 | 169.4 | 65.9 | 0 | 0 | 0 | 0 | 118 | ||||
| 194 | A | 36.3 | Very low | 42.4 | Very low | 93 Ų | 93 | 143.6 Ų | 143.6 | 77% | 0.769 | 81% | 0.81 | S | S | * | * | cis | -152.5 | 169.1 | -7.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 195 | P | 43.6 | Very low | 43.4 | Very low | 130 Ų | 130 | 143.5 Ų | 143.5 | 84% | 0.844 | 81% | 0.81 | S | S | * | * | trans | -103.9 | 144 | -166.2 | 37.3 | -32.2 | 0 | 0 | 0 | 115.9 | ||||
| 196 | A | 32.9 | Very low | 45 | Very low | 101 Ų | 101 | 139.1 Ų | 139.1 | 84% | 0.835 | 80% | 0.799 | S | S | * | * | trans | -162.5 | 150 | 159.1 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 197 | A | 36.7 | Very low | 46.4 | Very low | 101 Ų | 101 | 138.3 Ų | 138.3 | 84% | 0.835 | 80% | 0.802 | S | S | * | * | trans | 66.1 | 72 | 149.2 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 198 | G | 41.8 | Very low | 48.1 | Very low | 78 Ų | 78 | 136.2 Ų | 136.2 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | 36.3 | 110.2 | 123.1 | 0 | 0 | 0 | 0 | 0 | 122 | |||||
| 199 | K | 45.6 | Very low | 49.5 | Very low | 205 Ų | 205 | 134 Ų | 134 | 89% | 0.891 | 79% | 0.785 | S | S | * | * | trans | -126.6 | 135.4 | 137.4 | -68.4 | -170.9 | 179.7 | -176.3 | 0 | 108.4 | ||||
| 200 | R | 42.6 | Very low | 50.6 | Low | 241 Ų | 241 | 136.2 Ų | 136.2 | 91% | 0.909 | 79% | 0.788 | S | S | * | * | trans | -80.4 | 143.4 | -176.3 | -65.9 | 171.9 | 176.6 | 148.2 | -1.8 | 109.8 | E202 | R200-E202 PolarHBondContact O-N 3.04Š| ||
| 201 | D | 45.3 | Very low | 50.8 | Low | 137 Ų | 137 | 138.4 Ų | 138.4 | 73% | 0.733 | 79% | 0.788 | S | S | * | * | trans | -68.6 | 112 | 178.1 | -55.4 | -73.4 | 0 | 0 | 0 | 111.6 | T203 | D201-T203 PolarHBondContact O-N 3.25Š| ||
| 202 | E | 55.7 | Low | 51 | Low | 202 Ų | 202 | 140.8 Ų | 140.8 | 94% | 0.944 | 79% | 0.794 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.6 | 16.7 | 173.3 | -65.2 | -168.4 | 161.9 | 0 | 0 | 113.5 | R200 | R200-E202 PolarHBondContact O-N 3.04Š|
| 203 | T | 57.9 | Low | 50.8 | Low | 117 Ų | 117 | 138.7 Ų | 138.7 | 72% | 0.718 | 79% | 0.792 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.5 | 21.9 | 176.7 | 61.8 | 0 | 0 | 0 | 0 | 113.2 | D201 I205 | D201-T203 PolarHBondContact O-N 3.25Å; T203-I205 VanDerWaalsContact C-N 3.31Å; T203-I205 PolarHBondContact O-N 3.36Å |
| 204 | A | 54.7 | Low | 51.6 | Low | 80 Ų | 80 | 140 Ų | 140 | 66% | 0.661 | 79% | 0.793 | S | S | * | * | trans | -70.9 | 84.9 | 166.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | V206 | A204-V206 VanDerWaalsContact C-N 3.35Å; A204-V206 PolarHBondContact O-N 2.8Å | ||
| 205 | I | 62.4 | Low | 52.3 | Low | 156 Ų | 156 | 139.1 Ų | 139.1 | 80% | 0.8 | 79% | 0.793 | S | S | * | * | trans | -67 | 91.9 | 175.8 | -58.3 | 174.5 | 0 | 0 | 0 | 109.1 | T203 F207 | T203-I205 VanDerWaalsContact C-N 3.31Å; T203-I205 PolarHBondContact O-N 3.36Å; I205-F207 PolarHBondContact O-N 3.3Å | ||
| 206 | V | 68.7 | Low | 52.7 | Low | 99 Ų | 99 | 134.9 Ų | 134.9 | 60% | 0.6 | 77% | 0.774 | S | S | * | * | trans | -70.4 | 110.5 | 173.7 | 177.6 | 0 | 0 | 0 | 0 | 108.7 | A204 N208 K209 | A204-V206 VanDerWaalsContact C-N 3.35Å; A204-V206 PolarHBondContact O-N 2.8Å; V206-N208 PolarHBondContact O-N 2.85Å; V206-K209 PolarHBondContact O-N 2.93Å | ||
| 207 | F | 60 | Low | 53.6 | Low | 212 Ų | 212 | 139.5 Ų | 139.5 | 93% | 0.93 | 78% | 0.775 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.3 | 4.2 | -170.9 | -158.1 | -99.8 | 0 | 0 | 0 | 115.7 | I205 | I205-F207 PolarHBondContact O-N 3.3Š|
| 208 | N | 71.9 | Confident | 54.7 | Low | 149 Ų | 149 | 138.5 Ų | 138.5 | 80% | 0.797 | 76% | 0.755 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -132.1 | 12.4 | -178 | -151.1 | 10.8 | 0 | 0 | 0 | 114.2 | V206 | V206-N208 PolarHBondContact O-N 2.85Š|
| 209 | K | 62.9 | Low | 56.4 | Low | 155 Ų | 155 | 138.6 Ų | 138.6 | 67% | 0.674 | 74% | 0.738 | S | S | * | * | trans | -119.9 | 95 | 167.9 | -145.2 | 82.7 | 174.4 | -165.1 | 0 | 108.5 | V206 E211 | V206-K209 PolarHBondContact O-N 2.93Å; K209-E211 HydrophobicContact CG-CG 4.15Å; K209-E211 PolarHBondContact O-N 2.98Å | ||
| 210 | V | 57.2 | Low | 58 | Low | 133 Ų | 133 | 136.6 Ų | 136.6 | 81% | 0.806 | 73% | 0.729 | S | S | * | * | trans | -76.9 | 81.1 | 167.8 | -175.7 | 0 | 0 | 0 | 0 | 107.4 | L212 | V210-L212 VanDerWaalsContact C-N 3.3Å; V210-L212 HydrophobicContact CG1-CG 4.34Å; V210-L212 PolarHBondContact O-N 2.81Å | ||
| 211 | E | 53.4 | Low | 59.8 | Low | 164 Ų | 164 | 130.3 Ų | 130.3 | 77% | 0.766 | 71% | 0.71 | S | S | * | * | trans | -67 | 99 | 160.3 | -68.6 | -174.6 | -178.7 | 0 | 0 | 107 | K209 G213 | K209-E211 HydrophobicContact CG-CG 4.15Å; K209-E211 PolarHBondContact O-N 2.98Å; E211-G213 PolarHBondContact O-N 3.39Å | ||
| 212 | L | 58.4 | Low | 61.5 | Low | 162 Ų | 162 | 128.7 Ų | 128.7 | 85% | 0.848 | 70% | 0.698 | S | S | * | * | trans | -63.7 | 82.7 | 159.2 | -79.5 | 161.1 | 0 | 0 | 0 | 106.6 | V210 | V210-L212 VanDerWaalsContact C-N 3.3Å; V210-L212 HydrophobicContact CG1-CG 4.34Å; V210-L212 PolarHBondContact O-N 2.81Å | ||
| 213 | G | 44.3 | Very low | 62.7 | Low | 59 Ų | 59 | 122.6 Ų | 122.6 | 61% | 0.608 | 67% | 0.668 | S | S | * | * | trans | -51.3 | 151.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | E211 G215 | E211-G213 PolarHBondContact O-N 3.39Å; G213-G215 PolarHBondContact O-N 2.89Å | ||
| 214 | D | 51.7 | Low | 63.8 | Low | 165 Ų | 165 | 123.1 Ų | 123.1 | 88% | 0.882 | 66% | 0.66 | S | S | * | * | S | Bend | trans | -68 | 31.5 | -163.5 | -165.1 | 27.7 | 0 | 0 | 0 | 115.9 | G216 | D214-G216 PolarHBondContact O-N 3.43Š|
| 215 | G | 50.5 | Low | 65.1 | Low | 75 Ų | 75 | 125.3 Ų | 125.3 | 77% | 0.773 | 66% | 0.655 | S | S | * | * | trans | -72.2 | 57.4 | 150.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | G213 | G213-G215 PolarHBondContact O-N 2.89Š| ||
| 216 | G | 51.7 | Low | 66.2 | Low | 42 Ų | 42 | 122.7 Ų | 122.7 | 43% | 0.433 | 64% | 0.639 | S | S | . | * | trans | -47.9 | 149 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | D214 L218 | D214-G216 PolarHBondContact O-N 3.43Å; G216-L218 PolarHBondContact O-N 3.12Å | ||
| 217 | F | 51.5 | Low | 66.7 | Low | 198 Ų | 198 | 124.1 Ų | 124.1 | 87% | 0.868 | 64% | 0.638 | S | S | * | * | trans | -72.7 | 66.3 | -176.1 | -155.2 | -89.6 | 0 | 0 | 0 | 110.6 | D219 | F217-D219 PolarHBondContact O-N 3.17Š| ||
| 218 | L | 61.1 | Low | 67.4 | Low | 79 Ų | 79 | 121.3 Ų | 121.3 | 41% | 0.414 | 63% | 0.625 | S | S | . | * | trans | -41.7 | 123.1 | -168.7 | -70.2 | 175.6 | 0 | 0 | 0 | 109.5 | G216 Q222 K223 | G216-L218 PolarHBondContact O-N 3.12Å; L218-Q222 HydrophobicContact CB-CB 4.42Å; L218-K223 HydrophobicContact CB-CD 4.27Å; L218-K223 HydrophobicContact CB-CG 3.81Å; L218-K223 VanDerWaalsContact O-CD 3.29Å; L218-K223 WeakPolarHBondContact O-CD 3.25Å; L218-K223 WeakPolarHBondContact O-CE 3.29Å; L218-K223 PolarHBondContact O-NZ 2.82Å | ||
| 219 | D | 76.5 | Confident | 67.7 | Low | 81 Ų | 81 | 120.8 Ų | 120.8 | 43% | 0.433 | 62% | 0.622 | S | S | . | * | trans | -58.2 | 152.3 | -170.5 | 173.7 | 50.8 | 0 | 0 | 0 | 110.1 | F217 E221 Q222 K223 | F217-D219 PolarHBondContact O-N 3.17Å; D219-E221 PolarHBondContact O-N 2.9Å; D219-E221 WeakPolarHBondContact OD2-CB 3.43Å; D219-E221 VanDerWaalsContact OD2-CG 3.28Å; D219-E221 WeakPolarHBondContact OD2-CG 3.4Å; D219-E221 PolarHBondContact OD2-N 3.03Å; D219-Q222 HydrophobicContact CB-CG 4.48Å; D219-Q222 PolarHBondContact O-N 2.68Å; D219-K223 PolarHBondContact O-N 2.98Å | ||
| 220 | K | 78.8 | Confident | 68.4 | Low | 163 Ų | 163 | 122 Ų | 122 | 71% | 0.709 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.2 | -27.7 | 179.5 | -67.6 | 170.4 | -174.2 | 162.2 | 0 | 111.1 | K224 | K220-K224 WeakPolarHBondContact O-CD 3.39Å; K220-K224 WeakPolarHBondContact O-CG 3.21Å; K220-K224 PolarHBondContact O-N 2.89Å |
| 221 | E | 80.3 | Confident | 69.6 | Low | 109 Ų | 109 | 118 Ų | 118 | 51% | 0.509 | 60% | 0.596 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -77.6 | -44.1 | 173.9 | -56.8 | -155.8 | 158 | 0 | 0 | 114.2 | D219 K223 K224 K225 | D219-E221 PolarHBondContact O-N 2.9Å; D219-E221 WeakPolarHBondContact OD2-CB 3.43Å; D219-E221 VanDerWaalsContact OD2-CG 3.28Å; D219-E221 WeakPolarHBondContact OD2-CG 3.4Å; D219-E221 PolarHBondContact OD2-N 3.03Å; E221-K223 VanDerWaalsContact C-N 3.33Å; E221-K223 PolarHBondContact O-N 3.44Å; E221-K224 CarbonylContact O-C 3.58Å; E221-K224 WeakPolarHBondContact O-CA 3.33Å; E221-K224 WeakPolarHBondContact O-CB 3.46Å; E221-K224 PolarHBondContact O-N 2.69Å; E221-K225 WeakPolarHBondContact O-CG 3.23Å; E221-K225 PolarHBondContact O-N 3.38Å |
| 222 | Q | 81.9 | Confident | 70.9 | Confident | 102 Ų | 102 | 114.2 Ų | 114.2 | 48% | 0.477 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -57.8 | -47.3 | 173.8 | -68.9 | 174 | -26.8 | 0 | 0 | 110.5 | L218 D219 K224 K225 E226 | L218-Q222 HydrophobicContact CB-CB 4.42Å; D219-Q222 HydrophobicContact CB-CG 4.48Å; D219-Q222 PolarHBondContact O-N 2.68Å; Q222-K224 PolarHBondContact O-N 3.45Å; Q222-K225 PolarHBondContact O-N 3.05Å; Q222-K225 VanDerWaalsContact O-N 3.09Å; Q222-E226 WeakPolarHBondContact O-CB 3.02Å; Q222-E226 PolarHBondContact O-N 3.35Å |
| 223 | K | 81.6 | Confident | 71.7 | Confident | 74 Ų | 74 | 108.4 Ų | 108.4 | 32% | 0.322 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -62.3 | -23.2 | 173.9 | -72.1 | 175.7 | 170 | 121.8 | 0 | 113.9 | L218 D219 E221 K227 | L218-K223 HydrophobicContact CB-CD 4.27Å; L218-K223 HydrophobicContact CB-CG 3.81Å; L218-K223 VanDerWaalsContact O-CD 3.29Å; L218-K223 WeakPolarHBondContact O-CD 3.25Å; L218-K223 WeakPolarHBondContact O-CE 3.29Å; L218-K223 PolarHBondContact O-NZ 2.82Å; D219-K223 PolarHBondContact O-N 2.98Å; E221-K223 VanDerWaalsContact C-N 3.33Å; E221-K223 PolarHBondContact O-N 3.44Å; K223-K227 VanDerWaalsContact O-CD 3.23Å; K223-K227 WeakPolarHBondContact O-CD 3.24Å; K223-K227 WeakPolarHBondContact O-CG 3.19Å |
| 224 | K | 81.2 | Confident | 73.4 | Confident | 128 Ų | 128 | 108.6 Ų | 108.6 | 56% | 0.557 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -79.8 | -42.5 | 171 | -76.6 | 165 | -171.3 | 171.6 | 0 | 111.1 | K220 E221 Q222 K227 K228 | K220-K224 WeakPolarHBondContact O-CD 3.39Å; K220-K224 WeakPolarHBondContact O-CG 3.21Å; K220-K224 PolarHBondContact O-N 2.89Å; E221-K224 CarbonylContact O-C 3.58Å; E221-K224 WeakPolarHBondContact O-CA 3.33Å; E221-K224 WeakPolarHBondContact O-CB 3.46Å; E221-K224 PolarHBondContact O-N 2.69Å; Q222-K224 PolarHBondContact O-N 3.45Å; K224-K227 PolarHBondContact O-N 2.92Å; K224-K228 WeakPolarHBondContact O-CG 3.5Å; K224-K228 PolarHBondContact O-N 3.33Å |
| 225 | K | 82.1 | Confident | 74.9 | Confident | 126 Ų | 126 | 102.2 Ų | 102.2 | 55% | 0.548 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.9 | -50.5 | 177.7 | -69.8 | 171.7 | -177.7 | 176.3 | 0 | 110.4 | E221 Q222 K227 K228 N229 | E221-K225 WeakPolarHBondContact O-CG 3.23Å; E221-K225 PolarHBondContact O-N 3.38Å; Q222-K225 PolarHBondContact O-N 3.05Å; Q222-K225 VanDerWaalsContact O-N 3.09Å; K225-K227 VanDerWaalsContact C-N 3.33Å; K225-K227 PolarHBondContact O-N 3.01Å; K225-K228 WeakPolarHBondContact O-CA 3.47Å; K225-K228 WeakPolarHBondContact O-CB 3.49Å; K225-K228 PolarHBondContact O-N 2.93Å; K225-N229 VanDerWaalsContact O-CG 3.29Å; K225-N229 PolarHBondContact O-N 3.02Å; K225-N229 PolarHBondContact O-OD1 2.99Å |
| 226 | E | 83.6 | Confident | 76.6 | Confident | 101 Ų | 101 | 101.4 Ų | 101.4 | 47% | 0.472 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -56.4 | -43.3 | 176 | -166.4 | -155.8 | 158.6 | 0 | 0 | 112.7 | Q222 K228 N229 R230 | Q222-E226 WeakPolarHBondContact O-CB 3.02Å; Q222-E226 PolarHBondContact O-N 3.35Å; E226-K228 VanDerWaalsContact C-N 3.33Å; E226-K228 PolarHBondContact O-N 3.22Å; E226-N229 PolarHBondContact O-N 2.91Å; E226-R230 PolarHBondContact O-N 2.96Å |
| 227 | K | 79.6 | Confident | 78.3 | Confident | 130 Ų | 130 | 101.1 Ų | 101.1 | 57% | 0.565 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -66.1 | -30.7 | 175.1 | -74.8 | 172.4 | -168.7 | 169.3 | 0 | 113.5 | K223 K224 K225 I231 | K223-K227 VanDerWaalsContact O-CD 3.23Å; K223-K227 WeakPolarHBondContact O-CD 3.24Å; K223-K227 WeakPolarHBondContact O-CG 3.19Å; K224-K227 PolarHBondContact O-N 2.92Å; K225-K227 VanDerWaalsContact C-N 3.33Å; K225-K227 PolarHBondContact O-N 3.01Å; K227-I231 WeakPolarHBondContact O-CD1 3.39Å; K227-I231 WeakPolarHBondContact O-CG1 3.47Å |
| 228 | K | 76.3 | Confident | 80.2 | Confident | 152 Ų | 152 | 91.7 Ų | 91.7 | 66% | 0.661 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -69.5 | -44.2 | 171.1 | -72.9 | 177.2 | 176.7 | -174.3 | 0 | 110.4 | K224 K225 E226 R230 I231 | K224-K228 WeakPolarHBondContact O-CG 3.5Å; K224-K228 PolarHBondContact O-N 3.33Å; K225-K228 WeakPolarHBondContact O-CA 3.47Å; K225-K228 WeakPolarHBondContact O-CB 3.49Å; K225-K228 PolarHBondContact O-N 2.93Å; E226-K228 VanDerWaalsContact C-N 3.33Å; E226-K228 PolarHBondContact O-N 3.22Å; K228-R230 VanDerWaalsContact C-N 3.28Å; K228-R230 PolarHBondContact O-N 2.86Å; K228-I231 WeakPolarHBondContact O-CB 3.35Å; K228-I231 PolarHBondContact O-N 2.87Å |
| 229 | N | 76.8 | Confident | 81.5 | Confident | 138 Ų | 138 | 91 Ų | 91 | 74% | 0.738 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -63 | -33.6 | -179.4 | -62.7 | 1.5 | 0 | 0 | 0 | 112.1 | K225 E226 I231 | K225-N229 VanDerWaalsContact O-CG 3.29Å; K225-N229 PolarHBondContact O-N 3.02Å; K225-N229 PolarHBondContact O-OD1 2.99Å; E226-N229 PolarHBondContact O-N 2.91Å; N229-I231 PolarHBondContact O-N 3.15Å |
| 230 | R | 78.3 | Confident | 82.2 | Confident | 181 Ų | 181 | 88.6 Ų | 88.6 | 68% | 0.683 | 45% | 0.447 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.2 | -10 | 170.9 | -78.6 | -177.9 | 58.5 | -141.5 | -4.8 | 115.1 | E226 K228 K232 | E226-R230 PolarHBondContact O-N 2.96Å; K228-R230 VanDerWaalsContact C-N 3.28Å; K228-R230 PolarHBondContact O-N 2.86Å; R230-K232 PolarHBondContact O-N 3.4Å |
| 231 | I | 82.6 | Confident | 82.7 | Confident | 50 Ų | 50 | 88.1 Ų | 88.1 | 26% | 0.256 | 45% | 0.445 | S | S | . | . | S | Bend | trans | -91.4 | 90.9 | 178.8 | -59.7 | 164 | 0 | 0 | 0 | 109.5 | K227 K228 N229 G233 G234 L235 T236 Y282 | K227-I231 WeakPolarHBondContact O-CD1 3.39Å; K227-I231 WeakPolarHBondContact O-CG1 3.47Å; K228-I231 WeakPolarHBondContact O-CB 3.35Å; K228-I231 PolarHBondContact O-N 2.87Å; N229-I231 PolarHBondContact O-N 3.15Å; I231-G233 PolarHBondContact O-N 3.43Å; I231-G234 VanDerWaalsContact CG2-C 3.5Å; I231-G234 PolarHBondContact O-N 3.21Å; I231-L235 VanDerWaalsContact CG2-C 3.43Å; I231-L235 WeakPolarHBondContact CG2-O 3.36Å; I231-T236 HydrophobicContact CD1-CG2 3.85Å; I231-T236 HydrophobicContact CG2-CG2 4.43Å; I231-Y282 WeakPolarHBondContact CA-OH 3.34Å |
| 232 | K | 81.2 | Confident | 83.4 | Confident | 83 Ų | 83 | 87.5 Ų | 87.5 | 36% | 0.361 | 45% | 0.445 | S | S | . | . | G | 310 helix | trans | -46.6 | 124 | 172.2 | -63.1 | 177 | 174.2 | 169.6 | 0 | 111.1 | R230 G234 L235 L281 Y282 E285 | R230-K232 PolarHBondContact O-N 3.4Å; K232-G234 PolarHBondContact O-N 3.24Å; K232-G234 VanDerWaalsContact O-N 3.11Å; K232-L235 PolarHBondContact O-N 2.9Å; K232-L281 HydrophobicContact CD-CB 4.37Å; K232-Y282 HydrophobicContact CB-CE1 4.07Å; K232-Y282 HydrophobicContact CB-CE2 4.21Å; K232-Y282 HydrophobicContact CD-CD1 4.06Å; K232-Y282 HydrophobicContact CD-CE1 3.85Å; K232-Y282 HydrophobicContact CG-CE1 4.06Å; K232-Y282 PolarHBondContact N-OH 3.25Å; K232-E285 WeakPolarHBondContact CE-OE2 3.41Å; K232-E285 IonicContact NZ-OE2 2.63Å; K232-E285 PolarHBondContact NZ-OE2 3.18Å |
| 233 | G | 74.4 | Confident | 83.9 | Confident | 41 Ų | 41 | 84.6 Ų | 84.6 | 42% | 0.423 | 43% | 0.43 | S | S | . | . | G | 310 helix | trans | 62.6 | 12.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | I231 L235 K274 | I231-G233 PolarHBondContact O-N 3.43Å; G233-L235 PolarHBondContact O-N 2.82Å; G233-K274 VanDerWaalsContact O-CE 3.25Å; G233-K274 WeakPolarHBondContact O-CE 3.42Å |
| 234 | G | 79.5 | Confident | 84.6 | Confident | 63 Ų | 63 | 87.8 Ų | 87.8 | 65% | 0.649 | 44% | 0.444 | S | S | * | . | G | 310 helix | trans | 74.3 | 1.6 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | I231 K232 | I231-G234 VanDerWaalsContact CG2-C 3.5Å; I231-G234 PolarHBondContact O-N 3.21Å; K232-G234 PolarHBondContact O-N 3.24Å; K232-G234 VanDerWaalsContact O-N 3.11Å |
| 235 | L | 83.4 | Confident | 85.2 | Confident | 30 Ų | 30 | 87.2 Ų | 87.2 | 16% | 0.157 | 44% | 0.443 | C | S | . | . | trans | -98.9 | 109.9 | -176.4 | -126 | 77.2 | 0 | 0 | 0 | 111.3 | I231 K232 G233 M275 Y282 | I231-L235 VanDerWaalsContact CG2-C 3.43Å; I231-L235 WeakPolarHBondContact CG2-O 3.36Å; K232-L235 PolarHBondContact O-N 2.9Å; G233-L235 PolarHBondContact O-N 2.82Å; L235-M275 HydrophobicContact CD2-CB 3.96Å; L235-M275 HydrophobicContact CD2-CG 3.6Å; L235-M275 HydrophobicContact CD2-SD 3.91Å; L235-Y282 WeakPolarHBondContact O-CE2 3.36Å; L235-Y282 PolarHBondContact O-OH 3.12Å | ||
| 236 | T | 85.6 | Confident | 85.8 | Confident | 59 Ų | 59 | 81.4 Ų | 81.4 | 36% | 0.362 | 42% | 0.418 | S | S | . | . | trans | -61 | 128.9 | 178.2 | 50.8 | 0 | 0 | 0 | 0 | 111.6 | I231 L238 R253 | I231-T236 HydrophobicContact CD1-CG2 3.85Å; I231-T236 HydrophobicContact CG2-CG2 4.43Å; T236-L238 WeakPolarHBondContact O-CD1 3.3Å; T236-R253 PolarHBondContact O-NH2 3.37Å | ||
| 237 | P | 87.9 | Confident | 86.3 | Confident | 35 Ų | 35 | 77.5 Ų | 77.5 | 23% | 0.227 | 40% | 0.4 | C | S | . | . | trans | -70 | 136.8 | -175.4 | 26.2 | -33.5 | 0 | 0 | 0 | 111.4 | V239 Y282 L287 | P237-V239 HydrophobicContact CB-CG2 3.95Å; P237-V239 PolarHBondContact O-N 3.14Å; P237-Y282 HydrophobicContact CB-CD1 4.38Å; P237-Y282 HydrophobicContact CB-CD2 3.96Å; P237-Y282 HydrophobicContact CB-CE1 4.34Å; P237-Y282 HydrophobicContact CB-CE2 3.94Å; P237-Y282 HydrophobicContact CB-CG 4.17Å; P237-Y282 HydrophobicContact CG-CE1 4.19Å; P237-Y282 HydrophobicContact CG-CE2 4.31Å; P237-L287 HydrophobicContact CB-CD1 4.09Å; P237-L287 HydrophobicContact CG-CD1 4.1Å | ||
| 238 | L | 91.3 | Very high | 87.1 | Confident | 1 Ų | 1 | 73 Ų | 73 | 1% | 0.005 | 39% | 0.39 | C | S | . | . | trans | -80.8 | 67 | -178.8 | -95.5 | 63.6 | 0 | 0 | 0 | 111.5 | T236 R249 V250 R253 I289 K290 D291 | T236-L238 WeakPolarHBondContact O-CD1 3.3Å; L238-R249 HydrophobicContact CD1-CB 4.36Å; L238-R249 HydrophobicContact CD2-CB 4.49Å; L238-R249 HydrophobicContact CG-CB 4.5Å; L238-V250 HydrophobicContact CD2-CB 4.49Å; L238-V250 HydrophobicContact CD2-CG2 3.31Å; L238-R253 VanDerWaalsContact CD1-NH2 3.33Å; L238-I289 HydrophobicContact CB-CG2 4.38Å; L238-K290 PolarHBondContact O-N 3.42Å; L238-D291 WeakPolarHBondContact CB-OD1 3.32Å; L238-D291 WeakPolarHBondContact CD2-OD1 3.39Å | ||
| 239 | V | 89.6 | Confident | 88 | Confident | 63 Ų | 63 | 71 Ų | 71 | 38% | 0.382 | 38% | 0.379 | S | S | . | . | trans | -108.2 | 149.1 | -173.8 | 176.4 | 0 | 0 | 0 | 0 | 110.8 | P237 L287 I289 | P237-V239 HydrophobicContact CB-CG2 3.95Å; P237-V239 PolarHBondContact O-N 3.14Å; V239-L287 HydrophobicContact CG2-CB 4.01Å; V239-L287 HydrophobicContact CG2-CD1 4.47Å; V239-I289 HydrophobicContact CG2-CG1 4.31Å | ||
| 240 | G | 89.9 | Confident | 88.8 | Confident | 31 Ų | 31 | 65 Ų | 65 | 32% | 0.32 | 35% | 0.347 | S | S | . | . | S | Bend | trans | 117.6 | -154.3 | 167.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | K290 | G240-K290 PolarHBondContact O-NZ 2.84Š|
| 241 | K | 90.7 | Very high | 89.6 | Confident | 154 Ų | 154 | 59.7 Ų | 59.7 | 67% | 0.67 | 33% | 0.33 | S | S | * | . | S | Bend | trans | -124.4 | 0.9 | -172.4 | -63 | 174.6 | -175.5 | 170.5 | 0 | 113 | Y243 K303 | K241-Y243 VanDerWaalsContact C-N 3.29Å; K241-Y243 PolarHBondContact O-N 3.12Å; K241-K303 PolarHBondContact O-NZ 3.07Å |
| 242 | N | 94 | Very high | 90.1 | Very high | 96 Ų | 96 | 59.7 Ų | 59.7 | 51% | 0.513 | 34% | 0.338 | S | S | . | . | trans | -85.8 | 66.3 | -176.9 | -69.6 | -4.1 | 0 | 0 | 0 | 111.1 | K244 Q245 L246 | N242-K244 PolarHBondContact O-N 2.91Å; N242-Q245 HydrophobicContact CB-CB 4.13Å; N242-Q245 HydrophobicContact CB-CG 4.37Å; N242-Q245 VanDerWaalsContact CB-OE1 3.28Å; N242-Q245 PolarHBondContact ND2-OE1 2.89Å; N242-Q245 WeakPolarHBondContact O-CA 3.35Å; N242-Q245 PolarHBondContact O-N 3.27Å; N242-L246 HydrophobicContact CB-CD1 4.35Å; N242-L246 VanDerWaalsContact O-CD1 3.3Å; N242-L246 WeakPolarHBondContact O-CD1 3.41Å; N242-L246 PolarHBondContact O-N 2.69Å | ||
| 243 | Y | 93.3 | Very high | 90.7 | Very high | 41 Ų | 41 | 58 Ų | 58 | 16% | 0.161 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -55.7 | -26 | -169.5 | -50.6 | -44.9 | 0 | 0 | 0 | 115 | K241 L247 L296 S299 K303 | K241-Y243 VanDerWaalsContact C-N 3.29Å; K241-Y243 PolarHBondContact O-N 3.12Å; Y243-L247 WeakPolarHBondContact O-CB 3.34Å; Y243-L247 PolarHBondContact O-N 3.19Å; Y243-L296 HydrophobicContact CD1-CD2 3.89Å; Y243-S299 VanDerWaalsContact CE2-CB 3.49Å; Y243-K303 HydrophobicContact CD2-CD 3.75Å; Y243-K303 HydrophobicContact CD2-CG 4.43Å; Y243-K303 HydrophobicContact CE2-CD 3.78Å; Y243-K303 VanDerWaalsContact CE2-CE 3.44Å; Y243-K303 HydrophobicContact CE2-CG 4.25Å |
| 244 | K | 94.5 | Very high | 91.6 | Very high | 140 Ų | 140 | 60.3 Ų | 60.3 | 61% | 0.609 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -67.2 | -46.2 | 171.7 | -62.5 | -158.5 | 175.2 | -158.4 | 0 | 112.2 | N242 L247 G248 L300 E304 | N242-K244 PolarHBondContact O-N 2.91Å; K244-L247 PolarHBondContact O-N 2.86Å; K244-G248 PolarHBondContact O-N 3.4Å; K244-G248 VanDerWaalsContact O-N 3.1Å; K244-L300 HydrophobicContact CB-CD2 4.49Å; K244-L300 HydrophobicContact CD-CD2 4.48Å; K244-L300 HydrophobicContact CG-CD1 4.1Å; K244-L300 HydrophobicContact CG-CD2 3.46Å; K244-L300 VanDerWaalsContact CG-CD2 3.46Å; K244-L300 HydrophobicContact CG-CG 4.45Å; K244-E304 IonicContact NZ-OE1 2.91Å |
| 245 | Q | 93.9 | Very high | 92.3 | Very high | 116 Ų | 116 | 59.1 Ų | 59.1 | 54% | 0.542 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -69.9 | -34.6 | 177.1 | -68.3 | 175.6 | -26.2 | 0 | 0 | 111.9 | N242 R249 | N242-Q245 HydrophobicContact CB-CB 4.13Å; N242-Q245 HydrophobicContact CB-CG 4.37Å; N242-Q245 VanDerWaalsContact CB-OE1 3.28Å; N242-Q245 PolarHBondContact ND2-OE1 2.89Å; N242-Q245 WeakPolarHBondContact O-CA 3.35Å; N242-Q245 PolarHBondContact O-N 3.27Å; Q245-R249 WeakPolarHBondContact O-CB 3.37Å; Q245-R249 VanDerWaalsContact O-CG 3.23Å; Q245-R249 WeakPolarHBondContact O-CG 3.39Å; Q245-R249 PolarHBondContact O-N 3.21Å; Q245-R249 VanDerWaalsContact O-N 3.16Å |
| 246 | L | 94.5 | Very high | 92.8 | Very high | 5 Ų | 5 | 63.9 Ų | 63.9 | 3% | 0.026 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -67.5 | -46.7 | 173.8 | -85.5 | 75.2 | 0 | 0 | 0 | 110.5 | N242 G248 R249 V250 K290 L296 | N242-L246 HydrophobicContact CB-CD1 4.35Å; N242-L246 VanDerWaalsContact O-CD1 3.3Å; N242-L246 WeakPolarHBondContact O-CD1 3.41Å; N242-L246 PolarHBondContact O-N 2.69Å; L246-G248 PolarHBondContact O-N 3.42Å; L246-R249 WeakPolarHBondContact O-CA 3.42Å; L246-R249 WeakPolarHBondContact O-CB 3.38Å; L246-R249 PolarHBondContact O-N 2.9Å; L246-V250 WeakPolarHBondContact O-CG2 3.42Å; L246-V250 PolarHBondContact O-N 2.98Å; L246-K290 HydrophobicContact CD2-CB 3.92Å; L246-K290 HydrophobicContact CD2-CD 4.3Å; L246-L296 HydrophobicContact CB-CD1 4Å; L246-L296 HydrophobicContact CB-CD2 3.8Å; L246-L296 HydrophobicContact CD2-CD2 3.96Å |
| 247 | L | 95.7 | Very high | 93.1 | Very high | 19 Ų | 19 | 62.3 Ų | 62.3 | 10% | 0.099 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -57.6 | -51.6 | 179.1 | -176.7 | 63.2 | 0 | 0 | 0 | 111.4 | Y243 K244 R249 V250 E251 E293 L296 R297 L300 | Y243-L247 WeakPolarHBondContact O-CB 3.34Å; Y243-L247 PolarHBondContact O-N 3.19Å; K244-L247 PolarHBondContact O-N 2.86Å; L247-R249 PolarHBondContact O-N 3Å; L247-V250 PolarHBondContact O-N 2.78Å; L247-E251 HydrophobicContact CD1-CG 4.32Å; L247-E251 WeakPolarHBondContact CD1-OE1 3.46Å; L247-E251 HydrophobicContact CG-CG 4.44Å; L247-E251 WeakPolarHBondContact CG-OE1 3.3Å; L247-E251 WeakPolarHBondContact O-CG 3.32Å; L247-E251 PolarHBondContact O-N 3.18Å; L247-E293 HydrophobicContact CD1-CB 4.04Å; L247-E293 HydrophobicContact CD1-CG 4.12Å; L247-L296 HydrophobicContact CB-CB 4.5Å; L247-L296 HydrophobicContact CD1-CB 4.37Å; L247-R297 HydrophobicContact CD1-CG 3.94Å; L247-R297 HydrophobicContact CD2-CG 3.7Å; L247-L300 HydrophobicContact CD2-CD1 4.07Å |
| 248 | G | 95.4 | Very high | 93.4 | Very high | 34 Ų | 34 | 65.3 Ų | 65.3 | 35% | 0.351 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -62.8 | -23.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | K244 L246 A252 | K244-G248 PolarHBondContact O-N 3.4Å; K244-G248 VanDerWaalsContact O-N 3.1Å; L246-G248 PolarHBondContact O-N 3.42Å; G248-A252 WeakPolarHBondContact O-CB 3.48Å; G248-A252 PolarHBondContact O-N 2.95Å |
| 249 | R | 94.5 | Very high | 93.5 | Very high | 110 Ų | 110 | 69.8 Ų | 69.8 | 42% | 0.415 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -77.9 | -29.9 | 171.3 | -77.7 | 175.5 | -175.1 | -173.2 | 2.3 | 113.2 | L238 Q245 L246 L247 R253 | L238-R249 HydrophobicContact CD1-CB 4.36Å; L238-R249 HydrophobicContact CD2-CB 4.49Å; L238-R249 HydrophobicContact CG-CB 4.5Å; Q245-R249 WeakPolarHBondContact O-CB 3.37Å; Q245-R249 VanDerWaalsContact O-CG 3.23Å; Q245-R249 WeakPolarHBondContact O-CG 3.39Å; Q245-R249 PolarHBondContact O-N 3.21Å; Q245-R249 VanDerWaalsContact O-N 3.16Å; L246-R249 WeakPolarHBondContact O-CA 3.42Å; L246-R249 WeakPolarHBondContact O-CB 3.38Å; L246-R249 PolarHBondContact O-N 2.9Å; L247-R249 PolarHBondContact O-N 3Å; R249-R253 VanDerWaalsContact O-CG 3.27Å; R249-R253 WeakPolarHBondContact O-CG 3.41Å; R249-R253 PolarHBondContact O-N 2.93Å |
| 250 | V | 94.2 | Very high | 93.7 | Very high | 12 Ų | 12 | 69.2 Ų | 69.2 | 7% | 0.073 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -72.7 | -49.8 | 172.1 | -176.3 | 0 | 0 | 0 | 0 | 109.3 | L238 L246 L247 A252 R253 K254 D291 E293 L296 | L238-V250 HydrophobicContact CD2-CB 4.49Å; L238-V250 HydrophobicContact CD2-CG2 3.31Å; L246-V250 WeakPolarHBondContact O-CG2 3.42Å; L246-V250 PolarHBondContact O-N 2.98Å; L247-V250 PolarHBondContact O-N 2.78Å; V250-A252 VanDerWaalsContact C-N 3.33Å; V250-A252 PolarHBondContact O-N 3.26Å; V250-R253 WeakPolarHBondContact O-CA 3.29Å; V250-R253 WeakPolarHBondContact O-CB 3.5Å; V250-R253 PolarHBondContact O-N 3.28Å; V250-K254 PolarHBondContact O-N 3.04Å; V250-D291 WeakPolarHBondContact CG1-O 3.35Å; V250-D291 WeakPolarHBondContact CG2-O 3.29Å; V250-E293 HydrophobicContact CB-CG 4.08Å; V250-E293 HydrophobicContact CG1-CG 3.53Å; V250-E293 WeakPolarHBondContact CG1-OE1 3.13Å; V250-L296 HydrophobicContact CG2-CD1 3.84Å |
| 251 | E | 94.6 | Very high | 93.9 | Very high | 70 Ų | 70 | 74 Ų | 74 | 33% | 0.327 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -57.5 | -45.8 | 179.3 | -69.2 | 165.8 | 165.9 | 0 | 0 | 110.4 | L247 R253 K254 A255 R297 | L247-E251 HydrophobicContact CD1-CG 4.32Å; L247-E251 WeakPolarHBondContact CD1-OE1 3.46Å; L247-E251 HydrophobicContact CG-CG 4.44Å; L247-E251 WeakPolarHBondContact CG-OE1 3.3Å; L247-E251 WeakPolarHBondContact O-CG 3.32Å; L247-E251 PolarHBondContact O-N 3.18Å; E251-R253 VanDerWaalsContact C-N 3.27Å; E251-R253 PolarHBondContact O-N 2.91Å; E251-K254 PolarHBondContact O-N 3.38Å; E251-A255 PolarHBondContact O-N 3.05Å; E251-R297 IonicContact OE1-CZ 2.81Å; E251-R297 IonicContact OE1-NE 3.75Å; E251-R297 IonicContact OE1-NH2 3.42Å; E251-R297 PolarHBondContact OE1-NH2 2.92Å |
| 252 | A | 94.8 | Very high | 94 | Very high | 51 Ų | 51 | 74.2 Ų | 74.2 | 42% | 0.421 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -70.2 | -13.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | G248 V250 K256 | G248-A252 WeakPolarHBondContact O-CB 3.48Å; G248-A252 PolarHBondContact O-N 2.95Å; V250-A252 VanDerWaalsContact C-N 3.33Å; V250-A252 PolarHBondContact O-N 3.26Å; A252-K256 WeakPolarHBondContact O-CD 3.45Å; A252-K256 VanDerWaalsContact O-CG 3.28Å; A252-K256 WeakPolarHBondContact O-CG 3.15Å |
| 253 | R | 92.5 | Very high | 93.9 | Very high | 48 Ų | 48 | 76.8 Ų | 76.8 | 18% | 0.181 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -85.1 | -40.3 | 169.3 | -81.7 | 175.4 | -177.8 | -167 | 1.4 | 111.5 | T236 L238 R249 V250 E251 K256 L257 M275 | T236-R253 PolarHBondContact O-NH2 3.37Å; L238-R253 VanDerWaalsContact CD1-NH2 3.33Å; R249-R253 VanDerWaalsContact O-CG 3.27Å; R249-R253 WeakPolarHBondContact O-CG 3.41Å; R249-R253 PolarHBondContact O-N 2.93Å; V250-R253 WeakPolarHBondContact O-CA 3.29Å; V250-R253 WeakPolarHBondContact O-CB 3.5Å; V250-R253 PolarHBondContact O-N 3.28Å; E251-R253 VanDerWaalsContact C-N 3.27Å; E251-R253 PolarHBondContact O-N 2.91Å; R253-K256 PolarHBondContact O-N 3.3Å; R253-L257 WeakPolarHBondContact O-CG 3.47Å; R253-L257 PolarHBondContact O-N 2.67Å; R253-M275 HydrophobicContact CG-SD 4.43Å |
| 254 | K | 93.4 | Very high | 93.9 | Very high | 89 Ų | 89 | 78 Ų | 78 | 39% | 0.387 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -63 | -50.6 | 175.2 | -71.3 | -165.1 | -179.2 | 178.3 | 0 | 111.3 | V250 E251 K256 L257 E258 E293 | V250-K254 PolarHBondContact O-N 3.04Å; E251-K254 PolarHBondContact O-N 3.38Å; K254-K256 VanDerWaalsContact C-N 3.26Å; K254-K256 PolarHBondContact O-N 3.48Å; K254-L257 CarbonylContact O-C 3.54Å; K254-L257 WeakPolarHBondContact O-CA 3.45Å; K254-L257 WeakPolarHBondContact O-CB 3.42Å; K254-L257 PolarHBondContact O-N 2.92Å; K254-E258 WeakPolarHBondContact O-CG 3.44Å; K254-E258 PolarHBondContact O-N 3.23Å; K254-E293 WeakPolarHBondContact CD-OE1 3.32Å; K254-E293 VanDerWaalsContact CE-CD 3.48Å; K254-E293 WeakPolarHBondContact CE-OE1 3.38Å; K254-E293 IonicContact NZ-OE1 2.62Å; K254-E293 PolarHBondContact NZ-OE1 2.96Å; K254-E293 IonicContact NZ-OE2 3.57Å; K254-E293 PolarHBondContact NZ-OE2 2.96Å |
| 255 | A | 94.8 | Very high | 93.8 | Very high | 37 Ų | 37 | 77.1 Ų | 77.1 | 31% | 0.306 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -52.5 | -44.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | E251 L257 E258 E259 | E251-A255 PolarHBondContact O-N 3.05Å; A255-L257 PolarHBondContact O-N 3.16Å; A255-E258 PolarHBondContact O-N 3.29Å; A255-E259 WeakPolarHBondContact O-CB 3.27Å; A255-E259 VanDerWaalsContact O-CG 3.29Å; A255-E259 WeakPolarHBondContact O-CG 3.46Å; A255-E259 PolarHBondContact O-N 3.47Å |
| 256 | K | 92.9 | Very high | 93.7 | Very high | 131 Ų | 131 | 73.8 Ų | 73.8 | 57% | 0.57 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -65.8 | -33.4 | 175.6 | -73.6 | -177.9 | 180 | -156.3 | 0 | 114.4 | A252 R253 K254 L260 | A252-K256 WeakPolarHBondContact O-CD 3.45Å; A252-K256 VanDerWaalsContact O-CG 3.28Å; A252-K256 WeakPolarHBondContact O-CG 3.15Å; R253-K256 PolarHBondContact O-N 3.3Å; K254-K256 VanDerWaalsContact C-N 3.26Å; K254-K256 PolarHBondContact O-N 3.48Å; K256-L260 VanDerWaalsContact O-CB 3.3Å; K256-L260 WeakPolarHBondContact O-CB 3.47Å; K256-L260 WeakPolarHBondContact O-CD1 3.44Å; K256-L260 WeakPolarHBondContact O-CG 3.43Å; K256-L260 PolarHBondContact O-N 2.95Å; K256-L260 VanDerWaalsContact O-N 3.14Å |
| 257 | L | 93.3 | Very high | 93.5 | Very high | 25 Ų | 25 | 79.2 Ų | 79.2 | 13% | 0.131 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -73.3 | -35.8 | 174.1 | -74.7 | 174.6 | 0 | 0 | 0 | 111.4 | R253 K254 A255 L260 R261 Q271 E272 M275 | R253-L257 WeakPolarHBondContact O-CG 3.47Å; R253-L257 PolarHBondContact O-N 2.67Å; K254-L257 CarbonylContact O-C 3.54Å; K254-L257 WeakPolarHBondContact O-CA 3.45Å; K254-L257 WeakPolarHBondContact O-CB 3.42Å; K254-L257 PolarHBondContact O-N 2.92Å; A255-L257 PolarHBondContact O-N 3.16Å; L257-L260 PolarHBondContact O-N 3.3Å; L257-R261 WeakPolarHBondContact O-CB 3.48Å; L257-R261 VanDerWaalsContact O-CG 3.24Å; L257-R261 WeakPolarHBondContact O-CG 3.44Å; L257-R261 PolarHBondContact O-N 3.39Å; L257-Q271 HydrophobicContact CD2-CB 3.95Å; L257-E272 HydrophobicContact CD1-CG 3.88Å; L257-E272 HydrophobicContact CD2-CG 3.86Å; L257-E272 HydrophobicContact CG-CG 4.48Å; L257-M275 HydrophobicContact CD1-CE 4.01Å; L257-M275 HydrophobicContact CD1-SD 4.24Å; L257-M275 HydrophobicContact CD2-CE 3.94Å; L257-M275 HydrophobicContact CG-CE 3.91Å |
| 258 | E | 93.8 | Very high | 93.4 | Very high | 98 Ų | 98 | 78.3 Ų | 78.3 | 46% | 0.458 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -66.4 | -51.4 | 174.4 | -72.2 | 154.9 | -172.2 | 0 | 0 | 110.3 | K254 A255 L260 R261 E262 | K254-E258 WeakPolarHBondContact O-CG 3.44Å; K254-E258 PolarHBondContact O-N 3.23Å; A255-E258 PolarHBondContact O-N 3.29Å; E258-L260 PolarHBondContact O-N 2.99Å; E258-L260 VanDerWaalsContact O-N 3.12Å; E258-R261 PolarHBondContact O-N 3.31Å; E258-E262 WeakPolarHBondContact O-CG 3.49Å; E258-E262 PolarHBondContact O-N 2.91Å |
| 259 | E | 93.9 | Very high | 93.3 | Very high | 96 Ų | 96 | 81.9 Ų | 81.9 | 45% | 0.449 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -54.6 | -30.5 | 171 | -73.1 | 170.2 | -145.2 | 0 | 0 | 113.5 | A255 K263 | A255-E259 WeakPolarHBondContact O-CB 3.27Å; A255-E259 VanDerWaalsContact O-CG 3.29Å; A255-E259 WeakPolarHBondContact O-CG 3.46Å; A255-E259 PolarHBondContact O-N 3.47Å; E259-K263 VanDerWaalsContact O-CD 3.32Å; E259-K263 WeakPolarHBondContact O-CD 3.28Å; E259-K263 WeakPolarHBondContact O-CG 3.38Å |
| 260 | L | 93.3 | Very high | 93.2 | Very high | 50 Ų | 50 | 81 Ų | 81 | 26% | 0.262 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -81.5 | -35.6 | 175.6 | -88.8 | 162.7 | 0 | 0 | 0 | 112.2 | K256 L257 E258 K263 D264 K267 A268 Q271 | K256-L260 VanDerWaalsContact O-CB 3.3Å; K256-L260 WeakPolarHBondContact O-CB 3.47Å; K256-L260 WeakPolarHBondContact O-CD1 3.44Å; K256-L260 WeakPolarHBondContact O-CG 3.43Å; K256-L260 PolarHBondContact O-N 2.95Å; K256-L260 VanDerWaalsContact O-N 3.14Å; L257-L260 PolarHBondContact O-N 3.3Å; E258-L260 PolarHBondContact O-N 2.99Å; E258-L260 VanDerWaalsContact O-N 3.12Å; L260-K263 PolarHBondContact O-N 3.02Å; L260-D264 CarbonylContact O-C 3.53Å; L260-D264 VanDerWaalsContact O-C 3.26Å; L260-D264 WeakPolarHBondContact O-CA 3.23Å; L260-D264 PolarHBondContact O-N 3.43Å; L260-D264 VanDerWaalsContact O-O 3.1Å; L260-K267 HydrophobicContact CD2-CB 4.36Å; L260-A268 HydrophobicContact CB-CB 4.09Å; L260-Q271 HydrophobicContact CD1-CG 4.07Å |
| 261 | R | 93 | Very high | 93.1 | Very high | 131 Ų | 131 | 83.9 Ų | 83.9 | 49% | 0.494 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -67.1 | -40.2 | 175.5 | -76.3 | 169.6 | 176.7 | -161.6 | -3.8 | 111.4 | L257 E258 K263 A268 E272 | L257-R261 WeakPolarHBondContact O-CB 3.48Å; L257-R261 VanDerWaalsContact O-CG 3.24Å; L257-R261 WeakPolarHBondContact O-CG 3.44Å; L257-R261 PolarHBondContact O-N 3.39Å; E258-R261 PolarHBondContact O-N 3.31Å; R261-K263 PolarHBondContact O-N 3.39Å; R261-A268 HydrophobicContact CB-CB 4.32Å; R261-A268 HydrophobicContact CG-CB 3.48Å; R261-A268 VanDerWaalsContact CG-CB 3.48Å; R261-E272 IonicContact CZ-OE1 3.96Å; R261-E272 VanDerWaalsContact CZ-OE1 3.3Å; R261-E272 IonicContact NE-OE1 3.74Å; R261-E272 PolarHBondContact NE-OE1 3.05Å; R261-E272 VanDerWaalsContact NE-OE1 3.12Å; R261-E272 IonicContact NH2-OE1 3.82Å; R261-E272 PolarHBondContact NH2-OE1 3.47Å; R261-E272 IonicContact NH2-OE2 3.78Å |
| 262 | E | 93.2 | Very high | 93 | Very high | 160 Ų | 160 | 82.1 Ų | 82.1 | 75% | 0.748 | 41% | 0.405 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.3 | -27.8 | 175.8 | -72.4 | 170.7 | -174.7 | 0 | 0 | 113.1 | E258 | E258-E262 WeakPolarHBondContact O-CG 3.49Å; E258-E262 PolarHBondContact O-N 2.91Å |
| 263 | K | 93.2 | Very high | 93 | Very high | 149 Ų | 149 | 84.5 Ų | 84.5 | 65% | 0.648 | 41% | 0.407 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.7 | -46.3 | -179.5 | -66.9 | 169.9 | -171.5 | 162 | 0 | 113.1 | E259 L260 R261 | E259-K263 VanDerWaalsContact O-CD 3.32Å; E259-K263 WeakPolarHBondContact O-CD 3.28Å; E259-K263 WeakPolarHBondContact O-CG 3.38Å; L260-K263 PolarHBondContact O-N 3.02Å; R261-K263 PolarHBondContact O-N 3.39Å |
| 264 | D | 92.5 | Very high | 93 | Very high | 66 Ų | 66 | 86.9 Ų | 86.9 | 35% | 0.353 | 42% | 0.419 | S | S | . | . | trans | -156.3 | 91.1 | -168.5 | -73.1 | -83.9 | 0 | 0 | 0 | 111.2 | L260 G266 K267 A268 | L260-D264 CarbonylContact O-C 3.53Å; L260-D264 VanDerWaalsContact O-C 3.26Å; L260-D264 WeakPolarHBondContact O-CA 3.23Å; L260-D264 PolarHBondContact O-N 3.43Å; L260-D264 VanDerWaalsContact O-O 3.1Å; D264-G266 PolarHBondContact O-N 2.68Å; D264-G266 VanDerWaalsContact O-N 3.13Å; D264-K267 HydrophobicContact CB-CB 3.84Å; D264-K267 HydrophobicContact CB-CD 3.7Å; D264-K267 HydrophobicContact CB-CG 3.82Å; D264-K267 PolarHBondContact O-N 3.09Å; D264-K267 VanDerWaalsContact O-N 3.08Å; D264-K267 WeakPolarHBondContact OD1-CE 3.27Å; D264-K267 IonicContact OD1-NZ 3.12Å; D264-K267 PolarHBondContact OD1-NZ 3.22Å; D264-K267 WeakPolarHBondContact OD2-CD 3.49Å; D264-K267 IonicContact OD2-NZ 3.74Å; D264-K267 PolarHBondContact OD2-NZ 3.01Å; D264-A268 PolarHBondContact O-N 2.86Å | ||
| 265 | E | 92 | Very high | 92.9 | Very high | 122 Ų | 122 | 84.5 Ų | 84.5 | 57% | 0.57 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -51.9 | -39.6 | 177.7 | -71 | -164.2 | -171 | 0 | 0 | 114 | A268 K269 | E265-A268 WeakPolarHBondContact O-CB 3.44Å; E265-A268 PolarHBondContact O-N 3.27Å; E265-K269 WeakPolarHBondContact O-CG 3.45Å; E265-K269 PolarHBondContact O-N 2.94Å; E265-K269 IonicContact OE2-NZ 2.74Å; E265-K269 PolarHBondContact OE2-NZ 2.67Å |
| 266 | G | 91.9 | Very high | 92.8 | Very high | 47 Ų | 47 | 88.2 Ų | 88.2 | 49% | 0.485 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -62.8 | -44.3 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | D264 A268 K269 V270 | D264-G266 PolarHBondContact O-N 2.68Å; D264-G266 VanDerWaalsContact O-N 3.13Å; G266-A268 VanDerWaalsContact C-N 3.31Å; G266-A268 PolarHBondContact O-N 2.94Å; G266-K269 PolarHBondContact O-N 3.17Å; G266-V270 WeakPolarHBondContact O-CG2 3.37Å; G266-V270 PolarHBondContact O-N 3.02Å; G266-V270 VanDerWaalsContact O-N 3.12Å |
| 267 | K | 91.5 | Very high | 92.9 | Very high | 118 Ų | 118 | 90.4 Ų | 90.4 | 51% | 0.513 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -67.3 | -34.9 | 176.8 | -62.2 | 177.6 | -166.9 | 143.1 | 0 | 110.8 | L260 D264 Q271 | L260-K267 HydrophobicContact CD2-CB 4.36Å; D264-K267 HydrophobicContact CB-CB 3.84Å; D264-K267 HydrophobicContact CB-CD 3.7Å; D264-K267 HydrophobicContact CB-CG 3.82Å; D264-K267 PolarHBondContact O-N 3.09Å; D264-K267 VanDerWaalsContact O-N 3.08Å; D264-K267 WeakPolarHBondContact OD1-CE 3.27Å; D264-K267 IonicContact OD1-NZ 3.12Å; D264-K267 PolarHBondContact OD1-NZ 3.22Å; D264-K267 WeakPolarHBondContact OD2-CD 3.49Å; D264-K267 IonicContact OD2-NZ 3.74Å; D264-K267 PolarHBondContact OD2-NZ 3.01Å; K267-Q271 VanDerWaalsContact O-CG 3.24Å; K267-Q271 WeakPolarHBondContact O-CG 3.34Å; K267-Q271 PolarHBondContact O-N 2.81Å |
| 268 | A | 92.2 | Very high | 92.9 | Very high | 1 Ų | 1 | 89.6 Ų | 89.6 | 1% | 0.008 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -63.9 | -46.8 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | L260 R261 D264 E265 G266 V270 Q271 E272 | L260-A268 HydrophobicContact CB-CB 4.09Å; R261-A268 HydrophobicContact CB-CB 4.32Å; R261-A268 HydrophobicContact CG-CB 3.48Å; R261-A268 VanDerWaalsContact CG-CB 3.48Å; D264-A268 PolarHBondContact O-N 2.86Å; E265-A268 WeakPolarHBondContact O-CB 3.44Å; E265-A268 PolarHBondContact O-N 3.27Å; G266-A268 VanDerWaalsContact C-N 3.31Å; G266-A268 PolarHBondContact O-N 2.94Å; A268-V270 PolarHBondContact O-N 3.41Å; A268-Q271 PolarHBondContact O-N 3.2Å; A268-Q271 VanDerWaalsContact O-N 3.16Å; A268-E272 WeakPolarHBondContact O-CG 3.46Å; A268-E272 PolarHBondContact O-N 3.38Å |
| 269 | K | 93 | Very high | 92.9 | Very high | 109 Ų | 109 | 86.3 Ų | 86.3 | 47% | 0.474 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -57.9 | -46.8 | 177.2 | -71.4 | 164.3 | -169.9 | 162.6 | 0 | 111.4 | E265 G266 Q271 E272 E273 | E265-K269 WeakPolarHBondContact O-CG 3.45Å; E265-K269 PolarHBondContact O-N 2.94Å; E265-K269 IonicContact OE2-NZ 2.74Å; E265-K269 PolarHBondContact OE2-NZ 2.67Å; G266-K269 PolarHBondContact O-N 3.17Å; K269-Q271 PolarHBondContact O-N 2.8Å; K269-E272 WeakPolarHBondContact O-CB 3.39Å; K269-E272 PolarHBondContact O-N 2.74Å; K269-E273 WeakPolarHBondContact O-CG 3.23Å; K269-E273 PolarHBondContact O-N 3.5Å |
| 270 | V | 93.8 | Very high | 92.9 | Very high | 92 Ų | 92 | 85.5 Ų | 85.5 | 56% | 0.558 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -61.6 | -40.3 | 175.3 | 173.5 | 0 | 0 | 0 | 0 | 112.3 | G266 A268 K274 | G266-V270 WeakPolarHBondContact O-CG2 3.37Å; G266-V270 PolarHBondContact O-N 3.02Å; G266-V270 VanDerWaalsContact O-N 3.12Å; A268-V270 PolarHBondContact O-N 3.41Å; V270-K274 WeakPolarHBondContact O-CB 3.19Å; V270-K274 PolarHBondContact O-N 3.39Å |
| 271 | Q | 90.8 | Very high | 93 | Very high | 71 Ų | 71 | 87.5 Ų | 87.5 | 33% | 0.332 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -66.7 | -41.7 | 175.5 | -71 | -74.1 | -3.2 | 0 | 0 | 111.8 | L257 L260 K267 A268 K269 K274 M275 | L257-Q271 HydrophobicContact CD2-CB 3.95Å; L260-Q271 HydrophobicContact CD1-CG 4.07Å; K267-Q271 VanDerWaalsContact O-CG 3.24Å; K267-Q271 WeakPolarHBondContact O-CG 3.34Å; K267-Q271 PolarHBondContact O-N 2.81Å; A268-Q271 PolarHBondContact O-N 3.2Å; A268-Q271 VanDerWaalsContact O-N 3.16Å; K269-Q271 PolarHBondContact O-N 2.8Å; Q271-K274 WeakPolarHBondContact O-CB 3.46Å; Q271-K274 PolarHBondContact O-N 2.89Å; Q271-M275 VanDerWaalsContact O-CG 3.22Å; Q271-M275 WeakPolarHBondContact O-CG 3.35Å; Q271-M275 PolarHBondContact O-N 2.95Å |
| 272 | E | 92.4 | Very high | 93 | Very high | 34 Ų | 34 | 81.7 Ų | 81.7 | 16% | 0.159 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -60.3 | -44.8 | 174.7 | -76.2 | -178.9 | -146.3 | 0 | 0 | 112.5 | L257 R261 A268 K269 M275 K276 | L257-E272 HydrophobicContact CD1-CG 3.88Å; L257-E272 HydrophobicContact CD2-CG 3.86Å; L257-E272 HydrophobicContact CG-CG 4.48Å; R261-E272 IonicContact CZ-OE1 3.96Å; R261-E272 VanDerWaalsContact CZ-OE1 3.3Å; R261-E272 IonicContact NE-OE1 3.74Å; R261-E272 PolarHBondContact NE-OE1 3.05Å; R261-E272 VanDerWaalsContact NE-OE1 3.12Å; R261-E272 IonicContact NH2-OE1 3.82Å; R261-E272 PolarHBondContact NH2-OE1 3.47Å; R261-E272 IonicContact NH2-OE2 3.78Å; A268-E272 WeakPolarHBondContact O-CG 3.46Å; A268-E272 PolarHBondContact O-N 3.38Å; K269-E272 WeakPolarHBondContact O-CB 3.39Å; K269-E272 PolarHBondContact O-N 2.74Å; E272-M275 CarbonylContact O-C 3.6Å; E272-M275 WeakPolarHBondContact O-CB 3.48Å; E272-M275 PolarHBondContact O-N 3.23Å; E272-M275 VanDerWaalsContact O-N 3.16Å; E272-K276 VanDerWaalsContact O-CG 3.25Å; E272-K276 WeakPolarHBondContact O-CG 3.42Å; E272-K276 PolarHBondContact O-N 2.89Å; E272-K276 IonicContact OE2-NZ 2.61Å; E272-K276 PolarHBondContact OE2-NZ 2.98Å |
| 273 | E | 94.6 | Very high | 93.1 | Very high | 101 Ų | 101 | 79.6 Ų | 79.6 | 47% | 0.472 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -59.8 | -46.3 | 174.2 | -74.2 | 169.8 | -168.1 | 0 | 0 | 111.2 | K269 M275 K276 W277 | K269-E273 WeakPolarHBondContact O-CG 3.23Å; K269-E273 PolarHBondContact O-N 3.5Å; E273-M275 VanDerWaalsContact C-N 3.28Å; E273-M275 PolarHBondContact O-N 2.9Å; E273-K276 WeakPolarHBondContact O-CB 3.42Å; E273-K276 PolarHBondContact O-N 3.5Å; E273-K276 VanDerWaalsContact O-N 3.08Å; E273-W277 PolarHBondContact O-N 3.3Å |
| 274 | K | 93.1 | Very high | 93.1 | Very high | 98 Ų | 98 | 76.7 Ų | 76.7 | 43% | 0.426 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -58.2 | -38.3 | 173.1 | -173.2 | 176.1 | -179.4 | 175.8 | 0 | 112.2 | G233 V270 Q271 T278 | G233-K274 VanDerWaalsContact O-CE 3.25Å; G233-K274 WeakPolarHBondContact O-CE 3.42Å; V270-K274 WeakPolarHBondContact O-CB 3.19Å; V270-K274 PolarHBondContact O-N 3.39Å; Q271-K274 WeakPolarHBondContact O-CB 3.46Å; Q271-K274 PolarHBondContact O-N 2.89Å; K274-T278 WeakPolarHBondContact O-CB 3.34Å; K274-T278 VanDerWaalsContact O-CG2 3.27Å; K274-T278 WeakPolarHBondContact O-CG2 3.43Å; K274-T278 PolarHBondContact O-N 2.86Å; K274-T278 PolarHBondContact O-OG1 3.44Å |
| 275 | M | 92.3 | Very high | 93.1 | Very high | 38 Ų | 38 | 78.2 Ų | 78.2 | 19% | 0.187 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -67.6 | -40.9 | 173.2 | -58.9 | -150.7 | -164.2 | 0 | 0 | 112.3 | L235 R253 L257 Q271 E272 E273 T278 N279 | L235-M275 HydrophobicContact CD2-CB 3.96Å; L235-M275 HydrophobicContact CD2-CG 3.6Å; L235-M275 HydrophobicContact CD2-SD 3.91Å; R253-M275 HydrophobicContact CG-SD 4.43Å; L257-M275 HydrophobicContact CD1-CE 4.01Å; L257-M275 HydrophobicContact CD1-SD 4.24Å; L257-M275 HydrophobicContact CD2-CE 3.94Å; L257-M275 HydrophobicContact CG-CE 3.91Å; Q271-M275 VanDerWaalsContact O-CG 3.22Å; Q271-M275 WeakPolarHBondContact O-CG 3.35Å; Q271-M275 PolarHBondContact O-N 2.95Å; E272-M275 CarbonylContact O-C 3.6Å; E272-M275 WeakPolarHBondContact O-CB 3.48Å; E272-M275 PolarHBondContact O-N 3.23Å; E272-M275 VanDerWaalsContact O-N 3.16Å; E273-M275 VanDerWaalsContact C-N 3.28Å; E273-M275 PolarHBondContact O-N 2.9Å; M275-T278 WeakPolarHBondContact CA-OG1 3.4Å; M275-T278 PolarHBondContact O-OG1 2.98Å; M275-N279 VanDerWaalsContact O-CB 3.23Å; M275-N279 WeakPolarHBondContact O-CB 3.46Å; M275-N279 PolarHBondContact O-N 3.04Å |
| 276 | K | 93.1 | Very high | 93.2 | Very high | 116 Ų | 116 | 75 Ų | 75 | 50% | 0.504 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -62.9 | -51.6 | 177.4 | -69.4 | 160.3 | -168.3 | 164 | 0 | 110.6 | E272 E273 N279 V280 | E272-K276 VanDerWaalsContact O-CG 3.25Å; E272-K276 WeakPolarHBondContact O-CG 3.42Å; E272-K276 PolarHBondContact O-N 2.89Å; E272-K276 IonicContact OE2-NZ 2.61Å; E272-K276 PolarHBondContact OE2-NZ 2.98Å; E273-K276 WeakPolarHBondContact O-CB 3.42Å; E273-K276 PolarHBondContact O-N 3.5Å; E273-K276 VanDerWaalsContact O-N 3.08Å; K276-N279 WeakPolarHBondContact O-CB 3.31Å; K276-N279 PolarHBondContact O-N 3.1Å; K276-V280 WeakPolarHBondContact O-CG2 3.5Å; K276-V280 PolarHBondContact O-N 2.99Å |
| 277 | W | 94.1 | Very high | 93.2 | Very high | 176 Ų | 176 | 75.1 Ų | 75.1 | 67% | 0.667 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -63.9 | -44.5 | 178.9 | -72 | 117.7 | 0 | 0 | 0 | 113.4 | E273 N279 V280 L281 | E273-W277 PolarHBondContact O-N 3.3Å; W277-N279 VanDerWaalsContact C-N 3.3Å; W277-N279 PolarHBondContact O-N 3.31Å; W277-V280 PolarHBondContact O-N 3.27Å; W277-L281 WeakPolarHBondContact O-CG 3.37Å; W277-L281 PolarHBondContact O-N 2.84Å |
| 278 | T | 93.4 | Very high | 93.3 | Very high | 9 Ų | 9 | 77.7 Ų | 77.7 | 6% | 0.055 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -63.4 | -35.5 | 175.7 | 50.7 | 0 | 0 | 0 | 0 | 112.4 | K274 M275 L281 Y282 | K274-T278 WeakPolarHBondContact O-CB 3.34Å; K274-T278 VanDerWaalsContact O-CG2 3.27Å; K274-T278 WeakPolarHBondContact O-CG2 3.43Å; K274-T278 PolarHBondContact O-N 2.86Å; K274-T278 PolarHBondContact O-OG1 3.44Å; M275-T278 WeakPolarHBondContact CA-OG1 3.4Å; M275-T278 PolarHBondContact O-OG1 2.98Å; T278-L281 PolarHBondContact O-N 3.03Å; T278-Y282 WeakPolarHBondContact O-CD2 3.14Å; T278-Y282 PolarHBondContact O-N 3.2Å |
| 279 | N | 93.4 | Very high | 93.3 | Very high | 28 Ų | 28 | 79 Ų | 79 | 15% | 0.15 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -63.2 | -44 | 172.9 | -168.9 | -8.1 | 0 | 0 | 0 | 111.7 | M275 K276 W277 Y282 K283 I289 D291 | M275-N279 VanDerWaalsContact O-CB 3.23Å; M275-N279 WeakPolarHBondContact O-CB 3.46Å; M275-N279 PolarHBondContact O-N 3.04Å; K276-N279 WeakPolarHBondContact O-CB 3.31Å; K276-N279 PolarHBondContact O-N 3.1Å; W277-N279 VanDerWaalsContact C-N 3.3Å; W277-N279 PolarHBondContact O-N 3.31Å; N279-Y282 PolarHBondContact O-N 3.31Å; N279-K283 PolarHBondContact ND2-NZ 2.74Å; N279-K283 WeakPolarHBondContact O-CB 3.45Å; N279-K283 WeakPolarHBondContact O-CG 3.48Å; N279-K283 PolarHBondContact O-N 2.84Å; N279-K283 WeakPolarHBondContact OD1-CD 3.15Å; N279-K283 WeakPolarHBondContact OD1-CE 3.25Å; N279-K283 PolarHBondContact OD1-NZ 2.97Å; N279-K283 VanDerWaalsContact OD1-NZ 3.08Å; N279-I289 HydrophobicContact CB-CD1 4.48Å; N279-I289 VanDerWaalsContact OD1-CD1 3.31Å; N279-I289 WeakPolarHBondContact OD1-CD1 3.2Å; N279-I289 WeakPolarHBondContact OD1-CG2 3.28Å; N279-D291 PolarHBondContact ND2-OD2 3.14Å |
| 280 | V | 94.4 | Very high | 93.4 | Very high | 79 Ų | 79 | 77 Ų | 77 | 48% | 0.479 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -61 | -47.6 | 174.6 | 173.7 | 0 | 0 | 0 | 0 | 111.4 | K276 W277 Y282 K283 A284 | K276-V280 WeakPolarHBondContact O-CG2 3.5Å; K276-V280 PolarHBondContact O-N 2.99Å; W277-V280 PolarHBondContact O-N 3.27Å; V280-Y282 VanDerWaalsContact C-N 3.28Å; V280-Y282 PolarHBondContact O-N 3.33Å; V280-K283 PolarHBondContact O-N 3.44Å; V280-K283 VanDerWaalsContact O-N 3.14Å; V280-A284 WeakPolarHBondContact O-CB 3.39Å; V280-A284 PolarHBondContact O-N 3.09Å |
| 281 | L | 94.4 | Very high | 93.2 | Very high | 93 Ų | 93 | 74.8 Ų | 74.8 | 49% | 0.487 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -59 | -36.6 | 177.9 | -71.9 | 173 | 0 | 0 | 0 | 113.2 | K232 W277 T278 E285 | K232-L281 HydrophobicContact CD-CB 4.37Å; W277-L281 WeakPolarHBondContact O-CG 3.37Å; W277-L281 PolarHBondContact O-N 2.84Å; T278-L281 PolarHBondContact O-N 3.03Å; L281-E285 PolarHBondContact O-N 2.94Å; L281-E285 VanDerWaalsContact O-N 3.16Å |
| 282 | Y | 94.1 | Very high | 93.3 | Very high | 8 Ų | 8 | 76 Ų | 76 | 3% | 0.031 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -77.9 | -33.2 | 176.1 | -79.1 | -50.2 | 0 | 0 | 0 | 113.2 | I231 K232 L235 P237 T278 N279 V280 A284 E285 G286 L287 I289 | I231-Y282 WeakPolarHBondContact CA-OH 3.34Å; K232-Y282 HydrophobicContact CB-CE1 4.07Å; K232-Y282 HydrophobicContact CB-CE2 4.21Å; K232-Y282 HydrophobicContact CD-CD1 4.06Å; K232-Y282 HydrophobicContact CD-CE1 3.85Å; K232-Y282 HydrophobicContact CG-CE1 4.06Å; K232-Y282 PolarHBondContact N-OH 3.25Å; L235-Y282 WeakPolarHBondContact O-CE2 3.36Å; L235-Y282 PolarHBondContact O-OH 3.12Å; P237-Y282 HydrophobicContact CB-CD1 4.38Å; P237-Y282 HydrophobicContact CB-CD2 3.96Å; P237-Y282 HydrophobicContact CB-CE1 4.34Å; P237-Y282 HydrophobicContact CB-CE2 3.94Å; P237-Y282 HydrophobicContact CB-CG 4.17Å; P237-Y282 HydrophobicContact CG-CE1 4.19Å; P237-Y282 HydrophobicContact CG-CE2 4.31Å; T278-Y282 WeakPolarHBondContact O-CD2 3.14Å; T278-Y282 PolarHBondContact O-N 3.2Å; N279-Y282 PolarHBondContact O-N 3.31Å; V280-Y282 VanDerWaalsContact C-N 3.28Å; V280-Y282 PolarHBondContact O-N 3.33Å; Y282-A284 VanDerWaalsContact C-N 3.34Å; Y282-E285 WeakPolarHBondContact CD1-OE2 3.18Å; Y282-E285 WeakPolarHBondContact O-CB 3.38Å; Y282-E285 PolarHBondContact O-N 2.98Å; Y282-G286 PolarHBondContact O-N 3Å; Y282-L287 HydrophobicContact CD1-CD1 3.52Å; Y282-L287 HydrophobicContact CE1-CD1 4.07Å; Y282-L287 HydrophobicContact CG-CD1 4.16Å; Y282-L287 VanDerWaalsContact O-CB 3.31Å; Y282-L287 WeakPolarHBondContact O-CB 3.3Å; Y282-L287 PolarHBondContact O-N 3.03Å; Y282-I289 HydrophobicContact CD2-CD1 4.11Å; Y282-I289 HydrophobicContact CG-CD1 4.14Å |
| 283 | K | 94.1 | Very high | 93.4 | Very high | 116 Ų | 116 | 75.9 Ų | 75.9 | 50% | 0.504 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -64.7 | -39.3 | 171.2 | -78.2 | 165.7 | 172.2 | 158.7 | 0 | 111.1 | N279 V280 G286 | N279-K283 PolarHBondContact ND2-NZ 2.74Å; N279-K283 WeakPolarHBondContact O-CB 3.45Å; N279-K283 WeakPolarHBondContact O-CG 3.48Å; N279-K283 PolarHBondContact O-N 2.84Å; N279-K283 WeakPolarHBondContact OD1-CD 3.15Å; N279-K283 WeakPolarHBondContact OD1-CE 3.25Å; N279-K283 PolarHBondContact OD1-NZ 2.97Å; N279-K283 VanDerWaalsContact OD1-NZ 3.08Å; V280-K283 PolarHBondContact O-N 3.44Å; V280-K283 VanDerWaalsContact O-N 3.14Å; K283-G286 WeakPolarHBondContact O-CA 3.38Å; K283-G286 PolarHBondContact O-N 3.02Å |
| 284 | A | 95.1 | Very high | 93.4 | Very high | 88 Ų | 88 | 77.1 Ų | 77.1 | 73% | 0.727 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -64.5 | -35.9 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | V280 Y282 G286 | V280-A284 WeakPolarHBondContact O-CB 3.39Å; V280-A284 PolarHBondContact O-N 3.09Å; Y282-A284 VanDerWaalsContact C-N 3.34Å; A284-G286 PolarHBondContact O-N 2.88Å; A284-G286 VanDerWaalsContact O-N 3.14Å |
| 285 | E | 91.9 | Very high | 93.5 | Very high | 98 Ų | 98 | 77.2 Ų | 77.2 | 46% | 0.458 | 40% | 0.398 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.2 | -3.8 | 168.8 | -165 | -176 | 151.7 | 0 | 0 | 113.2 | K232 L281 Y282 | K232-E285 WeakPolarHBondContact CE-OE2 3.41Å; K232-E285 IonicContact NZ-OE2 2.63Å; K232-E285 PolarHBondContact NZ-OE2 3.18Å; L281-E285 PolarHBondContact O-N 2.94Å; L281-E285 VanDerWaalsContact O-N 3.16Å; Y282-E285 WeakPolarHBondContact CD1-OE2 3.18Å; Y282-E285 WeakPolarHBondContact O-CB 3.38Å; Y282-E285 PolarHBondContact O-N 2.98Å |
| 286 | G | 93 | Very high | 93.7 | Very high | 54 Ų | 54 | 75.6 Ų | 75.6 | 56% | 0.557 | 39% | 0.391 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 83.4 | 7.4 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | Y282 K283 A284 K288 | Y282-G286 PolarHBondContact O-N 3Å; K283-G286 WeakPolarHBondContact O-CA 3.38Å; K283-G286 PolarHBondContact O-N 3.02Å; A284-G286 PolarHBondContact O-N 2.88Å; A284-G286 VanDerWaalsContact O-N 3.14Å; G286-K288 PolarHBondContact O-N 3.18Å |
| 287 | L | 92.3 | Very high | 93.8 | Very high | 50 Ų | 50 | 75.4 Ų | 75.4 | 26% | 0.262 | 39% | 0.387 | S | S | . | . | trans | -74.1 | 120.8 | 177.6 | -60.7 | -174 | 0 | 0 | 0 | 111.2 | P237 V239 Y282 I289 | P237-L287 HydrophobicContact CB-CD1 4.09Å; P237-L287 HydrophobicContact CG-CD1 4.1Å; V239-L287 HydrophobicContact CG2-CB 4.01Å; V239-L287 HydrophobicContact CG2-CD1 4.47Å; Y282-L287 HydrophobicContact CD1-CD1 3.52Å; Y282-L287 HydrophobicContact CE1-CD1 4.07Å; Y282-L287 HydrophobicContact CG-CD1 4.16Å; Y282-L287 VanDerWaalsContact O-CB 3.31Å; Y282-L287 WeakPolarHBondContact O-CB 3.3Å; Y282-L287 PolarHBondContact O-N 3.03Å; L287-I289 VanDerWaalsContact C-N 3.31Å; L287-I289 PolarHBondContact O-N 3.41Å | ||
| 288 | K | 93.1 | Very high | 94 | Very high | 173 Ų | 173 | 68.5 Ų | 68.5 | 75% | 0.752 | 37% | 0.367 | S | S | * | . | trans | -77.2 | 79.7 | 177.2 | -62 | -174.1 | -178.9 | -174.7 | 0 | 111.1 | G286 | G286-K288 PolarHBondContact O-N 3.18Š| ||
| 289 | I | 93.8 | Very high | 94.1 | Very high | 28 Ų | 28 | 69.2 Ų | 69.2 | 14% | 0.144 | 37% | 0.372 | C | S | . | . | trans | -65.6 | 144.9 | 174.5 | -70.6 | -179.5 | 0 | 0 | 0 | 111 | L238 V239 N279 Y282 L287 D291 | L238-I289 HydrophobicContact CB-CG2 4.38Å; V239-I289 HydrophobicContact CG2-CG1 4.31Å; N279-I289 HydrophobicContact CB-CD1 4.48Å; N279-I289 VanDerWaalsContact OD1-CD1 3.31Å; N279-I289 WeakPolarHBondContact OD1-CD1 3.2Å; N279-I289 WeakPolarHBondContact OD1-CG2 3.28Å; Y282-I289 HydrophobicContact CD2-CD1 4.11Å; Y282-I289 HydrophobicContact CG-CD1 4.14Å; L287-I289 VanDerWaalsContact C-N 3.31Å; L287-I289 PolarHBondContact O-N 3.41Å; I289-D291 WeakPolarHBondContact CG2-OD1 3.22Å; I289-D291 WeakPolarHBondContact CG2-OD2 3.46Å | ||
| 290 | K | 93.7 | Very high | 94.2 | Very high | 67 Ų | 67 | 69 Ų | 69 | 29% | 0.291 | 37% | 0.371 | S | S | . | . | trans | -138.8 | 84.1 | -176.4 | -63.8 | 176.2 | -173.5 | 175.6 | 0 | 110.1 | L238 G240 L246 L296 | L238-K290 PolarHBondContact O-N 3.42Å; G240-K290 PolarHBondContact O-NZ 2.84Å; L246-K290 HydrophobicContact CD2-CB 3.92Å; L246-K290 HydrophobicContact CD2-CD 4.3Å; K290-L296 HydrophobicContact CB-CD2 4.29Å | ||
| 291 | D | 90.4 | Very high | 94.3 | Very high | 46 Ų | 46 | 72.6 Ų | 72.6 | 25% | 0.246 | 38% | 0.38 | C | S | . | . | trans | -94.9 | -14 | -177.5 | -54.6 | -36.3 | 0 | 0 | 0 | 112.6 | L238 V250 N279 I289 E293 | L238-D291 WeakPolarHBondContact CB-OD1 3.32Å; L238-D291 WeakPolarHBondContact CD2-OD1 3.39Å; V250-D291 WeakPolarHBondContact CG1-O 3.35Å; V250-D291 WeakPolarHBondContact CG2-O 3.29Å; N279-D291 PolarHBondContact ND2-OD2 3.14Å; I289-D291 WeakPolarHBondContact CG2-OD1 3.22Å; I289-D291 WeakPolarHBondContact CG2-OD2 3.46Å; D291-E293 PolarHBondContact O-N 3.12Å | ||
| 292 | D | 93.4 | Very high | 94.5 | Very high | 97 Ų | 97 | 76.1 Ų | 76.1 | 52% | 0.519 | 39% | 0.387 | S | S | . | . | trans | -74.9 | 105.6 | -173.6 | -48.9 | -59.2 | 0 | 0 | 0 | 112.9 | N294 L295 L296 | D292-N294 VanDerWaalsContact C-N 3.29Å; D292-N294 PolarHBondContact O-N 2.89Å; D292-L295 HydrophobicContact CB-CB 3.98Å; D292-L295 HydrophobicContact CB-CD1 3.94Å; D292-L295 HydrophobicContact CB-CG 3.89Å; D292-L295 PolarHBondContact O-N 3.26Å; D292-L295 VanDerWaalsContact O-N 3.12Å; D292-L296 WeakPolarHBondContact O-CG 3.42Å; D292-L296 PolarHBondContact O-N 3.21Å | ||
| 293 | E | 93.6 | Very high | 94.6 | Very high | 30 Ų | 30 | 79.6 Ų | 79.6 | 14% | 0.14 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -54.3 | -43.4 | 178.6 | -64.1 | 176.4 | 166.2 | 0 | 0 | 113 | L247 V250 K254 D291 L295 L296 R297 | L247-E293 HydrophobicContact CD1-CB 4.04Å; L247-E293 HydrophobicContact CD1-CG 4.12Å; V250-E293 HydrophobicContact CB-CG 4.08Å; V250-E293 HydrophobicContact CG1-CG 3.53Å; V250-E293 WeakPolarHBondContact CG1-OE1 3.13Å; K254-E293 WeakPolarHBondContact CD-OE1 3.32Å; K254-E293 VanDerWaalsContact CE-CD 3.48Å; K254-E293 WeakPolarHBondContact CE-OE1 3.38Å; K254-E293 IonicContact NZ-OE1 2.62Å; K254-E293 PolarHBondContact NZ-OE1 2.96Å; K254-E293 IonicContact NZ-OE2 3.57Å; K254-E293 PolarHBondContact NZ-OE2 2.96Å; D291-E293 PolarHBondContact O-N 3.12Å; E293-L295 VanDerWaalsContact C-N 3.33Å; E293-L295 PolarHBondContact O-N 3.33Å; E293-L296 PolarHBondContact O-N 3.02Å; E293-R297 WeakPolarHBondContact O-CB 3.26Å; E293-R297 VanDerWaalsContact O-CG 3.3Å; E293-R297 WeakPolarHBondContact O-CG 3.3Å; E293-R297 PolarHBondContact O-N 2.91Å |
| 294 | N | 95.1 | Very high | 94.7 | Very high | 127 Ų | 127 | 78 Ų | 78 | 68% | 0.679 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -62.4 | -40.8 | -179.7 | -72.5 | -28.5 | 0 | 0 | 0 | 111.6 | D292 A298 | D292-N294 VanDerWaalsContact C-N 3.29Å; D292-N294 PolarHBondContact O-N 2.89Å; N294-A298 VanDerWaalsContact O-CB 3.23Å; N294-A298 WeakPolarHBondContact O-CB 3.3Å; N294-A298 PolarHBondContact O-N 2.61Å |
| 295 | L | 95.6 | Very high | 94.9 | Very high | 101 Ų | 101 | 80.3 Ų | 80.3 | 53% | 0.529 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -73.5 | -33.3 | 175.7 | -59.8 | -176.6 | 0 | 0 | 0 | 112.2 | D292 E293 S299 | D292-L295 HydrophobicContact CB-CB 3.98Å; D292-L295 HydrophobicContact CB-CD1 3.94Å; D292-L295 HydrophobicContact CB-CG 3.89Å; D292-L295 PolarHBondContact O-N 3.26Å; D292-L295 VanDerWaalsContact O-N 3.12Å; E293-L295 VanDerWaalsContact C-N 3.33Å; E293-L295 PolarHBondContact O-N 3.33Å; L295-S299 WeakPolarHBondContact O-CB 3.42Å; L295-S299 PolarHBondContact O-N 3.14Å; L295-S299 PolarHBondContact O-OG 2.84Å |
| 296 | L | 95.6 | Very high | 95.1 | Very high | 4 Ų | 4 | 81.1 Ų | 81.1 | 2% | 0.021 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -66.4 | -47.6 | 173.8 | -70.7 | 171.9 | 0 | 0 | 0 | 111.4 | Y243 L246 L247 V250 K290 D292 E293 S299 L300 | Y243-L296 HydrophobicContact CD1-CD2 3.89Å; L246-L296 HydrophobicContact CB-CD1 4Å; L246-L296 HydrophobicContact CB-CD2 3.8Å; L246-L296 HydrophobicContact CD2-CD2 3.96Å; L247-L296 HydrophobicContact CB-CB 4.5Å; L247-L296 HydrophobicContact CD1-CB 4.37Å; V250-L296 HydrophobicContact CG2-CD1 3.84Å; K290-L296 HydrophobicContact CB-CD2 4.29Å; D292-L296 WeakPolarHBondContact O-CG 3.42Å; D292-L296 PolarHBondContact O-N 3.21Å; E293-L296 PolarHBondContact O-N 3.02Å; L296-S299 PolarHBondContact O-N 3.28Å; L296-L300 PolarHBondContact O-N 3.08Å |
| 297 | R | 96.1 | Very high | 95.4 | Very high | 112 Ų | 112 | 86.9 Ų | 86.9 | 42% | 0.423 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -61.1 | -45.5 | 174.3 | -71.8 | 174.4 | 177.5 | -174.9 | 0.4 | 111.1 | L247 E251 E293 S299 L300 K301 | L247-R297 HydrophobicContact CD1-CG 3.94Å; L247-R297 HydrophobicContact CD2-CG 3.7Å; E251-R297 IonicContact OE1-CZ 2.81Å; E251-R297 IonicContact OE1-NE 3.75Å; E251-R297 IonicContact OE1-NH2 3.42Å; E251-R297 PolarHBondContact OE1-NH2 2.92Å; E293-R297 WeakPolarHBondContact O-CB 3.26Å; E293-R297 VanDerWaalsContact O-CG 3.3Å; E293-R297 WeakPolarHBondContact O-CG 3.3Å; E293-R297 PolarHBondContact O-N 2.91Å; R297-S299 VanDerWaalsContact C-N 3.32Å; R297-S299 PolarHBondContact O-N 3.24Å; R297-L300 WeakPolarHBondContact O-CB 3.48Å; R297-L300 PolarHBondContact O-N 2.86Å; R297-K301 WeakPolarHBondContact O-CG 3.17Å; R297-K301 PolarHBondContact O-N 2.68Å |
| 298 | A | 96.9 | Very high | 95.6 | Very high | 31 Ų | 31 | 87.2 Ų | 87.2 | 26% | 0.256 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -61.7 | -39.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | N294 K301 R302 | N294-A298 VanDerWaalsContact O-CB 3.23Å; N294-A298 WeakPolarHBondContact O-CB 3.3Å; N294-A298 PolarHBondContact O-N 2.61Å; A298-K301 PolarHBondContact O-N 3.43Å; A298-R302 WeakPolarHBondContact O-CB 3.37Å; A298-R302 VanDerWaalsContact O-CG 3.27Å; A298-R302 WeakPolarHBondContact O-CG 3.19Å; A298-R302 PolarHBondContact O-N 3.46Å |
| 299 | S | 95.5 | Very high | 95.9 | Very high | 23 Ų | 23 | 82.6 Ų | 82.6 | 16% | 0.161 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -70 | -29.9 | 177.7 | -64.2 | 0 | 0 | 0 | 0 | 113.2 | Y243 L295 L296 R297 K303 | Y243-S299 VanDerWaalsContact CE2-CB 3.49Å; L295-S299 WeakPolarHBondContact O-CB 3.42Å; L295-S299 PolarHBondContact O-N 3.14Å; L295-S299 PolarHBondContact O-OG 2.84Å; L296-S299 PolarHBondContact O-N 3.28Å; R297-S299 VanDerWaalsContact C-N 3.32Å; R297-S299 PolarHBondContact O-N 3.24Å; S299-K303 PolarHBondContact O-N 3.25Å; S299-K303 VanDerWaalsContact O-N 3.12Å |
| 300 | L | 96.3 | Very high | 96.1 | Very high | 25 Ų | 25 | 90.1 Ų | 90.1 | 13% | 0.131 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -66 | -54.3 | 167.7 | -75.7 | 171.3 | 0 | 0 | 0 | 111.3 | K244 L247 L296 R297 R302 K303 E304 | K244-L300 HydrophobicContact CB-CD2 4.49Å; K244-L300 HydrophobicContact CD-CD2 4.48Å; K244-L300 HydrophobicContact CG-CD1 4.1Å; K244-L300 HydrophobicContact CG-CD2 3.46Å; K244-L300 VanDerWaalsContact CG-CD2 3.46Å; K244-L300 HydrophobicContact CG-CG 4.45Å; L247-L300 HydrophobicContact CD2-CD1 4.07Å; L296-L300 PolarHBondContact O-N 3.08Å; R297-L300 WeakPolarHBondContact O-CB 3.48Å; R297-L300 PolarHBondContact O-N 2.86Å; L300-R302 VanDerWaalsContact C-N 3.26Å; L300-R302 PolarHBondContact O-N 3.17Å; L300-K303 WeakPolarHBondContact O-CA 3.43Å; L300-K303 WeakPolarHBondContact O-CB 3.44Å; L300-K303 PolarHBondContact O-N 2.87Å; L300-E304 PolarHBondContact O-N 3.44Å |
| 301 | K | 96.9 | Very high | 96.3 | Very high | 154 Ų | 154 | 94.4 Ų | 94.4 | 67% | 0.67 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -53.6 | -42.5 | 177.1 | -70.1 | 179.7 | 178.5 | -177.2 | 0 | 111.7 | R297 A298 E304 K305 | R297-K301 WeakPolarHBondContact O-CG 3.17Å; R297-K301 PolarHBondContact O-N 2.68Å; A298-K301 PolarHBondContact O-N 3.43Å; K301-E304 PolarHBondContact O-N 3.11Å; K301-K305 WeakPolarHBondContact O-CB 3.4Å; K301-K305 PolarHBondContact O-N 3.38Å |
| 302 | R | 97.3 | Very high | 96.7 | Very high | 166 Ų | 166 | 98.6 Ų | 98.6 | 63% | 0.626 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -61.2 | -45.5 | 173.5 | -72.8 | 170.4 | -174 | 163.5 | 1.1 | 112.5 | A298 L300 E304 K305 M306 | A298-R302 WeakPolarHBondContact O-CB 3.37Å; A298-R302 VanDerWaalsContact O-CG 3.27Å; A298-R302 WeakPolarHBondContact O-CG 3.19Å; A298-R302 PolarHBondContact O-N 3.46Å; L300-R302 VanDerWaalsContact C-N 3.26Å; L300-R302 PolarHBondContact O-N 3.17Å; R302-E304 PolarHBondContact O-N 3.06Å; R302-K305 PolarHBondContact O-N 3.15Å; R302-M306 WeakPolarHBondContact O-CG 3.45Å; R302-M306 PolarHBondContact O-N 3.13Å |
| 303 | K | 96.8 | Very high | 97 | Very high | 81 Ų | 81 | 99.1 Ų | 99.1 | 35% | 0.352 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -62.9 | -40.2 | 176.3 | -86.8 | -172.9 | 170.5 | 179.2 | 0 | 112.5 | K241 Y243 S299 L300 M306 R307 | K241-K303 PolarHBondContact O-NZ 3.07Å; Y243-K303 HydrophobicContact CD2-CD 3.75Å; Y243-K303 HydrophobicContact CD2-CG 4.43Å; Y243-K303 HydrophobicContact CE2-CD 3.78Å; Y243-K303 VanDerWaalsContact CE2-CE 3.44Å; Y243-K303 HydrophobicContact CE2-CG 4.25Å; S299-K303 PolarHBondContact O-N 3.25Å; S299-K303 VanDerWaalsContact O-N 3.12Å; L300-K303 WeakPolarHBondContact O-CA 3.43Å; L300-K303 WeakPolarHBondContact O-CB 3.44Å; L300-K303 PolarHBondContact O-N 2.87Å; K303-M306 PolarHBondContact O-N 3.05Å; K303-R307 WeakPolarHBondContact O-CG 3.34Å; K303-R307 PolarHBondContact O-N 3.01Å |
| 304 | E | 96.9 | Very high | 97.2 | Very high | 84 Ų | 84 | 106.2 Ų | 106.2 | 39% | 0.393 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -70.3 | -41.4 | 180 | -73 | 166.3 | 174.9 | 0 | 0 | 111.1 | K244 L300 K301 R302 M306 R307 S308 | K244-E304 IonicContact NZ-OE1 2.91Å; L300-E304 PolarHBondContact O-N 3.44Å; K301-E304 PolarHBondContact O-N 3.11Å; R302-E304 PolarHBondContact O-N 3.06Å; E304-M306 VanDerWaalsContact C-N 3.34Å; E304-M306 PolarHBondContact O-N 2.9Å; E304-R307 PolarHBondContact O-N 3.01Å; E304-R307 VanDerWaalsContact O-N 3.14Å; E304-S308 PolarHBondContact O-N 2.86Å; E304-S308 PolarHBondContact O-OG 3.21Å |
| 305 | K | 98.1 | Very high | 97.4 | Very high | 135 Ų | 135 | 102.4 Ų | 102.4 | 59% | 0.587 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -57.1 | -42.9 | 169.3 | -173.5 | 172.8 | -177.7 | 173.4 | 0 | 112.5 | K301 R302 S308 Q309 | K301-K305 WeakPolarHBondContact O-CB 3.4Å; K301-K305 PolarHBondContact O-N 3.38Å; R302-K305 PolarHBondContact O-N 3.15Å; K305-S308 PolarHBondContact O-N 3.14Å; K305-S308 PolarHBondContact O-OG 2.9Å; K305-S308 VanDerWaalsContact O-OG 3.05Å; K305-Q309 WeakPolarHBondContact O-CB 3.26Å; K305-Q309 VanDerWaalsContact O-CG 3.31Å; K305-Q309 WeakPolarHBondContact O-CG 3.49Å; K305-Q309 PolarHBondContact O-N 2.94Å |
| 306 | M | 97.8 | Very high | 97.5 | Very high | 115 Ų | 115 | 102.2 Ų | 102.2 | 57% | 0.567 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -68 | -33.8 | 176.2 | -69.9 | -58.3 | -66.3 | 0 | 0 | 112.9 | R302 K303 E304 R310 | R302-M306 WeakPolarHBondContact O-CG 3.45Å; R302-M306 PolarHBondContact O-N 3.13Å; K303-M306 PolarHBondContact O-N 3.05Å; E304-M306 VanDerWaalsContact C-N 3.34Å; E304-M306 PolarHBondContact O-N 2.9Å; M306-R310 WeakPolarHBondContact O-CB 3.47Å; M306-R310 PolarHBondContact O-N 3.47Å; M306-R310 VanDerWaalsContact O-N 3.12Å |
| 307 | R | 97.7 | Very high | 97.6 | Very high | 176 Ų | 176 | 108.9 Ų | 108.9 | 66% | 0.664 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -69.5 | -44.4 | 173.8 | -76.1 | 174.5 | 172.1 | -171.2 | -5.1 | 111.7 | K303 E304 R310 K311 | K303-R307 WeakPolarHBondContact O-CG 3.34Å; K303-R307 PolarHBondContact O-N 3.01Å; E304-R307 PolarHBondContact O-N 3.01Å; E304-R307 VanDerWaalsContact O-N 3.14Å; R307-R310 PolarHBondContact O-N 2.63Å; R307-K311 PolarHBondContact O-N 3.43Å |
| 308 | S | 98.1 | Very high | 97.7 | Very high | 56 Ų | 56 | 106.2 Ų | 106.2 | 39% | 0.392 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -66.5 | -41.6 | 178.9 | 68.3 | 0 | 0 | 0 | 0 | 111.7 | E304 K305 R310 K311 K312 | E304-S308 PolarHBondContact O-N 2.86Å; E304-S308 PolarHBondContact O-OG 3.21Å; K305-S308 PolarHBondContact O-N 3.14Å; K305-S308 PolarHBondContact O-OG 2.9Å; K305-S308 VanDerWaalsContact O-OG 3.05Å; S308-R310 VanDerWaalsContact C-N 3.32Å; S308-R310 PolarHBondContact O-N 3.27Å; S308-K311 PolarHBondContact O-N 2.82Å; S308-K312 WeakPolarHBondContact O-CG 3.49Å; S308-K312 PolarHBondContact O-N 3.43Å |
| 309 | Q | 98.3 | Very high | 97.8 | Very high | 77 Ų | 77 | 110.2 Ų | 110.2 | 36% | 0.36 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -59.3 | -39.8 | 170.8 | -75.4 | -177.6 | 0.5 | 0 | 0 | 112.7 | K305 K313 | K305-Q309 WeakPolarHBondContact O-CB 3.26Å; K305-Q309 VanDerWaalsContact O-CG 3.31Å; K305-Q309 WeakPolarHBondContact O-CG 3.49Å; K305-Q309 PolarHBondContact O-N 2.94Å; Q309-K313 WeakPolarHBondContact O-CB 3.43Å; Q309-K313 WeakPolarHBondContact O-CG 3.39Å; Q309-K313 PolarHBondContact O-N 2.83Å |
| 310 | R | 98.5 | Very high | 98 | Very high | 185 Ų | 185 | 111.8 Ų | 111.8 | 70% | 0.698 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -66.6 | -39.4 | 175.4 | -172.7 | -177.8 | -63.4 | 173.3 | -1.9 | 111.8 | M306 R307 S308 W314 | M306-R310 WeakPolarHBondContact O-CB 3.47Å; M306-R310 PolarHBondContact O-N 3.47Å; M306-R310 VanDerWaalsContact O-N 3.12Å; R307-R310 PolarHBondContact O-N 2.63Å; S308-R310 VanDerWaalsContact C-N 3.32Å; S308-R310 PolarHBondContact O-N 3.27Å; R310-W314 WeakPolarHBondContact O-CB 3.48Å; R310-W314 PolarHBondContact O-N 2.8Å; R310-W314 VanDerWaalsContact O-N 3.13Å |
| 311 | K | 98.4 | Very high | 98.1 | Very high | 157 Ų | 157 | 115.4 Ų | 115.4 | 68% | 0.683 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.8 | -52.5 | 175 | -172.3 | 179.3 | 178.1 | -176.7 | 0 | 110.4 | R307 S308 K313 W314 T315 | R307-K311 PolarHBondContact O-N 3.43Å; S308-K311 PolarHBondContact O-N 2.82Å; K311-K313 PolarHBondContact O-N 3.18Å; K311-W314 WeakPolarHBondContact O-CA 3.16Å; K311-W314 WeakPolarHBondContact O-CB 3.33Å; K311-W314 PolarHBondContact O-N 2.93Å; K311-T315 HydrophobicContact CG-CG2 4.44Å; K311-T315 PolarHBondContact O-N 3.15Å |
| 312 | K | 98.5 | Very high | 98.1 | Very high | 134 Ų | 134 | 111.3 Ų | 111.3 | 58% | 0.583 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -54.2 | -51.9 | 176.4 | -70.4 | -171.9 | 175.5 | -162.7 | 0 | 112.2 | S308 W314 T315 E316 | S308-K312 WeakPolarHBondContact O-CG 3.49Å; S308-K312 PolarHBondContact O-N 3.43Å; K312-W314 PolarHBondContact O-N 2.91Å; K312-T315 PolarHBondContact O-N 2.68Å; K312-T315 VanDerWaalsContact O-N 3.11Å; K312-T315 PolarHBondContact O-OG1 3.12Å; K312-E316 WeakPolarHBondContact O-CB 3.45Å; K312-E316 WeakPolarHBondContact O-CG 3.23Å; K312-E316 PolarHBondContact O-N 3.07Å |
| 313 | K | 98.5 | Very high | 98.2 | Very high | 109 Ų | 109 | 107 Ų | 107 | 47% | 0.474 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.6 | -12.9 | 175.5 | -70.9 | 177.7 | 179.6 | -179.1 | 0 | 114.8 | Q309 K311 R317 | Q309-K313 WeakPolarHBondContact O-CB 3.43Å; Q309-K313 WeakPolarHBondContact O-CG 3.39Å; Q309-K313 PolarHBondContact O-N 2.83Å; K311-K313 PolarHBondContact O-N 3.18Å; K313-R317 WeakPolarHBondContact O-CD 3.27Å; K313-R317 VanDerWaalsContact O-CG 3.26Å; K313-R317 WeakPolarHBondContact O-CG 3.24Å; K313-R317 PolarHBondContact O-NE 2.93Å; K313-R317 PolarHBondContact O-NH1 3.2Å |
| 314 | W | 98.4 | Very high | 98.3 | Very high | 179 Ų | 179 | 109 Ų | 109 | 68% | 0.678 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -92.8 | -44.5 | 172.5 | -168.1 | -91.8 | 0 | 0 | 0 | 111 | R310 K311 K312 R317 S318 | R310-W314 WeakPolarHBondContact O-CB 3.48Å; R310-W314 PolarHBondContact O-N 2.8Å; R310-W314 VanDerWaalsContact O-N 3.13Å; K311-W314 WeakPolarHBondContact O-CA 3.16Å; K311-W314 WeakPolarHBondContact O-CB 3.33Å; K311-W314 PolarHBondContact O-N 2.93Å; K312-W314 PolarHBondContact O-N 2.91Å; W314-R317 WeakPolarHBondContact O-CB 3.28Å; W314-R317 PolarHBondContact O-N 3.48Å; W314-R317 VanDerWaalsContact O-N 3.14Å; W314-S318 PolarHBondContact O-N 2.79Å; W314-S318 PolarHBondContact O-OG 3.03Å |
| 315 | T | 98.5 | Very high | 98.3 | Very high | 47 Ų | 47 | 110.6 Ų | 110.6 | 29% | 0.288 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.5 | -47.2 | 176.1 | 61.6 | 0 | 0 | 0 | 0 | 111.1 | K311 K312 R317 S318 E319 | K311-T315 HydrophobicContact CG-CG2 4.44Å; K311-T315 PolarHBondContact O-N 3.15Å; K312-T315 PolarHBondContact O-N 2.68Å; K312-T315 VanDerWaalsContact O-N 3.11Å; K312-T315 PolarHBondContact O-OG1 3.12Å; T315-R317 PolarHBondContact O-N 2.82Å; T315-R317 VanDerWaalsContact O-N 3.15Å; T315-S318 WeakPolarHBondContact CA-OG 3.33Å; T315-S318 PolarHBondContact O-N 3.18Å; T315-S318 PolarHBondContact O-OG 2.99Å; T315-E319 VanDerWaalsContact C-CD 3.5Å; T315-E319 VanDerWaalsContact CB-OE1 3.27Å; T315-E319 WeakPolarHBondContact CB-OE1 3.34Å; T315-E319 WeakPolarHBondContact O-CB 3.17Å; T315-E319 VanDerWaalsContact O-CD 3.25Å; T315-E319 VanDerWaalsContact O-CG 3.24Å; T315-E319 WeakPolarHBondContact O-CG 3.42Å; T315-E319 PolarHBondContact O-N 3.4Å |
| 316 | E | 98.5 | Very high | 98.3 | Very high | 96 Ų | 96 | 109 Ų | 109 | 45% | 0.449 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -51.6 | -39 | 172.8 | -71.8 | 158.9 | -154 | 0 | 0 | 112.3 | K312 T320 | K312-E316 WeakPolarHBondContact O-CB 3.45Å; K312-E316 WeakPolarHBondContact O-CG 3.23Å; K312-E316 PolarHBondContact O-N 3.07Å; E316-T320 VanDerWaalsContact O-CB 3.24Å; E316-T320 WeakPolarHBondContact O-CB 3.49Å; E316-T320 PolarHBondContact O-N 3.5Å; E316-T320 PolarHBondContact O-OG1 3.36Å |
| 317 | R | 98.4 | Very high | 98.4 | Very high | 145 Ų | 145 | 111.1 Ų | 111.1 | 55% | 0.547 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -73.4 | -42.8 | 178.5 | -73.6 | -179.5 | -164.8 | 120.3 | 4.1 | 112.1 | K313 W314 T315 T320 V321 | K313-R317 WeakPolarHBondContact O-CD 3.27Å; K313-R317 VanDerWaalsContact O-CG 3.26Å; K313-R317 WeakPolarHBondContact O-CG 3.24Å; K313-R317 PolarHBondContact O-NE 2.93Å; K313-R317 PolarHBondContact O-NH1 3.2Å; W314-R317 WeakPolarHBondContact O-CB 3.28Å; W314-R317 PolarHBondContact O-N 3.48Å; W314-R317 VanDerWaalsContact O-N 3.14Å; T315-R317 PolarHBondContact O-N 2.82Å; T315-R317 VanDerWaalsContact O-N 3.15Å; R317-T320 PolarHBondContact O-N 3.41Å; R317-V321 WeakPolarHBondContact O-CG2 3.39Å; R317-V321 PolarHBondContact O-N 2.91Å; R317-V321 VanDerWaalsContact O-N 3.07Å |
| 318 | S | 98.4 | Very high | 98.4 | Very high | 56 Ų | 56 | 112.1 Ų | 112.1 | 39% | 0.392 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.1 | -44 | 174.9 | 39.3 | 0 | 0 | 0 | 0 | 111.5 | W314 T315 T320 V321 V322 | W314-S318 PolarHBondContact O-N 2.79Å; W314-S318 PolarHBondContact O-OG 3.03Å; T315-S318 WeakPolarHBondContact CA-OG 3.33Å; T315-S318 PolarHBondContact O-N 3.18Å; T315-S318 PolarHBondContact O-OG 2.99Å; S318-T320 PolarHBondContact O-N 3.37Å; S318-V321 PolarHBondContact O-N 2.75Å; S318-V321 VanDerWaalsContact O-N 3.12Å; S318-V322 WeakPolarHBondContact O-CG2 3.24Å; S318-V322 PolarHBondContact O-N 3.05Å |
| 319 | E | 98.5 | Very high | 98.4 | Very high | 115 Ų | 115 | 114.1 Ų | 114.1 | 54% | 0.537 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -57.9 | -49.8 | 174.7 | -70.7 | 152.6 | -151.7 | 0 | 0 | 110.5 | T315 V321 V322 E323 | T315-E319 VanDerWaalsContact C-CD 3.5Å; T315-E319 VanDerWaalsContact CB-OE1 3.27Å; T315-E319 WeakPolarHBondContact CB-OE1 3.34Å; T315-E319 WeakPolarHBondContact O-CB 3.17Å; T315-E319 VanDerWaalsContact O-CD 3.25Å; T315-E319 VanDerWaalsContact O-CG 3.24Å; T315-E319 WeakPolarHBondContact O-CG 3.42Å; T315-E319 PolarHBondContact O-N 3.4Å; E319-V321 PolarHBondContact O-N 3.02Å; E319-V322 PolarHBondContact O-N 2.84Å; E319-E323 VanDerWaalsContact O-CB 3.28Å; E319-E323 WeakPolarHBondContact O-CB 3.35Å; E319-E323 PolarHBondContact O-N 3.11Å |
| 320 | T | 98.5 | Very high | 98.4 | Very high | 56 Ų | 56 | 113.6 Ų | 113.6 | 34% | 0.344 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -57.4 | -33.8 | 175.7 | -62.5 | 0 | 0 | 0 | 0 | 113 | E316 R317 S318 K324 | E316-T320 VanDerWaalsContact O-CB 3.24Å; E316-T320 WeakPolarHBondContact O-CB 3.49Å; E316-T320 PolarHBondContact O-N 3.5Å; E316-T320 PolarHBondContact O-OG1 3.36Å; R317-T320 PolarHBondContact O-N 3.41Å; S318-T320 PolarHBondContact O-N 3.37Å; T320-K324 HydrophobicContact CG2-CD 4.06Å; T320-K324 VanDerWaalsContact CG2-NZ 3.31Å; T320-K324 WeakPolarHBondContact O-CB 3.34Å; T320-K324 WeakPolarHBondContact O-CD 3.32Å; T320-K324 WeakPolarHBondContact O-CG 3.25Å; T320-K324 PolarHBondContact O-N 3.15Å; T320-K324 VanDerWaalsContact O-N 3.15Å |
| 321 | V | 98.6 | Very high | 98.4 | Very high | 101 Ų | 101 | 111.5 Ų | 111.5 | 61% | 0.612 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -74.3 | -45.8 | 177.4 | 168.8 | 0 | 0 | 0 | 0 | 111 | R317 S318 E319 K324 M325 | R317-V321 WeakPolarHBondContact O-CG2 3.39Å; R317-V321 PolarHBondContact O-N 2.91Å; R317-V321 VanDerWaalsContact O-N 3.07Å; S318-V321 PolarHBondContact O-N 2.75Å; S318-V321 VanDerWaalsContact O-N 3.12Å; E319-V321 PolarHBondContact O-N 3.02Å; V321-K324 PolarHBondContact O-N 3.37Å; V321-M325 PolarHBondContact O-N 3.01Å |
| 322 | V | 98.6 | Very high | 98.4 | Very high | 67 Ų | 67 | 111.9 Ų | 111.9 | 41% | 0.406 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.3 | -46.7 | 176.4 | 172.4 | 0 | 0 | 0 | 0 | 110.6 | S318 E319 K324 M325 Q326 | S318-V322 WeakPolarHBondContact O-CG2 3.24Å; S318-V322 PolarHBondContact O-N 3.05Å; E319-V322 PolarHBondContact O-N 2.84Å; V322-K324 PolarHBondContact O-N 3.33Å; V322-M325 CarbonylContact O-C 3.55Å; V322-M325 WeakPolarHBondContact O-CA 3.25Å; V322-M325 WeakPolarHBondContact O-CB 3.23Å; V322-M325 PolarHBondContact O-N 3.42Å; V322-Q326 HydrophobicContact CG1-CG 4.39Å; V322-Q326 WeakPolarHBondContact O-CG 3.46Å; V322-Q326 PolarHBondContact O-N 2.74Å |
| 323 | E | 98.6 | Very high | 98.4 | Very high | 76 Ų | 76 | 113.6 Ų | 113.6 | 36% | 0.355 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.4 | -43.3 | 177.6 | -168.2 | -157.2 | -167.2 | 0 | 0 | 111.5 | E319 M325 Q326 R327 | E319-E323 VanDerWaalsContact O-CB 3.28Å; E319-E323 WeakPolarHBondContact O-CB 3.35Å; E319-E323 PolarHBondContact O-N 3.11Å; E323-M325 VanDerWaalsContact C-N 3.27Å; E323-M325 PolarHBondContact O-N 2.89Å; E323-Q326 PolarHBondContact O-N 2.82Å; E323-R327 VanDerWaalsContact CD-NE 3.27Å; E323-R327 HydrophobicContact CG-CG 4.37Å; E323-R327 WeakPolarHBondContact O-CB 3.35Å; E323-R327 VanDerWaalsContact O-CG 3.25Å; E323-R327 WeakPolarHBondContact O-CG 3.31Å; E323-R327 PolarHBondContact O-N 3.35Å; E323-R327 IonicContact OE1-CZ 2.71Å; E323-R327 IonicContact OE1-NE 3.43Å; E323-R327 PolarHBondContact OE1-NE 3.32Å; E323-R327 IonicContact OE1-NH2 2.67Å; E323-R327 PolarHBondContact OE1-NH2 2.98Å; E323-R327 IonicContact OE2-CZ 2.59Å; E323-R327 IonicContact OE2-NE 2.72Å; E323-R327 IonicContact OE2-NH2 3.12Å |
| 324 | K | 98.5 | Very high | 98.4 | Very high | 122 Ų | 122 | 116.8 Ų | 116.8 | 53% | 0.53 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.1 | -32.1 | 174.5 | -77.6 | 169.4 | -175.2 | 169 | 0 | 112.6 | T320 V321 V322 R328 | T320-K324 HydrophobicContact CG2-CD 4.06Å; T320-K324 VanDerWaalsContact CG2-NZ 3.31Å; T320-K324 WeakPolarHBondContact O-CB 3.34Å; T320-K324 WeakPolarHBondContact O-CD 3.32Å; T320-K324 WeakPolarHBondContact O-CG 3.25Å; T320-K324 PolarHBondContact O-N 3.15Å; T320-K324 VanDerWaalsContact O-N 3.15Å; V321-K324 PolarHBondContact O-N 3.37Å; V322-K324 PolarHBondContact O-N 3.33Å; K324-R328 WeakPolarHBondContact O-CD 3.19Å; K324-R328 VanDerWaalsContact O-CG 3.25Å; K324-R328 WeakPolarHBondContact O-CG 3.39Å; K324-R328 PolarHBondContact O-N 3.04Å |
| 325 | M | 97.9 | Very high | 98.4 | Very high | 118 Ų | 118 | 112.9 Ų | 112.9 | 58% | 0.581 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -70.7 | -47.2 | 174 | -171.7 | 176.3 | 72.8 | 0 | 0 | 111.1 | V321 V322 E323 R328 Q329 | V321-M325 PolarHBondContact O-N 3.01Å; V322-M325 CarbonylContact O-C 3.55Å; V322-M325 WeakPolarHBondContact O-CA 3.25Å; V322-M325 WeakPolarHBondContact O-CB 3.23Å; V322-M325 PolarHBondContact O-N 3.42Å; E323-M325 VanDerWaalsContact C-N 3.27Å; E323-M325 PolarHBondContact O-N 2.89Å; M325-R328 WeakPolarHBondContact O-CB 3.33Å; M325-R328 PolarHBondContact O-N 3.48Å; M325-Q329 WeakPolarHBondContact O-CG 3.43Å; M325-Q329 PolarHBondContact O-N 3.07Å |
| 326 | Q | 98.4 | Very high | 98.4 | Very high | 103 Ų | 103 | 114.5 Ų | 114.5 | 48% | 0.481 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -59 | -53.9 | 175.9 | -72.4 | 171 | -20.3 | 0 | 0 | 111.2 | V322 E323 R328 Q329 D330 | V322-Q326 HydrophobicContact CG1-CG 4.39Å; V322-Q326 WeakPolarHBondContact O-CG 3.46Å; V322-Q326 PolarHBondContact O-N 2.74Å; E323-Q326 PolarHBondContact O-N 2.82Å; Q326-R328 PolarHBondContact O-N 3.35Å; Q326-Q329 CarbonylContact O-C 3.26Å; Q326-Q329 WeakPolarHBondContact O-CA 3.47Å; Q326-Q329 PolarHBondContact O-N 2.85Å; Q326-D330 VanDerWaalsContact O-CG 3.31Å; Q326-D330 PolarHBondContact O-N 2.83Å |
| 327 | R | 98.3 | Very high | 98.3 | Very high | 158 Ų | 158 | 115.7 Ų | 115.7 | 60% | 0.596 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -52.4 | -34 | 176.3 | -72.5 | 173.2 | 176.3 | -144.8 | 6.2 | 113.2 | E323 K331 | E323-R327 VanDerWaalsContact CD-NE 3.27Å; E323-R327 HydrophobicContact CG-CG 4.37Å; E323-R327 WeakPolarHBondContact O-CB 3.35Å; E323-R327 VanDerWaalsContact O-CG 3.25Å; E323-R327 WeakPolarHBondContact O-CG 3.31Å; E323-R327 PolarHBondContact O-N 3.35Å; E323-R327 IonicContact OE1-CZ 2.71Å; E323-R327 IonicContact OE1-NE 3.43Å; E323-R327 PolarHBondContact OE1-NE 3.32Å; E323-R327 IonicContact OE1-NH2 2.67Å; E323-R327 PolarHBondContact OE1-NH2 2.98Å; E323-R327 IonicContact OE2-CZ 2.59Å; E323-R327 IonicContact OE2-NE 2.72Å; E323-R327 IonicContact OE2-NH2 3.12Å; R327-K331 WeakPolarHBondContact O-CB 3.46Å; R327-K331 PolarHBondContact O-N 2.89Å |
| 328 | R | 98.4 | Very high | 98.3 | Very high | 197 Ų | 197 | 116.7 Ų | 116.7 | 74% | 0.743 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -71.3 | -44.8 | 173.9 | -75.6 | 171.4 | 178.3 | -164.1 | -0.6 | 112.1 | K324 M325 Q326 K331 R332 | K324-R328 WeakPolarHBondContact O-CD 3.19Å; K324-R328 VanDerWaalsContact O-CG 3.25Å; K324-R328 WeakPolarHBondContact O-CG 3.39Å; K324-R328 PolarHBondContact O-N 3.04Å; M325-R328 WeakPolarHBondContact O-CB 3.33Å; M325-R328 PolarHBondContact O-N 3.48Å; Q326-R328 PolarHBondContact O-N 3.35Å; R328-K331 PolarHBondContact O-N 3.05Å; R328-R332 PolarHBondContact O-N 3.03Å |
| 329 | Q | 98.5 | Very high | 98.3 | Very high | 98 Ų | 98 | 118.4 Ų | 118.4 | 46% | 0.458 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -65.2 | -41.2 | 176.3 | -65.2 | -67.2 | 9.1 | 0 | 0 | 111.6 | M325 Q326 R332 R333 | M325-Q329 WeakPolarHBondContact O-CG 3.43Å; M325-Q329 PolarHBondContact O-N 3.07Å; Q326-Q329 CarbonylContact O-C 3.26Å; Q326-Q329 WeakPolarHBondContact O-CA 3.47Å; Q326-Q329 PolarHBondContact O-N 2.85Å; Q329-R332 CarbonylContact O-C 3.58Å; Q329-R332 WeakPolarHBondContact O-CA 3.28Å; Q329-R332 WeakPolarHBondContact O-CB 3.4Å; Q329-R332 PolarHBondContact O-N 3.06Å; Q329-R332 VanDerWaalsContact O-N 3.13Å; Q329-R333 WeakPolarHBondContact O-CG 3.37Å; Q329-R333 PolarHBondContact O-N 3.25Å |
| 330 | D | 98.3 | Very high | 98.2 | Very high | 66 Ų | 66 | 116.9 Ų | 116.9 | 35% | 0.353 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.2 | -41.6 | 177 | -62.7 | -30.7 | 0 | 0 | 0 | 111.6 | Q326 R332 R333 R334 | Q326-D330 VanDerWaalsContact O-CG 3.31Å; Q326-D330 PolarHBondContact O-N 2.83Å; D330-R332 VanDerWaalsContact C-N 3.3Å; D330-R332 PolarHBondContact O-N 3.27Å; D330-R333 PolarHBondContact O-N 3.42Å; D330-R334 WeakPolarHBondContact O-CB 3.45Å; D330-R334 VanDerWaalsContact O-CG 3.28Å; D330-R334 WeakPolarHBondContact O-CG 3.3Å; D330-R334 PolarHBondContact O-N 2.78Å |
| 331 | K | 98.5 | Very high | 98.1 | Very high | 141 Ų | 141 | 121 Ų | 121 | 61% | 0.613 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -59.4 | -41.4 | 171.4 | -173.5 | 174 | -177.5 | 176.7 | 0 | 111.4 | R327 R328 N335 | R327-K331 WeakPolarHBondContact O-CB 3.46Å; R327-K331 PolarHBondContact O-N 2.89Å; R328-K331 PolarHBondContact O-N 3.05Å; K331-N335 VanDerWaalsContact O-CB 3.31Å; K331-N335 WeakPolarHBondContact O-CB 3.48Å; K331-N335 PolarHBondContact O-N 3.13Å; K331-N335 PolarHBondContact O-OD1 3.34Å |
| 332 | R | 98.3 | Very high | 98.1 | Very high | 166 Ų | 166 | 117.1 Ų | 117.1 | 63% | 0.626 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -63.7 | -47 | 174.8 | -173.3 | 178.7 | -178.3 | 177.6 | 1.6 | 111.5 | R328 Q329 D330 N335 I336 | R328-R332 PolarHBondContact O-N 3.03Å; Q329-R332 CarbonylContact O-C 3.58Å; Q329-R332 WeakPolarHBondContact O-CA 3.28Å; Q329-R332 WeakPolarHBondContact O-CB 3.4Å; Q329-R332 PolarHBondContact O-N 3.06Å; Q329-R332 VanDerWaalsContact O-N 3.13Å; D330-R332 VanDerWaalsContact C-N 3.3Å; D330-R332 PolarHBondContact O-N 3.27Å; R332-N335 PolarHBondContact O-N 3.45Å; R332-I336 HydrophobicContact CG-CD1 3.9Å; R332-I336 VanDerWaalsContact O-CG1 3.3Å; R332-I336 WeakPolarHBondContact O-CG1 3.43Å; R332-I336 PolarHBondContact O-N 2.89Å |
| 333 | R | 98.3 | Very high | 98 | Very high | 169 Ų | 169 | 119.4 Ų | 119.4 | 64% | 0.638 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -59.3 | -49.8 | 177.4 | -72.1 | 175.7 | 178.9 | -143.9 | -0.7 | 111.6 | Q329 D330 N335 I336 Q337 | Q329-R333 WeakPolarHBondContact O-CG 3.37Å; Q329-R333 PolarHBondContact O-N 3.25Å; D330-R333 PolarHBondContact O-N 3.42Å; R333-N335 PolarHBondContact O-N 2.86Å; R333-I336 PolarHBondContact O-N 2.81Å; R333-Q337 WeakPolarHBondContact O-CB 3.37Å; R333-Q337 WeakPolarHBondContact O-CG 3.5Å; R333-Q337 PolarHBondContact O-N 2.95Å |
| 334 | R | 98.3 | Very high | 97.8 | Very high | 176 Ų | 176 | 119.4 Ų | 119.4 | 66% | 0.664 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -60.5 | -41.9 | 176.6 | -69.4 | 175.6 | -167.8 | -176.8 | 4.5 | 112.1 | D330 Q337 K338 | D330-R334 WeakPolarHBondContact O-CB 3.45Å; D330-R334 VanDerWaalsContact O-CG 3.28Å; D330-R334 WeakPolarHBondContact O-CG 3.3Å; D330-R334 PolarHBondContact O-N 2.78Å; R334-Q337 PolarHBondContact O-N 3.26Å; R334-K338 WeakPolarHBondContact O-CB 3.42Å; R334-K338 PolarHBondContact O-N 2.95Å |
| 335 | N | 98.2 | Very high | 97.6 | Very high | 97 Ų | 97 | 118.4 Ų | 118.4 | 52% | 0.519 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -65.2 | -41.1 | 176.4 | -76.4 | 6.1 | 0 | 0 | 0 | 112.4 | K331 R332 R333 K338 N339 | K331-N335 VanDerWaalsContact O-CB 3.31Å; K331-N335 WeakPolarHBondContact O-CB 3.48Å; K331-N335 PolarHBondContact O-N 3.13Å; K331-N335 PolarHBondContact O-OD1 3.34Å; R332-N335 PolarHBondContact O-N 3.45Å; R333-N335 PolarHBondContact O-N 2.86Å; N335-K338 PolarHBondContact O-N 3.43Å; N335-N339 WeakPolarHBondContact O-CB 3.39Å; N335-N339 PolarHBondContact O-N 3.45Å |
| 336 | I | 97.7 | Very high | 97.4 | Very high | 82 Ų | 82 | 119.7 Ų | 119.7 | 42% | 0.421 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -64.3 | -46.5 | 175.3 | -69.2 | 165.9 | 0 | 0 | 0 | 110.3 | R332 R333 K338 N339 N340 | R332-I336 HydrophobicContact CG-CD1 3.9Å; R332-I336 VanDerWaalsContact O-CG1 3.3Å; R332-I336 WeakPolarHBondContact O-CG1 3.43Å; R332-I336 PolarHBondContact O-N 2.89Å; R333-I336 PolarHBondContact O-N 2.81Å; I336-K338 PolarHBondContact O-N 3.42Å; I336-N339 PolarHBondContact O-N 2.9Å; I336-N340 WeakPolarHBondContact O-CB 3.49Å; I336-N340 VanDerWaalsContact O-CG 3.31Å; I336-N340 PolarHBondContact O-N 3.3Å |
| 337 | Q | 97.9 | Very high | 97.2 | Very high | 121 Ų | 121 | 122.3 Ų | 122.3 | 57% | 0.565 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -59.1 | -44.7 | 175.5 | -74.1 | 174.2 | -14.3 | 0 | 0 | 111.9 | R333 R334 N339 N340 K341 | R333-Q337 WeakPolarHBondContact O-CB 3.37Å; R333-Q337 WeakPolarHBondContact O-CG 3.5Å; R333-Q337 PolarHBondContact O-N 2.95Å; R334-Q337 PolarHBondContact O-N 3.26Å; Q337-N339 PolarHBondContact O-N 2.91Å; Q337-N340 PolarHBondContact O-N 2.89Å; Q337-K341 WeakPolarHBondContact O-CB 3.49Å; Q337-K341 WeakPolarHBondContact O-CG 3.17Å; Q337-K341 PolarHBondContact O-N 3.49Å |
| 338 | K | 97.8 | Very high | 96.9 | Very high | 166 Ų | 166 | 117.1 Ų | 117.1 | 72% | 0.722 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -62.9 | -40.7 | 176.3 | -172.3 | 174.2 | -177.6 | 176.4 | 0 | 112.1 | R334 N335 I336 G342 | R334-K338 WeakPolarHBondContact O-CB 3.42Å; R334-K338 PolarHBondContact O-N 2.95Å; N335-K338 PolarHBondContact O-N 3.43Å; I336-K338 PolarHBondContact O-N 3.42Å; K338-G342 PolarHBondContact O-N 2.72Å |
| 339 | N | 97.4 | Very high | 96.5 | Very high | 92 Ų | 92 | 111.1 Ų | 111.1 | 49% | 0.492 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.1 | -43.6 | 175.2 | -170.7 | 12.8 | 0 | 0 | 0 | 111.4 | N335 I336 Q337 G342 K343 | N335-N339 WeakPolarHBondContact O-CB 3.39Å; N335-N339 PolarHBondContact O-N 3.45Å; I336-N339 PolarHBondContact O-N 2.9Å; Q337-N339 PolarHBondContact O-N 2.91Å; N339-G342 PolarHBondContact O-N 3.43Å; N339-K343 WeakPolarHBondContact O-CG 3.41Å; N339-K343 PolarHBondContact O-N 2.87Å |
| 340 | N | 97.7 | Very high | 96.3 | Very high | 83 Ų | 83 | 115.2 Ų | 115.2 | 44% | 0.444 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65.4 | -44.8 | 178.3 | -69.9 | -4.2 | 0 | 0 | 0 | 111.8 | I336 Q337 K343 V344 | I336-N340 WeakPolarHBondContact O-CB 3.49Å; I336-N340 VanDerWaalsContact O-CG 3.31Å; I336-N340 PolarHBondContact O-N 3.3Å; Q337-N340 PolarHBondContact O-N 2.89Å; N340-K343 PolarHBondContact O-N 3.04Å; N340-V344 WeakPolarHBondContact O-CG2 3.38Å; N340-V344 PolarHBondContact O-N 2.67Å; N340-V344 VanDerWaalsContact O-N 3.1Å |
| 341 | K | 96.9 | Very high | 96 | Very high | 142 Ų | 142 | 113.1 Ų | 113.1 | 62% | 0.617 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -59 | -49.9 | 172.9 | -73.1 | -174.4 | 176.3 | -166.9 | 0 | 111.4 | Q337 K343 V344 E345 | Q337-K341 WeakPolarHBondContact O-CB 3.49Å; Q337-K341 WeakPolarHBondContact O-CG 3.17Å; Q337-K341 PolarHBondContact O-N 3.49Å; K341-K343 VanDerWaalsContact C-N 3.27Å; K341-K343 PolarHBondContact O-N 3.24Å; K341-V344 CarbonylContact O-C 3.45Å; K341-V344 WeakPolarHBondContact O-CA 3.49Å; K341-V344 WeakPolarHBondContact O-CB 3.35Å; K341-V344 PolarHBondContact O-N 3.45Å; K341-E345 WeakPolarHBondContact O-CG 3.45Å; K341-E345 PolarHBondContact O-N 3.41Å |
| 342 | G | 96.8 | Very high | 95.6 | Very high | 19 Ų | 19 | 110.8 Ų | 110.8 | 20% | 0.196 | 50% | 0.498 | C | S | . | . | H | α-helix | trans | -61.4 | -28.9 | 177 | 0 | 0 | 0 | 0 | 0 | 114.4 | K338 N339 K346 | K338-G342 PolarHBondContact O-N 2.72Å; N339-G342 PolarHBondContact O-N 3.43Å; G342-K346 VanDerWaalsContact O-CB 3.29Å; G342-K346 WeakPolarHBondContact O-CB 3.29Å; G342-K346 WeakPolarHBondContact O-CG 3.46Å; G342-K346 PolarHBondContact O-N 2.84Å |
| 343 | K | 96.6 | Very high | 95.3 | Very high | 116 Ų | 116 | 112 Ų | 112 | 50% | 0.504 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -70 | -39 | 170.3 | -76.1 | 174 | -179.6 | -176.4 | 0 | 112.1 | N339 N340 K341 K347 | N339-K343 WeakPolarHBondContact O-CG 3.41Å; N339-K343 PolarHBondContact O-N 2.87Å; N340-K343 PolarHBondContact O-N 3.04Å; K341-K343 VanDerWaalsContact C-N 3.27Å; K341-K343 PolarHBondContact O-N 3.24Å; K343-K347 WeakPolarHBondContact O-CG 3.33Å; K343-K347 PolarHBondContact O-N 3.03Å |
| 344 | V | 95.4 | Very high | 95 | Very high | 75 Ų | 75 | 113.8 Ų | 113.8 | 46% | 0.455 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -69.8 | -46.4 | 176.5 | 172.9 | 0 | 0 | 0 | 0 | 110.7 | N340 K341 K347 K348 | N340-V344 WeakPolarHBondContact O-CG2 3.38Å; N340-V344 PolarHBondContact O-N 2.67Å; N340-V344 VanDerWaalsContact O-N 3.1Å; K341-V344 CarbonylContact O-C 3.45Å; K341-V344 WeakPolarHBondContact O-CA 3.49Å; K341-V344 WeakPolarHBondContact O-CB 3.35Å; K341-V344 PolarHBondContact O-N 3.45Å; V344-K347 WeakPolarHBondContact O-CB 3.41Å; V344-K347 PolarHBondContact O-N 2.61Å; V344-K347 VanDerWaalsContact O-N 3.08Å; V344-K348 HydrophobicContact CG1-CD 4.32Å; V344-K348 WeakPolarHBondContact O-CG 3.32Å; V344-K348 PolarHBondContact O-N 3.38Å |
| 345 | E | 93.9 | Very high | 94.5 | Very high | 101 Ų | 101 | 108.6 Ų | 108.6 | 47% | 0.472 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -56.1 | -51.8 | 174.3 | -71.3 | 156.5 | -168 | 0 | 0 | 110.8 | K341 K347 K348 D349 | K341-E345 WeakPolarHBondContact O-CG 3.45Å; K341-E345 PolarHBondContact O-N 3.41Å; E345-K347 PolarHBondContact O-N 3.25Å; E345-K347 VanDerWaalsContact O-N 3.14Å; E345-K348 CarbonylContact O-C 3.6Å; E345-K348 WeakPolarHBondContact O-CA 3.38Å; E345-K348 WeakPolarHBondContact O-CB 3.45Å; E345-K348 PolarHBondContact O-N 2.94Å; E345-D349 VanDerWaalsContact O-CG 3.3Å; E345-D349 PolarHBondContact O-N 3.14Å |
| 346 | K | 94.8 | Very high | 94 | Very high | 146 Ų | 146 | 112.8 Ų | 112.8 | 64% | 0.635 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -58.3 | -30 | 175 | -74.9 | 175 | -179.4 | -172.9 | 0 | 114.1 | G342 R350 | G342-K346 VanDerWaalsContact O-CB 3.29Å; G342-K346 WeakPolarHBondContact O-CB 3.29Å; G342-K346 WeakPolarHBondContact O-CG 3.46Å; G342-K346 PolarHBondContact O-N 2.84Å; K346-R350 WeakPolarHBondContact O-CB 3.44Å; K346-R350 WeakPolarHBondContact O-CD 3.47Å; K346-R350 WeakPolarHBondContact O-CG 3.41Å; K346-R350 PolarHBondContact O-N 3.08Å |
| 347 | K | 92.9 | Very high | 93.3 | Very high | 157 Ų | 157 | 113.8 Ų | 113.8 | 68% | 0.683 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -72 | -43.5 | 172.6 | -77.6 | -179.2 | 176.7 | -168.4 | 0 | 111.2 | K343 V344 E345 R350 A351 | K343-K347 WeakPolarHBondContact O-CG 3.33Å; K343-K347 PolarHBondContact O-N 3.03Å; V344-K347 WeakPolarHBondContact O-CB 3.41Å; V344-K347 PolarHBondContact O-N 2.61Å; V344-K347 VanDerWaalsContact O-N 3.08Å; E345-K347 PolarHBondContact O-N 3.25Å; E345-K347 VanDerWaalsContact O-N 3.14Å; K347-R350 PolarHBondContact O-N 2.82Å; K347-A351 PolarHBondContact O-N 3.23Å |
| 348 | K | 92 | Very high | 92.6 | Very high | 50 Ų | 50 | 109.5 Ų | 109.5 | 22% | 0.217 | 52% | 0.515 | C | S | . | . | H | α-helix | trans | -60.3 | -47.7 | 175.4 | -70 | 175.9 | 175.3 | -179 | 0 | 111.6 | V344 E345 R350 A351 R352 L358 E360 | V344-K348 HydrophobicContact CG1-CD 4.32Å; V344-K348 WeakPolarHBondContact O-CG 3.32Å; V344-K348 PolarHBondContact O-N 3.38Å; E345-K348 CarbonylContact O-C 3.6Å; E345-K348 WeakPolarHBondContact O-CA 3.38Å; E345-K348 WeakPolarHBondContact O-CB 3.45Å; E345-K348 PolarHBondContact O-N 2.94Å; K348-R350 VanDerWaalsContact C-N 3.31Å; K348-R350 PolarHBondContact O-N 2.95Å; K348-A351 WeakPolarHBondContact O-CA 3.42Å; K348-A351 WeakPolarHBondContact O-CB 3.39Å; K348-A351 PolarHBondContact O-N 3.17Å; K348-R352 PolarHBondContact O-N 3.1Å; K348-L358 HydrophobicContact CB-CD1 3.56Å; K348-L358 HydrophobicContact CD-CD1 4.42Å; K348-L358 HydrophobicContact CG-CD1 3.8Å; K348-E360 WeakPolarHBondContact CE-OE2 3.46Å; K348-E360 IonicContact NZ-OE1 2.89Å; K348-E360 PolarHBondContact NZ-OE1 2.97Å; K348-E360 IonicContact NZ-OE2 2.84Å; K348-E360 PolarHBondContact NZ-OE2 2.89Å |
| 349 | D | 91.2 | Very high | 92 | Very high | 71 Ų | 71 | 106.1 Ų | 106.1 | 38% | 0.38 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -66.2 | -34.5 | -179.5 | -58.8 | -29.3 | 0 | 0 | 0 | 112.2 | E345 A351 R352 K353 | E345-D349 VanDerWaalsContact O-CG 3.3Å; E345-D349 PolarHBondContact O-N 3.14Å; D349-A351 VanDerWaalsContact C-N 3.32Å; D349-R352 IonicContact OD1-NH1 3.04Å; D349-R352 PolarHBondContact OD1-NH1 3.02Å; D349-K353 WeakPolarHBondContact O-CB 3.38Å; D349-K353 VanDerWaalsContact O-CG 3.32Å; D349-K353 WeakPolarHBondContact O-CG 3.43Å; D349-K353 PolarHBondContact O-N 2.93Å |
| 350 | R | 93.4 | Very high | 91.3 | Very high | 184 Ų | 184 | 106.2 Ų | 106.2 | 69% | 0.694 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -66 | -32.2 | 170.4 | -76.6 | 172.1 | 178.4 | -161.8 | -2.2 | 112.9 | K346 K347 K348 R354 | K346-R350 WeakPolarHBondContact O-CB 3.44Å; K346-R350 WeakPolarHBondContact O-CD 3.47Å; K346-R350 WeakPolarHBondContact O-CG 3.41Å; K346-R350 PolarHBondContact O-N 3.08Å; K347-R350 PolarHBondContact O-N 2.82Å; K348-R350 VanDerWaalsContact C-N 3.31Å; K348-R350 PolarHBondContact O-N 2.95Å; R350-R354 WeakPolarHBondContact O-CG 3.18Å; R350-R354 PolarHBondContact O-N 3.22Å |
| 351 | A | 92 | Very high | 90.4 | Very high | 21 Ų | 21 | 104.2 Ų | 104.2 | 17% | 0.174 | 50% | 0.497 | C | S | . | . | H | α-helix | trans | -71.1 | -47.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | K347 K348 D349 K353 R354 G355 R356 L358 | K347-A351 PolarHBondContact O-N 3.23Å; K348-A351 WeakPolarHBondContact O-CA 3.42Å; K348-A351 WeakPolarHBondContact O-CB 3.39Å; K348-A351 PolarHBondContact O-N 3.17Å; D349-A351 VanDerWaalsContact C-N 3.32Å; A351-K353 PolarHBondContact O-N 3.27Å; A351-R354 CarbonylContact O-C 3.6Å; A351-R354 WeakPolarHBondContact O-CA 3.33Å; A351-R354 PolarHBondContact O-N 3.27Å; A351-G355 PolarHBondContact O-N 3.34Å; A351-R356 HydrophobicContact CB-CB 4.21Å; A351-R356 WeakPolarHBondContact O-CB 3.35Å; A351-R356 PolarHBondContact O-N 2.84Å; A351-L358 HydrophobicContact CB-CD2 4.16Å |
| 352 | R | 89.6 | Confident | 89.6 | Confident | 92 Ų | 92 | 102.3 Ų | 102.3 | 35% | 0.347 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -57 | -46.7 | 174.5 | -68.5 | 179.6 | -178.7 | 132.1 | -6.6 | 112.4 | K348 D349 R354 G355 L358 D361 | K348-R352 PolarHBondContact O-N 3.1Å; D349-R352 IonicContact OD1-NH1 3.04Å; D349-R352 PolarHBondContact OD1-NH1 3.02Å; R352-R354 PolarHBondContact O-N 3.27Å; R352-R354 VanDerWaalsContact O-N 3.11Å; R352-G355 PolarHBondContact O-N 3.29Å; R352-L358 HydrophobicContact CG-CD1 4.04Å; R352-D361 IonicContact CZ-OD1 3.04Å; R352-D361 IonicContact CZ-OD2 3.43Å; R352-D361 IonicContact NE-OD1 2.61Å; R352-D361 PolarHBondContact NE-OD1 2.93Å; R352-D361 IonicContact NE-OD2 3.59Å; R352-D361 PolarHBondContact NE-OD2 2.99Å; R352-D361 IonicContact NH2-OD1 2.67Å; R352-D361 PolarHBondContact NH2-OD1 3.11Å; R352-D361 IonicContact NH2-OD2 3.79Å; R352-D361 PolarHBondContact NH2-OD2 3.43Å |
| 353 | K | 92 | Very high | 89 | Confident | 192 Ų | 192 | 108.5 Ų | 108.5 | 84% | 0.835 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.2 | -15.2 | 175.1 | -75.1 | -173.8 | 178.3 | -160.5 | 0 | 114.5 | D349 A351 | D349-K353 WeakPolarHBondContact O-CB 3.38Å; D349-K353 VanDerWaalsContact O-CG 3.32Å; D349-K353 WeakPolarHBondContact O-CG 3.43Å; D349-K353 PolarHBondContact O-N 2.93Å; A351-K353 PolarHBondContact O-N 3.27Å |
| 354 | R | 92.3 | Very high | 88.2 | Confident | 207 Ų | 207 | 110.1 Ų | 110.1 | 78% | 0.781 | 52% | 0.522 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102.4 | 18 | 173.4 | -69.8 | 176.2 | 172.6 | -168.3 | -5 | 112.3 | R350 A351 R352 R356 | R350-R354 WeakPolarHBondContact O-CG 3.18Å; R350-R354 PolarHBondContact O-N 3.22Å; A351-R354 CarbonylContact O-C 3.6Å; A351-R354 WeakPolarHBondContact O-CA 3.33Å; A351-R354 PolarHBondContact O-N 3.27Å; R352-R354 PolarHBondContact O-N 3.27Å; R352-R354 VanDerWaalsContact O-N 3.11Å; R354-R356 PolarHBondContact O-N 3.43Å |
| 355 | G | 87.7 | Confident | 87.4 | Confident | 67 Ų | 67 | 110.6 Ų | 110.6 | 69% | 0.691 | 53% | 0.533 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 71.2 | 7.8 | 179.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | A351 R352 V357 | A351-G355 PolarHBondContact O-N 3.34Å; R352-G355 PolarHBondContact O-N 3.29Å; G355-V357 PolarHBondContact O-N 3.18Å |
| 356 | R | 88.3 | Confident | 86.5 | Confident | 184 Ų | 184 | 113.7 Ų | 113.7 | 69% | 0.694 | 55% | 0.548 | S | S | * | . | trans | -83.2 | 114.4 | 179.5 | -64.2 | -171.7 | 177.6 | -143.2 | -2.4 | 110.6 | A351 R354 | A351-R356 HydrophobicContact CB-CB 4.21Å; A351-R356 WeakPolarHBondContact O-CB 3.35Å; A351-R356 PolarHBondContact O-N 2.84Å; R354-R356 PolarHBondContact O-N 3.43Å | ||
| 357 | V | 82.1 | Confident | 84.7 | Confident | 104 Ų | 104 | 115.3 Ų | 115.3 | 63% | 0.63 | 57% | 0.57 | S | S | * | * | trans | -66.9 | 133.1 | 172.4 | -173.5 | 0 | 0 | 0 | 0 | 109.7 | G355 L362 | G355-V357 PolarHBondContact O-N 3.18Å; V357-L362 HydrophobicContact CG1-CD2 3.76Å; V357-L362 HydrophobicContact CG1-CG 3.84Å | ||
| 358 | L | 84.8 | Confident | 84.3 | Confident | 31 Ų | 31 | 113.3 Ų | 113.3 | 16% | 0.162 | 56% | 0.564 | C | S | . | * | trans | -99.9 | 151.4 | 177.7 | -64.5 | 169.6 | 0 | 0 | 0 | 111 | K348 A351 R352 E360 D361 L362 | K348-L358 HydrophobicContact CB-CD1 3.56Å; K348-L358 HydrophobicContact CD-CD1 4.42Å; K348-L358 HydrophobicContact CG-CD1 3.8Å; A351-L358 HydrophobicContact CB-CD2 4.16Å; R352-L358 HydrophobicContact CG-CD1 4.04Å; L358-E360 PolarHBondContact O-N 3.18Å; L358-E360 VanDerWaalsContact O-N 3.08Å; L358-D361 PolarHBondContact O-N 3.08Å; L358-L362 PolarHBondContact O-N 3.45Å | ||
| 359 | P | 83.6 | Confident | 83.9 | Confident | 94 Ų | 94 | 116.6 Ų | 116.6 | 61% | 0.61 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -58.1 | -24.5 | 176.2 | -26.7 | 35.2 | 0 | 0 | 0 | 114.7 | K363 | P359-K363 WeakPolarHBondContact O-CG 3.33Å; P359-K363 PolarHBondContact O-N 2.93Å |
| 360 | E | 82.6 | Confident | 83.5 | Confident | 95 Ų | 95 | 119.1 Ų | 119.1 | 44% | 0.444 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -73.7 | -27.8 | 174.1 | -69 | 177.6 | 178.6 | 0 | 0 | 113 | K348 L358 K364 | K348-E360 WeakPolarHBondContact CE-OE2 3.46Å; K348-E360 IonicContact NZ-OE1 2.89Å; K348-E360 PolarHBondContact NZ-OE1 2.97Å; K348-E360 IonicContact NZ-OE2 2.84Å; K348-E360 PolarHBondContact NZ-OE2 2.89Å; L358-E360 PolarHBondContact O-N 3.18Å; L358-E360 VanDerWaalsContact O-N 3.08Å; E360-K364 WeakPolarHBondContact O-CG 3.48Å; E360-K364 PolarHBondContact O-N 3Å |
| 361 | D | 79.1 | Confident | 82.9 | Confident | 41 Ų | 41 | 115.3 Ų | 115.3 | 22% | 0.219 | 59% | 0.587 | C | S | . | * | H | α-helix | trans | -82.3 | -34.6 | 179.4 | -57.6 | -32 | 0 | 0 | 0 | 109.7 | R352 L358 K364 A365 | R352-D361 IonicContact CZ-OD1 3.04Å; R352-D361 IonicContact CZ-OD2 3.43Å; R352-D361 IonicContact NE-OD1 2.61Å; R352-D361 PolarHBondContact NE-OD1 2.93Å; R352-D361 IonicContact NE-OD2 3.59Å; R352-D361 PolarHBondContact NE-OD2 2.99Å; R352-D361 IonicContact NH2-OD1 2.67Å; R352-D361 PolarHBondContact NH2-OD1 3.11Å; R352-D361 IonicContact NH2-OD2 3.79Å; R352-D361 PolarHBondContact NH2-OD2 3.43Å; L358-D361 PolarHBondContact O-N 3.08Å; D361-K364 PolarHBondContact O-N 3.06Å; D361-A365 PolarHBondContact O-N 3.43Å |
| 362 | L | 80.6 | Confident | 82.4 | Confident | 101 Ų | 101 | 121.2 Ų | 121.2 | 53% | 0.529 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -61 | -46.5 | 168.3 | -65.5 | 175.4 | 0 | 0 | 0 | 112.2 | V357 L358 K364 A365 Q366 | V357-L362 HydrophobicContact CG1-CD2 3.76Å; V357-L362 HydrophobicContact CG1-CG 3.84Å; L358-L362 PolarHBondContact O-N 3.45Å; L362-K364 PolarHBondContact O-N 3.41Å; L362-A365 PolarHBondContact O-N 3.03Å; L362-Q366 PolarHBondContact O-N 3.24Å |
| 363 | K | 83.1 | Confident | 81.9 | Confident | 150 Ų | 150 | 123.1 Ų | 123.1 | 65% | 0.652 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -64.2 | -21.7 | 177.1 | -74.7 | -179.3 | 179.3 | -166.5 | 0 | 114 | P359 | P359-K363 WeakPolarHBondContact O-CG 3.33Å; P359-K363 PolarHBondContact O-N 2.93Å |
| 364 | K | 81.8 | Confident | 81.2 | Confident | 150 Ų | 150 | 118.2 Ų | 118.2 | 65% | 0.652 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.8 | -14.2 | 173.6 | -79.5 | 177.1 | 173.5 | -169.2 | 0 | 114 | E360 D361 L362 | E360-K364 WeakPolarHBondContact O-CG 3.48Å; E360-K364 PolarHBondContact O-N 3Å; D361-K364 PolarHBondContact O-N 3.06Å; L362-K364 PolarHBondContact O-N 3.41Å |
| 365 | A | 77.1 | Confident | 80.3 | Confident | 84 Ų | 84 | 111.4 Ų | 111.4 | 69% | 0.694 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.4 | -4.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | D361 L362 | D361-A365 PolarHBondContact O-N 3.43Å; L362-A365 PolarHBondContact O-N 3.03Å |
| 366 | Q | 76.4 | Confident | 79.7 | Confident | 167 Ų | 167 | 115.1 Ų | 115.1 | 78% | 0.78 | 60% | 0.597 | S | S | * | * | trans | -99.9 | 4.8 | 172.7 | -69.2 | -175.8 | -43 | 0 | 0 | 112.9 | L362 | L362-Q366 PolarHBondContact O-N 3.24Š| ||
| 367 | V | 56.8 | Low | 78.9 | Confident | 180 Ų | 180 | 108.8 Ų | 108.8 | 100% | 1.091 | 59% | 0.588 | S | S | * | * | trans | -123.4 | 0 | 173 | -178.7 | 0 | 0 | 0 | 0 | 107.2 |
Retrieved 367 of 367 residues in 672.7 ms
(Link to these results)