| 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 | 73.6 | Confident | 90.5 | Very high | 197 Ų | 197 | 127.5 Ų | 127.5 | 97% | 0.97 | 64% | 0.637 | S | S | * | * | 0 | -45.3 | 0 | -164 | -151 | -160.4 | 0 | 0 | 111.4 | A3 I4 K5 | M1-A3 PolarHBondContact O-N 3.45Å; M1-I4 PolarHBondContact O-N 3.24Å; M1-K5 PolarHBondContact O-N 3.27Å | |||
| 2 | D | 88.3 | Confident | 90.9 | Very high | 120 Ų | 120 | 127.2 Ų | 127.2 | 64% | 0.642 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -64.9 | -36.1 | -172.5 | -61.7 | -56.2 | 0 | 0 | 0 | 116.2 | I4 K5 K6 | D2-I4 VanDerWaalsContact C-N 3.33Å; D2-I4 PolarHBondContact O-N 3.19Å; D2-K5 PolarHBondContact O-N 3.07Å; D2-K6 PolarHBondContact O-N 2.87Å |
| 3 | A | 89.2 | Confident | 91.3 | Very high | 81 Ų | 81 | 123.9 Ų | 123.9 | 67% | 0.669 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -62.7 | -38.8 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | M1 K7 | M1-A3 PolarHBondContact O-N 3.45Å; A3-K7 PolarHBondContact O-N 2.77Å |
| 4 | I | 91.4 | Very high | 91.6 | Very high | 130 Ų | 130 | 121.6 Ų | 121.6 | 67% | 0.667 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -69 | -42.7 | 177.9 | -63.6 | 174.8 | 0 | 0 | 0 | 110 | M1 D2 K6 K7 M8 | M1-I4 PolarHBondContact O-N 3.24Å; D2-I4 VanDerWaalsContact C-N 3.33Å; D2-I4 PolarHBondContact O-N 3.19Å; I4-K6 PolarHBondContact O-N 3.19Å; I4-K7 PolarHBondContact O-N 3.3Å; I4-M8 WeakPolarHBondContact O-CB 3.48Å; I4-M8 PolarHBondContact O-N 2.81Å |
| 5 | K | 92.8 | Very high | 91.9 | Very high | 122 Ų | 122 | 122.8 Ų | 122.8 | 53% | 0.53 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -61.3 | -43 | 176.9 | -171 | 176.3 | -179.8 | -177.8 | 0 | 111.7 | M1 D2 M8 Q9 | M1-K5 PolarHBondContact O-N 3.27Å; D2-K5 PolarHBondContact O-N 3.07Å; K5-M8 PolarHBondContact O-N 3.33Å; K5-Q9 WeakPolarHBondContact O-CG 3.5Å; K5-Q9 PolarHBondContact O-N 2.86Å |
| 6 | K | 93.9 | Very high | 92.2 | Very high | 153 Ų | 153 | 121.9 Ų | 121.9 | 67% | 0.665 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -61.1 | -49.1 | 174.3 | -112.3 | -178.4 | 177.5 | 178.9 | 0 | 111.9 | D2 I4 M8 Q9 M10 | D2-K6 PolarHBondContact O-N 2.87Å; I4-K6 PolarHBondContact O-N 3.19Å; K6-M8 PolarHBondContact O-N 3.32Å; K6-Q9 PolarHBondContact O-N 3.37Å; K6-Q9 VanDerWaalsContact O-N 3.13Å; K6-M10 WeakPolarHBondContact O-CG 3.4Å; K6-M10 PolarHBondContact O-N 2.81Å |
| 7 | K | 93.1 | Very high | 92.4 | Very high | 153 Ų | 153 | 119.7 Ų | 119.7 | 67% | 0.665 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -59.2 | -38.8 | 178.5 | -165.7 | 173.7 | -176.7 | 177.8 | 0 | 111.4 | A3 I4 M10 L11 | A3-K7 PolarHBondContact O-N 2.77Å; I4-K7 PolarHBondContact O-N 3.3Å; K7-M10 PolarHBondContact O-N 3.37Å; K7-L11 WeakPolarHBondContact O-CG 3.48Å; K7-L11 PolarHBondContact O-N 3.4Å; K7-L11 VanDerWaalsContact O-N 3.09Å |
| 8 | M | 93.8 | Very high | 92.7 | Very high | 109 Ų | 109 | 116.5 Ų | 116.5 | 54% | 0.537 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -68.5 | -37.3 | 176.5 | -175.1 | 147.9 | 61.4 | 0 | 0 | 113.3 | I4 K5 K6 L11 K12 | I4-M8 WeakPolarHBondContact O-CB 3.48Å; I4-M8 PolarHBondContact O-N 2.81Å; K5-M8 PolarHBondContact O-N 3.33Å; K6-M8 PolarHBondContact O-N 3.32Å; M8-L11 PolarHBondContact O-N 2.96Å; M8-K12 WeakPolarHBondContact O-CG 3.24Å; M8-K12 PolarHBondContact O-N 2.79Å; M8-K12 VanDerWaalsContact O-N 3.16Å |
| 9 | Q | 93.4 | Very high | 92.9 | Very high | 115 Ų | 115 | 114.8 Ų | 114.8 | 54% | 0.537 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -65.3 | -41.2 | 174 | -75.1 | 176.5 | -39.4 | 0 | 0 | 111.9 | K5 K6 L11 K12 L13 | K5-Q9 WeakPolarHBondContact O-CG 3.5Å; K5-Q9 PolarHBondContact O-N 2.86Å; K6-Q9 PolarHBondContact O-N 3.37Å; K6-Q9 VanDerWaalsContact O-N 3.13Å; Q9-L11 PolarHBondContact O-N 2.97Å; Q9-K12 PolarHBondContact O-N 3.46Å; Q9-L13 PolarHBondContact O-N 3.43Å |
| 10 | M | 92.3 | Very high | 93.1 | Very high | 114 Ų | 114 | 114.1 Ų | 114.1 | 56% | 0.562 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -60.8 | -46 | 176.4 | -63.5 | -61.2 | -90.7 | 0 | 0 | 111.1 | K6 K7 K12 L13 D14 | K6-M10 WeakPolarHBondContact O-CG 3.4Å; K6-M10 PolarHBondContact O-N 2.81Å; K7-M10 PolarHBondContact O-N 3.37Å; M10-K12 VanDerWaalsContact C-N 3.27Å; M10-K12 PolarHBondContact O-N 3.37Å; M10-L13 PolarHBondContact O-N 3.46Å; M10-D14 WeakPolarHBondContact O-CB 3.44Å; M10-D14 PolarHBondContact O-N 2.88Å |
| 11 | L | 93.8 | Very high | 93.3 | Very high | 108 Ų | 108 | 118.2 Ų | 118.2 | 57% | 0.565 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -63.2 | -31.5 | 178.4 | -69.4 | 172.8 | 0 | 0 | 0 | 113.6 | K7 M8 Q9 K15 | K7-L11 WeakPolarHBondContact O-CG 3.48Å; K7-L11 PolarHBondContact O-N 3.4Å; K7-L11 VanDerWaalsContact O-N 3.09Å; M8-L11 PolarHBondContact O-N 2.96Å; Q9-L11 PolarHBondContact O-N 2.97Å; L11-K15 WeakPolarHBondContact O-CB 3.36Å; L11-K15 PolarHBondContact O-N 3Å; L11-K15 VanDerWaalsContact O-N 3.11Å |
| 12 | K | 95.1 | Very high | 94.4 | Very high | 124 Ų | 124 | 111.1 Ų | 111.1 | 54% | 0.539 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -69.6 | -46.1 | 174.2 | -73.8 | -179.1 | 178.9 | -169.4 | 0 | 111.3 | M8 Q9 M10 D14 K15 E16 | M8-K12 WeakPolarHBondContact O-CG 3.24Å; M8-K12 PolarHBondContact O-N 2.79Å; M8-K12 VanDerWaalsContact O-N 3.16Å; Q9-K12 PolarHBondContact O-N 3.46Å; M10-K12 VanDerWaalsContact C-N 3.27Å; M10-K12 PolarHBondContact O-N 3.37Å; K12-D14 VanDerWaalsContact C-N 3.34Å; K12-D14 PolarHBondContact O-N 3.05Å; K12-K15 WeakPolarHBondContact O-CB 3.32Å; K12-K15 PolarHBondContact O-N 2.91Å; K12-E16 WeakPolarHBondContact O-CG 3.44Å; K12-E16 PolarHBondContact O-N 3.49Å |
| 13 | L | 96.4 | Very high | 94.8 | Very high | 85 Ų | 85 | 111.4 Ų | 111.4 | 45% | 0.445 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -61.7 | -43.6 | 177.3 | -174.7 | 68.3 | 0 | 0 | 0 | 111.3 | Q9 M10 K15 E16 N17 | Q9-L13 PolarHBondContact O-N 3.43Å; M10-L13 PolarHBondContact O-N 3.46Å; L13-K15 VanDerWaalsContact C-N 3.3Å; L13-K15 PolarHBondContact O-N 2.88Å; L13-E16 PolarHBondContact O-N 2.94Å; L13-N17 WeakPolarHBondContact O-CB 3.38Å; L13-N17 PolarHBondContact O-N 3.32Å; L13-N17 PolarHBondContact O-ND2 2.89Å |
| 14 | D | 95.9 | Very high | 95.2 | Very high | 91 Ų | 91 | 112.7 Ų | 112.7 | 49% | 0.487 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -62.8 | -38.7 | 177.6 | -66.9 | -26.5 | 0 | 0 | 0 | 111.5 | M10 K12 A18 | M10-D14 WeakPolarHBondContact O-CB 3.44Å; M10-D14 PolarHBondContact O-N 2.88Å; K12-D14 VanDerWaalsContact C-N 3.34Å; K12-D14 PolarHBondContact O-N 3.05Å; D14-A18 WeakPolarHBondContact O-CB 3.19Å; D14-A18 PolarHBondContact O-N 3.29Å |
| 15 | K | 95.4 | Very high | 95.4 | Very high | 140 Ų | 140 | 109.2 Ų | 109.2 | 61% | 0.609 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -65.9 | -47.2 | 175 | -178.3 | -173.1 | 173.2 | -172.6 | 0 | 111.6 | L11 K12 L13 A18 L19 | L11-K15 WeakPolarHBondContact O-CB 3.36Å; L11-K15 PolarHBondContact O-N 3Å; L11-K15 VanDerWaalsContact O-N 3.11Å; K12-K15 WeakPolarHBondContact O-CB 3.32Å; K12-K15 PolarHBondContact O-N 2.91Å; L13-K15 VanDerWaalsContact C-N 3.3Å; L13-K15 PolarHBondContact O-N 2.88Å; K15-A18 PolarHBondContact O-N 3.04Å; K15-L19 HydrophobicContact CG-CD1 4.16Å; K15-L19 WeakPolarHBondContact O-CG 3.34Å; K15-L19 PolarHBondContact O-N 3.08Å |
| 16 | E | 96.5 | Very high | 95.6 | Very high | 108 Ų | 108 | 110 Ų | 110 | 51% | 0.505 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -60.4 | -47.6 | 178.7 | -73.7 | 170.2 | 176.5 | 0 | 0 | 110.4 | K12 L13 A18 L19 D20 | K12-E16 WeakPolarHBondContact O-CG 3.44Å; K12-E16 PolarHBondContact O-N 3.49Å; L13-E16 PolarHBondContact O-N 2.94Å; E16-A18 VanDerWaalsContact C-N 3.29Å; E16-A18 PolarHBondContact O-N 3.45Å; E16-L19 PolarHBondContact O-N 2.86Å; E16-L19 VanDerWaalsContact O-N 3.1Å; E16-D20 PolarHBondContact O-N 2.91Å |
| 17 | N | 96.1 | Very high | 95.8 | Very high | 85 Ų | 85 | 105.3 Ų | 105.3 | 46% | 0.455 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -59.9 | -37.1 | 176.1 | -69.4 | -23.9 | 0 | 0 | 0 | 113.2 | L13 R21 | L13-N17 WeakPolarHBondContact O-CB 3.38Å; L13-N17 PolarHBondContact O-N 3.32Å; L13-N17 PolarHBondContact O-ND2 2.89Å; N17-R21 WeakPolarHBondContact O-CB 3.28Å; N17-R21 PolarHBondContact O-N 3.4Å; N17-R21 VanDerWaalsContact O-N 3.16Å |
| 18 | A | 97.1 | Very high | 95.9 | Very high | 62 Ų | 62 | 102.4 Ų | 102.4 | 51% | 0.512 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -69.4 | -38.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | D14 K15 E16 A22 | D14-A18 WeakPolarHBondContact O-CB 3.19Å; D14-A18 PolarHBondContact O-N 3.29Å; K15-A18 PolarHBondContact O-N 3.04Å; E16-A18 VanDerWaalsContact C-N 3.29Å; E16-A18 PolarHBondContact O-N 3.45Å; A18-A22 WeakPolarHBondContact O-CB 3.31Å; A18-A22 PolarHBondContact O-N 2.89Å |
| 19 | L | 96.9 | Very high | 96.1 | Very high | 85 Ų | 85 | 103.4 Ų | 103.4 | 45% | 0.445 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -67.5 | -49.5 | 176.4 | -70.9 | 172.4 | 0 | 0 | 0 | 111 | K15 E16 R21 A22 E23 | K15-L19 HydrophobicContact CG-CD1 4.16Å; K15-L19 WeakPolarHBondContact O-CG 3.34Å; K15-L19 PolarHBondContact O-N 3.08Å; E16-L19 PolarHBondContact O-N 2.86Å; E16-L19 VanDerWaalsContact O-N 3.1Å; L19-R21 PolarHBondContact O-N 2.99Å; L19-A22 WeakPolarHBondContact O-CB 3.42Å; L19-A22 PolarHBondContact O-N 3.19Å; L19-E23 WeakPolarHBondContact O-CG 3.44Å; L19-E23 PolarHBondContact O-N 3.3Å |
| 20 | D | 97.1 | Very high | 96.3 | Very high | 99 Ų | 99 | 104.3 Ų | 104.3 | 53% | 0.529 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -57.6 | -40.4 | 178.7 | -67.6 | -8.5 | 0 | 0 | 0 | 111.3 | E16 Q24 | E16-D20 PolarHBondContact O-N 2.91Å; D20-Q24 WeakPolarHBondContact O-CB 3.26Å; D20-Q24 PolarHBondContact O-N 3.01Å |
| 21 | R | 96.4 | Very high | 96.5 | Very high | 201 Ų | 201 | 100.9 Ų | 100.9 | 76% | 0.758 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -67.2 | -38.5 | 176.4 | -173.2 | 175 | -178.8 | 177.4 | 0.9 | 112.5 | N17 L19 A25 | N17-R21 WeakPolarHBondContact O-CB 3.28Å; N17-R21 PolarHBondContact O-N 3.4Å; N17-R21 VanDerWaalsContact O-N 3.16Å; L19-R21 PolarHBondContact O-N 2.99Å; R21-A25 WeakPolarHBondContact O-CB 3.39Å; R21-A25 PolarHBondContact O-N 3Å; R21-A25 VanDerWaalsContact O-N 3.09Å |
| 22 | A | 96.9 | Very high | 96.7 | Very high | 48 Ų | 48 | 98.6 Ų | 98.6 | 40% | 0.397 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -66.7 | -45.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | A18 L19 Q24 A25 E26 | A18-A22 WeakPolarHBondContact O-CB 3.31Å; A18-A22 PolarHBondContact O-N 2.89Å; L19-A22 WeakPolarHBondContact O-CB 3.42Å; L19-A22 PolarHBondContact O-N 3.19Å; A22-Q24 PolarHBondContact O-N 2.93Å; A22-A25 PolarHBondContact O-N 3.39Å; A22-E26 WeakPolarHBondContact O-CG 3.46Å; A22-E26 PolarHBondContact O-N 3.4Å |
| 23 | E | 97.3 | Very high | 96.8 | Very high | 127 Ų | 127 | 96.7 Ų | 96.7 | 59% | 0.593 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -61.3 | -44.2 | 177.8 | -71 | -178.8 | -176.2 | 0 | 0 | 111.9 | L19 A25 E26 A27 | L19-E23 WeakPolarHBondContact O-CG 3.44Å; L19-E23 PolarHBondContact O-N 3.3Å; E23-A25 PolarHBondContact O-N 2.99Å; E23-E26 PolarHBondContact O-N 3.14Å; E23-A27 PolarHBondContact O-N 3.42Å |
| 24 | Q | 96.5 | Very high | 96.8 | Very high | 107 Ų | 107 | 96 Ų | 96 | 50% | 0.5 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.5 | -44.1 | 175.5 | -176.5 | 59 | 49.2 | 0 | 0 | 111.7 | D20 A22 E26 A27 D28 | D20-Q24 WeakPolarHBondContact O-CB 3.26Å; D20-Q24 PolarHBondContact O-N 3.01Å; A22-Q24 PolarHBondContact O-N 2.93Å; Q24-E26 VanDerWaalsContact C-N 3.31Å; Q24-E26 PolarHBondContact O-N 3.16Å; Q24-A27 PolarHBondContact O-N 3.45Å; Q24-D28 VanDerWaalsContact NE2-CG 3.29Å; Q24-D28 PolarHBondContact NE2-OD1 3.1Å; Q24-D28 PolarHBondContact NE2-OD2 3.19Å; Q24-D28 VanDerWaalsContact NE2-OD2 3.07Å; Q24-D28 PolarHBondContact O-N 2.95Å |
| 25 | A | 96.7 | Very high | 96.9 | Very high | 58 Ų | 58 | 99.9 Ų | 99.9 | 48% | 0.479 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.2 | -36.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | R21 A22 E23 K29 | R21-A25 WeakPolarHBondContact O-CB 3.39Å; R21-A25 PolarHBondContact O-N 3Å; R21-A25 VanDerWaalsContact O-N 3.09Å; A22-A25 PolarHBondContact O-N 3.39Å; E23-A25 PolarHBondContact O-N 2.99Å; A25-K29 VanDerWaalsContact O-CB 3.25Å; A25-K29 WeakPolarHBondContact O-CB 3.44Å; A25-K29 PolarHBondContact O-N 3.47Å |
| 26 | E | 96.9 | Very high | 96.9 | Very high | 139 Ų | 139 | 95.8 Ų | 95.8 | 65% | 0.65 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -67.4 | -41.8 | 174.3 | -74.6 | -173.6 | 177.6 | 0 | 0 | 112.2 | A22 E23 Q24 K29 K30 | A22-E26 WeakPolarHBondContact O-CG 3.46Å; A22-E26 PolarHBondContact O-N 3.4Å; E23-E26 PolarHBondContact O-N 3.14Å; Q24-E26 VanDerWaalsContact C-N 3.31Å; Q24-E26 PolarHBondContact O-N 3.16Å; E26-K29 PolarHBondContact O-N 3.29Å; E26-K30 WeakPolarHBondContact O-CB 3.5Å; E26-K30 PolarHBondContact O-N 3.25Å |
| 27 | A | 97.5 | Very high | 96.9 | Very high | 54 Ų | 54 | 95.9 Ų | 95.9 | 45% | 0.446 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.9 | -46.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | E23 Q24 K30 A31 | E23-A27 PolarHBondContact O-N 3.42Å; Q24-A27 PolarHBondContact O-N 3.45Å; A27-K30 PolarHBondContact O-N 2.91Å; A27-A31 PolarHBondContact O-N 3.05Å |
| 28 | D | 96.5 | Very high | 97 | Very high | 91 Ų | 91 | 97.8 Ų | 97.8 | 49% | 0.487 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65 | -41 | 178.3 | -70.8 | -27.9 | 0 | 0 | 0 | 111.6 | Q24 A31 A32 | Q24-D28 VanDerWaalsContact NE2-CG 3.29Å; Q24-D28 PolarHBondContact NE2-OD1 3.1Å; Q24-D28 PolarHBondContact NE2-OD2 3.19Å; Q24-D28 VanDerWaalsContact NE2-OD2 3.07Å; Q24-D28 PolarHBondContact O-N 2.95Å; D28-A31 PolarHBondContact O-N 3.01Å; D28-A32 WeakPolarHBondContact O-CB 3.49Å; D28-A32 PolarHBondContact O-N 3.49Å |
| 29 | K | 97.3 | Very high | 97 | Very high | 130 Ų | 130 | 99.7 Ų | 99.7 | 57% | 0.565 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -59.5 | -48.2 | 174.7 | 177.9 | -178.1 | 166.6 | -175.8 | 0 | 110.9 | A25 E26 A31 A32 E33 | A25-K29 VanDerWaalsContact O-CB 3.25Å; A25-K29 WeakPolarHBondContact O-CB 3.44Å; A25-K29 PolarHBondContact O-N 3.47Å; E26-K29 PolarHBondContact O-N 3.29Å; K29-A31 VanDerWaalsContact C-N 3.34Å; K29-A31 PolarHBondContact O-N 2.99Å; K29-A32 PolarHBondContact O-N 3.33Å; K29-E33 WeakPolarHBondContact CE-OE1 3.47Å; K29-E33 HydrophobicContact CG-CG 4.46Å; K29-E33 IonicContact NZ-OE1 3.91Å; K29-E33 WeakPolarHBondContact O-CG 3.26Å; K29-E33 PolarHBondContact O-N 2.76Å |
| 30 | K | 97.6 | Very high | 96.9 | Very high | 135 Ų | 135 | 100.9 Ų | 100.9 | 59% | 0.587 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.2 | -43.6 | 179 | -173.4 | 179.2 | 177.8 | -176.2 | 0 | 111.5 | E26 A27 A32 E33 D34 | E26-K30 WeakPolarHBondContact O-CB 3.5Å; E26-K30 PolarHBondContact O-N 3.25Å; A27-K30 PolarHBondContact O-N 2.91Å; K30-A32 VanDerWaalsContact C-N 3.31Å; K30-A32 PolarHBondContact O-N 3Å; K30-E33 PolarHBondContact O-N 3.18Å; K30-D34 PolarHBondContact O-N 2.9Å |
| 31 | A | 97.4 | Very high | 96.9 | Very high | 41 Ų | 41 | 101.9 Ų | 101.9 | 34% | 0.339 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.3 | -38.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | A27 D28 K29 R35 | A27-A31 PolarHBondContact O-N 3.05Å; D28-A31 PolarHBondContact O-N 3.01Å; K29-A31 VanDerWaalsContact C-N 3.34Å; K29-A31 PolarHBondContact O-N 2.99Å; A31-R35 VanDerWaalsContact O-CG 3.28Å; A31-R35 WeakPolarHBondContact O-CG 3.28Å; A31-R35 PolarHBondContact O-N 3.28Å; A31-R35 VanDerWaalsContact O-N 3.13Å |
| 32 | A | 96.6 | Very high | 96.9 | Very high | 60 Ų | 60 | 97.9 Ų | 97.9 | 50% | 0.496 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -68.4 | -42 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | D28 K29 K30 R35 S36 | D28-A32 WeakPolarHBondContact O-CB 3.49Å; D28-A32 PolarHBondContact O-N 3.49Å; K29-A32 PolarHBondContact O-N 3.33Å; K30-A32 VanDerWaalsContact C-N 3.31Å; K30-A32 PolarHBondContact O-N 3Å; A32-R35 PolarHBondContact O-N 3.42Å; A32-S36 PolarHBondContact O-N 3.12Å |
| 33 | E | 96.9 | Very high | 96.9 | Very high | 85 Ų | 85 | 100.5 Ų | 100.5 | 40% | 0.397 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.3 | -43.3 | 176.1 | -74.5 | 178.9 | 176.1 | 0 | 0 | 111.9 | K29 K30 R35 S36 K37 | K29-E33 WeakPolarHBondContact CE-OE1 3.47Å; K29-E33 HydrophobicContact CG-CG 4.46Å; K29-E33 IonicContact NZ-OE1 3.91Å; K29-E33 WeakPolarHBondContact O-CG 3.26Å; K29-E33 PolarHBondContact O-N 2.76Å; K30-E33 PolarHBondContact O-N 3.18Å; E33-R35 VanDerWaalsContact C-N 3.34Å; E33-R35 PolarHBondContact O-N 2.94Å; E33-S36 WeakPolarHBondContact O-CB 3.42Å; E33-S36 PolarHBondContact O-N 3.44Å; E33-K37 WeakPolarHBondContact O-CG 3.46Å; E33-K37 PolarHBondContact O-N 3.48Å |
| 34 | D | 97.6 | Very high | 96.9 | Very high | 71 Ų | 71 | 97.7 Ų | 97.7 | 38% | 0.38 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.9 | -39.2 | 177.8 | -71.4 | -20.1 | 0 | 0 | 0 | 111.5 | K30 K37 Q38 | K30-D34 PolarHBondContact O-N 2.9Å; D34-K37 PolarHBondContact O-N 3.21Å; D34-Q38 WeakPolarHBondContact O-CG 3.5Å; D34-Q38 PolarHBondContact O-N 3Å; D34-Q38 VanDerWaalsContact O-N 3.13Å |
| 35 | R | 96.8 | Very high | 97 | Very high | 171 Ų | 171 | 95.3 Ų | 95.3 | 65% | 0.645 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.8 | -40.2 | 172.2 | -72.7 | 174.4 | -172.4 | 175.5 | 4.9 | 112.4 | A31 A32 E33 Q38 L39 | A31-R35 VanDerWaalsContact O-CG 3.28Å; A31-R35 WeakPolarHBondContact O-CG 3.28Å; A31-R35 PolarHBondContact O-N 3.28Å; A31-R35 VanDerWaalsContact O-N 3.13Å; A32-R35 PolarHBondContact O-N 3.42Å; E33-R35 VanDerWaalsContact C-N 3.34Å; E33-R35 PolarHBondContact O-N 2.94Å; R35-Q38 PolarHBondContact O-N 2.86Å; R35-L39 WeakPolarHBondContact O-CG 3.39Å; R35-L39 PolarHBondContact O-N 2.96Å |
| 36 | S | 95.9 | Very high | 96.9 | Very high | 54 Ų | 54 | 97.4 Ų | 97.4 | 38% | 0.378 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.9 | -47.2 | 176.9 | -165 | 0 | 0 | 0 | 0 | 110.9 | A32 E33 Q38 L39 E40 | A32-S36 PolarHBondContact O-N 3.12Å; E33-S36 WeakPolarHBondContact O-CB 3.42Å; E33-S36 PolarHBondContact O-N 3.44Å; S36-Q38 PolarHBondContact O-N 3.23Å; S36-L39 PolarHBondContact O-N 2.69Å; S36-E40 WeakPolarHBondContact O-CG 3.48Å; S36-E40 PolarHBondContact O-N 3.1Å; S36-E40 PolarHBondContact OG-OE1 3.39Å |
| 37 | K | 97.3 | Very high | 96.9 | Very high | 111 Ų | 111 | 96.4 Ų | 96.4 | 48% | 0.483 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -59.9 | -44.1 | 178.2 | -69.9 | 170.6 | -172.7 | 163.9 | 0 | 112.2 | E33 D34 L39 E40 D41 | E33-K37 WeakPolarHBondContact O-CG 3.46Å; E33-K37 PolarHBondContact O-N 3.48Å; D34-K37 PolarHBondContact O-N 3.21Å; K37-L39 VanDerWaalsContact C-N 3.33Å; K37-L39 PolarHBondContact O-N 3.33Å; K37-E40 PolarHBondContact O-N 3.37Å; K37-D41 PolarHBondContact O-N 2.9Å |
| 38 | Q | 97.1 | Very high | 96.8 | Very high | 124 Ų | 124 | 101 Ų | 101 | 58% | 0.579 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -58.8 | -45.4 | 176.1 | -73.5 | 175.1 | -11.9 | 0 | 0 | 111.8 | D34 R35 S36 D41 E42 | D34-Q38 WeakPolarHBondContact O-CG 3.5Å; D34-Q38 PolarHBondContact O-N 3Å; D34-Q38 VanDerWaalsContact O-N 3.13Å; R35-Q38 PolarHBondContact O-N 2.86Å; S36-Q38 PolarHBondContact O-N 3.23Å; Q38-D41 PolarHBondContact O-N 3.31Å; Q38-E42 WeakPolarHBondContact O-CG 3.41Å; Q38-E42 PolarHBondContact O-N 3.41Å |
| 39 | L | 96.8 | Very high | 96.8 | Very high | 103 Ų | 103 | 103.1 Ų | 103.1 | 54% | 0.539 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -66.6 | -37.5 | 178.2 | -69.4 | 172.5 | 0 | 0 | 0 | 112.3 | R35 S36 K37 E42 L43 | R35-L39 WeakPolarHBondContact O-CG 3.39Å; R35-L39 PolarHBondContact O-N 2.96Å; S36-L39 PolarHBondContact O-N 2.69Å; K37-L39 VanDerWaalsContact C-N 3.33Å; K37-L39 PolarHBondContact O-N 3.33Å; L39-E42 PolarHBondContact O-N 2.86Å; L39-L43 WeakPolarHBondContact O-CB 3.49Å; L39-L43 VanDerWaalsContact O-CG 3.25Å; L39-L43 WeakPolarHBondContact O-CG 3.35Å; L39-L43 PolarHBondContact O-N 3.42Å |
| 40 | E | 96.6 | Very high | 96.7 | Very high | 109 Ų | 109 | 101.5 Ų | 101.5 | 51% | 0.509 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.5 | -44.6 | 174.7 | -74.1 | 165.9 | -146.7 | 0 | 0 | 111.6 | S36 K37 L43 V44 | S36-E40 WeakPolarHBondContact O-CG 3.48Å; S36-E40 PolarHBondContact O-N 3.1Å; S36-E40 PolarHBondContact OG-OE1 3.39Å; K37-E40 PolarHBondContact O-N 3.37Å; E40-L43 PolarHBondContact O-N 3.19Å; E40-V44 WeakPolarHBondContact O-CG2 3.06Å; E40-V44 PolarHBondContact O-N 3.1Å |
| 41 | D | 97.3 | Very high | 96.7 | Very high | 121 Ų | 121 | 101.4 Ų | 101.4 | 65% | 0.647 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -63.9 | -42.4 | 176 | -75.2 | -24.9 | 0 | 0 | 0 | 112 | K37 Q38 V44 S45 | K37-D41 PolarHBondContact O-N 2.9Å; Q38-D41 PolarHBondContact O-N 3.31Å; D41-V44 PolarHBondContact O-N 3.5Å; D41-S45 WeakPolarHBondContact O-CB 3.28Å; D41-S45 PolarHBondContact O-N 3.49Å |
| 42 | E | 96.4 | Very high | 96.5 | Very high | 117 Ų | 117 | 100.9 Ų | 100.9 | 55% | 0.547 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.4 | -42.6 | 174.9 | -76.7 | -179 | -170.5 | 0 | 0 | 111.9 | Q38 L39 V44 S45 L46 | Q38-E42 WeakPolarHBondContact O-CG 3.41Å; Q38-E42 PolarHBondContact O-N 3.41Å; L39-E42 PolarHBondContact O-N 2.86Å; E42-V44 PolarHBondContact O-N 2.92Å; E42-S45 WeakPolarHBondContact O-CB 3.32Å; E42-S45 PolarHBondContact O-N 3.05Å; E42-L46 WeakPolarHBondContact O-CB 3.41Å; E42-L46 WeakPolarHBondContact O-CG 3.42Å; E42-L46 PolarHBondContact O-N 2.86Å |
| 43 | L | 96.6 | Very high | 96.4 | Very high | 102 Ų | 102 | 101.8 Ų | 101.8 | 53% | 0.534 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.3 | -45.2 | 176.1 | -78.8 | 173 | 0 | 0 | 0 | 111.6 | L39 E40 S45 L46 Q47 | L39-L43 WeakPolarHBondContact O-CB 3.49Å; L39-L43 VanDerWaalsContact O-CG 3.25Å; L39-L43 WeakPolarHBondContact O-CG 3.35Å; L39-L43 PolarHBondContact O-N 3.42Å; E40-L43 PolarHBondContact O-N 3.19Å; L43-S45 VanDerWaalsContact C-N 3.33Å; L43-S45 PolarHBondContact O-N 3.34Å; L43-L46 PolarHBondContact O-N 3.48Å; L43-Q47 WeakPolarHBondContact O-CB 3.44Å; L43-Q47 WeakPolarHBondContact O-CG 3.5Å; L43-Q47 PolarHBondContact O-N 3.04Å |
| 44 | V | 97.5 | Very high | 96.3 | Very high | 69 Ų | 69 | 102.1 Ų | 102.1 | 42% | 0.418 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63 | -42 | 176.8 | 171.7 | 0 | 0 | 0 | 0 | 111 | E40 D41 E42 Q47 K48 | E40-V44 WeakPolarHBondContact O-CG2 3.06Å; E40-V44 PolarHBondContact O-N 3.1Å; D41-V44 PolarHBondContact O-N 3.5Å; E42-V44 PolarHBondContact O-N 2.92Å; V44-Q47 PolarHBondContact O-N 3.25Å; V44-K48 HydrophobicContact CG1-CD 4.44Å; V44-K48 WeakPolarHBondContact O-CG 3.31Å; V44-K48 PolarHBondContact O-N 2.97Å |
| 45 | S | 96.8 | Very high | 96.2 | Very high | 56 Ų | 56 | 103 Ų | 103 | 39% | 0.392 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.9 | -46.2 | 176.2 | -177.3 | 0 | 0 | 0 | 0 | 111.9 | D41 E42 L43 K48 K49 | D41-S45 WeakPolarHBondContact O-CB 3.28Å; D41-S45 PolarHBondContact O-N 3.49Å; E42-S45 WeakPolarHBondContact O-CB 3.32Å; E42-S45 PolarHBondContact O-N 3.05Å; L43-S45 VanDerWaalsContact C-N 3.33Å; L43-S45 PolarHBondContact O-N 3.34Å; S45-K48 PolarHBondContact O-N 2.89Å; S45-K49 WeakPolarHBondContact O-CG 3.47Å; S45-K49 PolarHBondContact O-N 2.88Å; S45-K49 VanDerWaalsContact O-N 3.07Å |
| 46 | L | 95.9 | Very high | 96.2 | Very high | 102 Ų | 102 | 100 Ų | 100 | 53% | 0.534 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.5 | -41.9 | 177.5 | -72.4 | 173.9 | 0 | 0 | 0 | 112 | E42 L43 K48 K49 L50 | E42-L46 WeakPolarHBondContact O-CB 3.41Å; E42-L46 WeakPolarHBondContact O-CG 3.42Å; E42-L46 PolarHBondContact O-N 2.86Å; L43-L46 PolarHBondContact O-N 3.48Å; L46-K48 VanDerWaalsContact C-N 3.31Å; L46-K48 PolarHBondContact O-N 3.33Å; L46-K49 PolarHBondContact O-N 3.48Å; L46-L50 WeakPolarHBondContact O-CB 3.49Å; L46-L50 PolarHBondContact O-N 3.2Å |
| 47 | Q | 95.8 | Very high | 96.1 | Very high | 119 Ų | 119 | 102.7 Ų | 102.7 | 56% | 0.556 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61.7 | -38.6 | 175.7 | -77.2 | -178.5 | 0.5 | 0 | 0 | 112.4 | L43 V44 L50 K51 | L43-Q47 WeakPolarHBondContact O-CB 3.44Å; L43-Q47 WeakPolarHBondContact O-CG 3.5Å; L43-Q47 PolarHBondContact O-N 3.04Å; V44-Q47 PolarHBondContact O-N 3.25Å; Q47-L50 PolarHBondContact O-N 3.07Å; Q47-K51 WeakPolarHBondContact O-CG 3.38Å; Q47-K51 PolarHBondContact O-N 3.05Å |
| 48 | K | 97.1 | Very high | 96.1 | Very high | 150 Ų | 150 | 102 Ų | 102 | 65% | 0.652 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -64.6 | -42.1 | 174.7 | -73.6 | 174.6 | -178.9 | 175.9 | 0 | 111.8 | V44 S45 L46 K51 G52 | V44-K48 HydrophobicContact CG1-CD 4.44Å; V44-K48 WeakPolarHBondContact O-CG 3.31Å; V44-K48 PolarHBondContact O-N 2.97Å; S45-K48 PolarHBondContact O-N 2.89Å; L46-K48 VanDerWaalsContact C-N 3.31Å; L46-K48 PolarHBondContact O-N 3.33Å; K48-K51 PolarHBondContact O-N 3.43Å; K48-G52 PolarHBondContact O-N 3.13Å |
| 49 | K | 96.1 | Very high | 96 | Very high | 136 Ų | 136 | 102.5 Ų | 102.5 | 59% | 0.591 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -62.7 | -43.9 | 175.1 | -70.9 | 177 | -178.4 | 177 | 0 | 111.4 | S45 L46 K51 G52 T53 | S45-K49 WeakPolarHBondContact O-CG 3.47Å; S45-K49 PolarHBondContact O-N 2.88Å; S45-K49 VanDerWaalsContact O-N 3.07Å; L46-K49 PolarHBondContact O-N 3.48Å; K49-K51 PolarHBondContact O-N 3.35Å; K49-G52 PolarHBondContact O-N 3.49Å; K49-T53 WeakPolarHBondContact O-CG2 3.29Å; K49-T53 PolarHBondContact O-N 3.37Å; K49-T53 PolarHBondContact O-OG1 3.42Å |
| 50 | L | 95.2 | Very high | 95.9 | Very high | 95 Ų | 95 | 105.7 Ų | 105.7 | 50% | 0.497 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -57.8 | -50.1 | 177.9 | -176 | 68.7 | 0 | 0 | 0 | 111.1 | L46 Q47 G52 T53 E54 | L46-L50 WeakPolarHBondContact O-CB 3.49Å; L46-L50 PolarHBondContact O-N 3.2Å; Q47-L50 PolarHBondContact O-N 3.07Å; L50-G52 VanDerWaalsContact C-N 3.31Å; L50-G52 PolarHBondContact O-N 3.41Å; L50-T53 WeakPolarHBondContact CA-OG1 3.48Å; L50-T53 PolarHBondContact O-N 3.31Å; L50-T53 VanDerWaalsContact O-N 3.1Å; L50-T53 PolarHBondContact O-OG1 3.05Å; L50-E54 WeakPolarHBondContact O-CG 3.34Å; L50-E54 PolarHBondContact O-N 3.47Å |
| 51 | K | 96.3 | Very high | 95.7 | Very high | 134 Ų | 134 | 102.7 Ų | 102.7 | 58% | 0.583 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -59.2 | -41.9 | 175.8 | -72.2 | -176.2 | 178.8 | -174.7 | 0 | 112.6 | Q47 K48 K49 T53 E54 D55 | Q47-K51 WeakPolarHBondContact O-CG 3.38Å; Q47-K51 PolarHBondContact O-N 3.05Å; K48-K51 PolarHBondContact O-N 3.43Å; K49-K51 PolarHBondContact O-N 3.35Å; K51-T53 VanDerWaalsContact C-N 3.32Å; K51-T53 PolarHBondContact O-N 3.13Å; K51-E54 PolarHBondContact O-N 3.42Å; K51-D55 VanDerWaalsContact O-CG 3.29Å; K51-D55 PolarHBondContact O-N 3.38Å |
| 52 | G | 94.9 | Very high | 95.6 | Very high | 29 Ų | 29 | 103 Ų | 103 | 30% | 0.299 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.1 | -42.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | K48 K49 L50 E56 | K48-G52 PolarHBondContact O-N 3.13Å; K49-G52 PolarHBondContact O-N 3.49Å; L50-G52 VanDerWaalsContact C-N 3.31Å; L50-G52 PolarHBondContact O-N 3.41Å; G52-E56 WeakPolarHBondContact O-CG 3.43Å; G52-E56 PolarHBondContact O-N 2.97Å; G52-E56 VanDerWaalsContact O-N 3.1Å |
| 53 | T | 94.3 | Very high | 95.5 | Very high | 80 Ų | 80 | 100 Ų | 100 | 49% | 0.491 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -70.3 | -33 | 176.2 | 54.9 | 0 | 0 | 0 | 0 | 113.2 | K49 L50 K51 L57 | K49-T53 WeakPolarHBondContact O-CG2 3.29Å; K49-T53 PolarHBondContact O-N 3.37Å; K49-T53 PolarHBondContact O-OG1 3.42Å; L50-T53 WeakPolarHBondContact CA-OG1 3.48Å; L50-T53 PolarHBondContact O-N 3.31Å; L50-T53 VanDerWaalsContact O-N 3.1Å; L50-T53 PolarHBondContact O-OG1 3.05Å; K51-T53 VanDerWaalsContact C-N 3.32Å; K51-T53 PolarHBondContact O-N 3.13Å; T53-L57 WeakPolarHBondContact O-CB 3.49Å; T53-L57 PolarHBondContact O-N 2.88Å |
| 54 | E | 94.4 | Very high | 95.4 | Very high | 91 Ų | 91 | 100 Ų | 100 | 43% | 0.425 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.1 | -48.3 | 173.6 | -71.8 | 168.8 | 165.6 | 0 | 0 | 110.5 | L50 K51 E56 L57 D58 | L50-E54 WeakPolarHBondContact O-CG 3.34Å; L50-E54 PolarHBondContact O-N 3.47Å; K51-E54 PolarHBondContact O-N 3.42Å; E54-E56 VanDerWaalsContact C-N 3.28Å; E54-E56 PolarHBondContact O-N 2.97Å; E54-L57 WeakPolarHBondContact O-CB 3.36Å; E54-L57 PolarHBondContact O-N 3.44Å; E54-L57 VanDerWaalsContact O-N 3.12Å; E54-D58 PolarHBondContact O-N 3.38Å |
| 55 | D | 96.3 | Very high | 95.2 | Very high | 91 Ų | 91 | 102.9 Ų | 102.9 | 49% | 0.487 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -60.6 | -36.6 | 177.2 | -69 | -20 | 0 | 0 | 0 | 112.3 | K51 K59 | K51-D55 VanDerWaalsContact O-CG 3.29Å; K51-D55 PolarHBondContact O-N 3.38Å; D55-K59 VanDerWaalsContact O-CG 3.29Å; D55-K59 WeakPolarHBondContact O-CG 3.49Å; D55-K59 PolarHBondContact O-N 3.02Å |
| 56 | E | 95 | Very high | 95.1 | Very high | 107 Ų | 107 | 104.4 Ų | 104.4 | 50% | 0.5 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -67.8 | -43.5 | 174.5 | -76.5 | 176.3 | -172.6 | 0 | 0 | 111.8 | G52 E54 D58 K59 Y60 | G52-E56 WeakPolarHBondContact O-CG 3.43Å; G52-E56 PolarHBondContact O-N 2.97Å; G52-E56 VanDerWaalsContact O-N 3.1Å; E54-E56 VanDerWaalsContact C-N 3.28Å; E54-E56 PolarHBondContact O-N 2.97Å; E56-D58 VanDerWaalsContact C-N 3.31Å; E56-D58 PolarHBondContact O-N 3.03Å; E56-K59 PolarHBondContact O-N 3.35Å; E56-Y60 HydrophobicContact CB-CE2 4.39Å; E56-Y60 WeakPolarHBondContact O-CD2 3.33Å; E56-Y60 PolarHBondContact O-N 3.27Å |
| 57 | L | 94.6 | Very high | 95 | Very high | 110 Ų | 110 | 102.1 Ų | 102.1 | 58% | 0.576 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -60.6 | -41.8 | 177 | -179.8 | 63.1 | 0 | 0 | 0 | 111.6 | T53 E54 Y60 S61 | T53-L57 WeakPolarHBondContact O-CB 3.49Å; T53-L57 PolarHBondContact O-N 2.88Å; E54-L57 WeakPolarHBondContact O-CB 3.36Å; E54-L57 PolarHBondContact O-N 3.44Å; E54-L57 VanDerWaalsContact O-N 3.12Å; L57-Y60 PolarHBondContact O-N 3.19Å; L57-S61 VanDerWaalsContact O-CB 3.31Å; L57-S61 WeakPolarHBondContact O-CB 3.46Å; L57-S61 PolarHBondContact O-N 2.91Å; L57-S61 PolarHBondContact O-OG 3.32Å |
| 58 | D | 96.4 | Very high | 94.6 | Very high | 96 Ų | 96 | 101.4 Ų | 101.4 | 51% | 0.513 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.9 | -46 | 176.7 | -76.6 | -19.1 | 0 | 0 | 0 | 111.1 | E54 E56 Y60 S61 E62 | E54-D58 PolarHBondContact O-N 3.38Å; E56-D58 VanDerWaalsContact C-N 3.31Å; E56-D58 PolarHBondContact O-N 3.03Å; D58-Y60 PolarHBondContact O-N 3.07Å; D58-S61 WeakPolarHBondContact O-CB 3.44Å; D58-S61 PolarHBondContact O-N 2.93Å; D58-E62 WeakPolarHBondContact O-CG 3.48Å; D58-E62 PolarHBondContact O-N 2.96Å |
| 59 | K | 96.6 | Very high | 94.4 | Very high | 135 Ų | 135 | 100.1 Ų | 100.1 | 59% | 0.587 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -58.6 | -46 | 175.7 | -71.7 | 167.1 | -171 | 163.2 | 0 | 112.6 | D55 E56 S61 E62 A63 | D55-K59 VanDerWaalsContact O-CG 3.29Å; D55-K59 WeakPolarHBondContact O-CG 3.49Å; D55-K59 PolarHBondContact O-N 3.02Å; E56-K59 PolarHBondContact O-N 3.35Å; K59-S61 VanDerWaalsContact C-N 3.31Å; K59-E62 PolarHBondContact O-N 2.94Å; K59-A63 WeakPolarHBondContact O-CB 3.4Å; K59-A63 PolarHBondContact O-N 2.88Å |
| 60 | Y | 93.3 | Very high | 94.2 | Very high | 170 Ų | 170 | 100.6 Ų | 100.6 | 67% | 0.667 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -67.3 | -35 | 178.7 | -73.1 | -58.9 | 0 | 0 | 0 | 112 | E56 L57 D58 A63 L64 | E56-Y60 HydrophobicContact CB-CE2 4.39Å; E56-Y60 WeakPolarHBondContact O-CD2 3.33Å; E56-Y60 PolarHBondContact O-N 3.27Å; L57-Y60 PolarHBondContact O-N 3.19Å; D58-Y60 PolarHBondContact O-N 3.07Å; Y60-A63 PolarHBondContact O-N 2.97Å; Y60-L64 WeakPolarHBondContact O-CB 3.4Å; Y60-L64 PolarHBondContact O-N 3.45Å |
| 61 | S | 92.4 | Very high | 93.8 | Very high | 46 Ų | 46 | 101 Ų | 101 | 32% | 0.322 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -67.1 | -40.7 | 177.5 | -62 | 0 | 0 | 0 | 0 | 112.1 | L57 D58 K59 K65 | L57-S61 VanDerWaalsContact O-CB 3.31Å; L57-S61 WeakPolarHBondContact O-CB 3.46Å; L57-S61 PolarHBondContact O-N 2.91Å; L57-S61 PolarHBondContact O-OG 3.32Å; D58-S61 WeakPolarHBondContact O-CB 3.44Å; D58-S61 PolarHBondContact O-N 2.93Å; K59-S61 VanDerWaalsContact C-N 3.31Å; S61-K65 WeakPolarHBondContact O-CG 3.36Å; S61-K65 PolarHBondContact O-N 3.01Å |
| 62 | E | 95.5 | Very high | 93.4 | Very high | 128 Ų | 128 | 99.3 Ų | 99.3 | 60% | 0.598 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -65.5 | -47.9 | 173.3 | -70.9 | -179.1 | 171.9 | 0 | 0 | 111.6 | D58 K59 L64 K65 D66 | D58-E62 WeakPolarHBondContact O-CG 3.48Å; D58-E62 PolarHBondContact O-N 2.96Å; K59-E62 PolarHBondContact O-N 2.94Å; E62-L64 PolarHBondContact O-N 3.42Å; E62-K65 PolarHBondContact O-N 3.23Å; E62-K65 VanDerWaalsContact O-N 3.1Å; E62-D66 PolarHBondContact O-N 3.29Å |
| 63 | A | 94.5 | Very high | 93.1 | Very high | 55 Ų | 55 | 102.5 Ų | 102.5 | 46% | 0.455 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -59.3 | -36.1 | 178 | 0 | 0 | 0 | 0 | 0 | 112.6 | K59 Y60 A67 | K59-A63 WeakPolarHBondContact O-CB 3.4Å; K59-A63 PolarHBondContact O-N 2.88Å; Y60-A63 PolarHBondContact O-N 2.97Å; A63-A67 WeakPolarHBondContact O-CB 3.25Å; A63-A67 PolarHBondContact O-N 2.88Å |
| 64 | L | 93.6 | Very high | 92.7 | Very high | 102 Ų | 102 | 101.4 Ų | 101.4 | 53% | 0.534 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.2 | -45.4 | 175.3 | -179.5 | 63.5 | 0 | 0 | 0 | 111.6 | Y60 E62 A67 Q68 | Y60-L64 WeakPolarHBondContact O-CB 3.4Å; Y60-L64 PolarHBondContact O-N 3.45Å; E62-L64 PolarHBondContact O-N 3.42Å; L64-A67 PolarHBondContact O-N 3.19Å; L64-Q68 HydrophobicContact CD1-CG 4.38Å; L64-Q68 WeakPolarHBondContact O-CB 3.39Å; L64-Q68 VanDerWaalsContact O-CG 3.28Å; L64-Q68 WeakPolarHBondContact O-CG 3.35Å; L64-Q68 PolarHBondContact O-N 3.22Å |
| 65 | K | 95.1 | Very high | 92.2 | Very high | 129 Ų | 129 | 102.3 Ų | 102.3 | 56% | 0.561 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -60.2 | -47.4 | 177 | -71.7 | 172.8 | -176.2 | 172.4 | 0 | 111.1 | S61 E62 A67 Q68 E69 | S61-K65 WeakPolarHBondContact O-CG 3.36Å; S61-K65 PolarHBondContact O-N 3.01Å; E62-K65 PolarHBondContact O-N 3.23Å; E62-K65 VanDerWaalsContact O-N 3.1Å; K65-A67 VanDerWaalsContact C-N 3.3Å; K65-A67 PolarHBondContact O-N 3.09Å; K65-Q68 WeakPolarHBondContact O-CB 3.28Å; K65-Q68 PolarHBondContact O-N 3.47Å; K65-Q68 VanDerWaalsContact O-N 3.16Å; K65-E69 WeakPolarHBondContact O-CG 3.4Å; K65-E69 PolarHBondContact O-N 3.29Å |
| 66 | D | 93.8 | Very high | 91.5 | Very high | 88 Ų | 88 | 103.6 Ų | 103.6 | 47% | 0.471 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -59 | -40.4 | 177.2 | -78.2 | -1.1 | 0 | 0 | 0 | 112.6 | E62 K70 | E62-D66 PolarHBondContact O-N 3.29Å; D66-K70 VanDerWaalsContact O-CG 3.32Å; D66-K70 WeakPolarHBondContact O-CG 3.45Å; D66-K70 PolarHBondContact O-N 2.93Å; D66-K70 VanDerWaalsContact O-N 3.14Å |
| 67 | A | 93 | Very high | 90.9 | Very high | 54 Ų | 54 | 105.3 Ų | 105.3 | 45% | 0.446 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -67.8 | -41.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | A63 L64 K65 K70 L71 | A63-A67 WeakPolarHBondContact O-CB 3.25Å; A63-A67 PolarHBondContact O-N 2.88Å; L64-A67 PolarHBondContact O-N 3.19Å; K65-A67 VanDerWaalsContact C-N 3.3Å; K65-A67 PolarHBondContact O-N 3.09Å; A67-K70 PolarHBondContact O-N 3.27Å; A67-L71 WeakPolarHBondContact O-CB 3.43Å; A67-L71 PolarHBondContact O-N 3.47Å |
| 68 | Q | 88 | Confident | 90 | Very high | 104 Ų | 104 | 103.1 Ų | 103.1 | 49% | 0.486 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62.7 | -44.7 | 175.6 | -74.4 | 174.2 | -24.1 | 0 | 0 | 111.5 | L64 K65 K70 L71 E72 | L64-Q68 HydrophobicContact CD1-CG 4.38Å; L64-Q68 WeakPolarHBondContact O-CB 3.39Å; L64-Q68 VanDerWaalsContact O-CG 3.28Å; L64-Q68 WeakPolarHBondContact O-CG 3.35Å; L64-Q68 PolarHBondContact O-N 3.22Å; K65-Q68 WeakPolarHBondContact O-CB 3.28Å; K65-Q68 PolarHBondContact O-N 3.47Å; K65-Q68 VanDerWaalsContact O-N 3.16Å; Q68-K70 VanDerWaalsContact C-N 3.34Å; Q68-K70 PolarHBondContact O-N 2.95Å; Q68-L71 WeakPolarHBondContact O-CB 3.38Å; Q68-L71 PolarHBondContact O-N 2.99Å; Q68-E72 PolarHBondContact O-N 3.43Å |
| 69 | E | 92.8 | Very high | 88.8 | Confident | 122 Ų | 122 | 102.7 Ų | 102.7 | 57% | 0.57 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -61.2 | -42.4 | 176.6 | -73.4 | -174.8 | -177.3 | 0 | 0 | 112.2 | K65 L71 E72 L73 | K65-E69 WeakPolarHBondContact O-CG 3.4Å; K65-E69 PolarHBondContact O-N 3.29Å; E69-L71 VanDerWaalsContact C-N 3.33Å; E69-L71 PolarHBondContact O-N 2.96Å; E69-E72 PolarHBondContact O-N 3.25Å; E69-L73 VanDerWaalsContact O-CG 3.28Å; E69-L73 WeakPolarHBondContact O-CG 3.25Å; E69-L73 PolarHBondContact O-N 3.41Å |
| 70 | K | 91.6 | Very high | 87.7 | Confident | 146 Ų | 146 | 100.1 Ų | 100.1 | 64% | 0.635 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -63.2 | -39.8 | 175.7 | -74.2 | 170.1 | -173.6 | 164.9 | 0 | 112.1 | D66 A67 Q68 L73 A74 | D66-K70 VanDerWaalsContact O-CG 3.32Å; D66-K70 WeakPolarHBondContact O-CG 3.45Å; D66-K70 PolarHBondContact O-N 2.93Å; D66-K70 VanDerWaalsContact O-N 3.14Å; A67-K70 PolarHBondContact O-N 3.27Å; Q68-K70 VanDerWaalsContact C-N 3.34Å; Q68-K70 PolarHBondContact O-N 2.95Å; K70-L73 PolarHBondContact O-N 3.3Å; K70-A74 WeakPolarHBondContact O-CB 3.42Å; K70-A74 PolarHBondContact O-N 2.9Å |
| 71 | L | 87.3 | Confident | 86.6 | Confident | 103 Ų | 103 | 96.3 Ų | 96.3 | 54% | 0.539 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.4 | -50.4 | 175.7 | -175.1 | 110.6 | 0 | 0 | 0 | 110.6 | A67 Q68 E69 L73 A74 E75 | A67-L71 WeakPolarHBondContact O-CB 3.43Å; A67-L71 PolarHBondContact O-N 3.47Å; Q68-L71 WeakPolarHBondContact O-CB 3.38Å; Q68-L71 PolarHBondContact O-N 2.99Å; E69-L71 VanDerWaalsContact C-N 3.33Å; E69-L71 PolarHBondContact O-N 2.96Å; L71-L73 VanDerWaalsContact C-N 3.28Å; L71-L73 PolarHBondContact O-N 2.95Å; L71-A74 WeakPolarHBondContact O-CB 3.47Å; L71-A74 PolarHBondContact O-N 3.42Å; L71-E75 WeakPolarHBondContact O-CG 3.46Å; L71-E75 PolarHBondContact O-N 3.04Å |
| 72 | E | 88.6 | Confident | 85 | Confident | 100 Ų | 100 | 96.9 Ų | 96.9 | 47% | 0.467 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -57.6 | -41.2 | 177.5 | -75.6 | -166.5 | -166.3 | 0 | 0 | 112.4 | Q68 E69 A74 E75 K76 | Q68-E72 PolarHBondContact O-N 3.43Å; E69-E72 PolarHBondContact O-N 3.25Å; E72-A74 VanDerWaalsContact C-N 3.33Å; E72-E75 PolarHBondContact O-N 3.26Å; E72-K76 WeakPolarHBondContact O-CB 3.41Å; E72-K76 VanDerWaalsContact O-CG 3.26Å; E72-K76 WeakPolarHBondContact O-CG 3.39Å; E72-K76 PolarHBondContact O-N 3.27Å; E72-K76 IonicContact OE2-NZ 3.79Å; E72-K76 PolarHBondContact OE2-NZ 3.16Å |
| 73 | L | 88.3 | Confident | 83.4 | Confident | 96 Ų | 96 | 93.5 Ų | 93.5 | 50% | 0.503 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.4 | -38.8 | 176.5 | -72.7 | 171.3 | 0 | 0 | 0 | 111.8 | E69 K70 L71 K77 | E69-L73 VanDerWaalsContact O-CG 3.28Å; E69-L73 WeakPolarHBondContact O-CG 3.25Å; E69-L73 PolarHBondContact O-N 3.41Å; K70-L73 PolarHBondContact O-N 3.3Å; L71-L73 VanDerWaalsContact C-N 3.28Å; L71-L73 PolarHBondContact O-N 2.95Å; L73-K77 WeakPolarHBondContact O-CB 3.4Å; L73-K77 VanDerWaalsContact O-CG 3.26Å; L73-K77 WeakPolarHBondContact O-CG 3.44Å; L73-K77 PolarHBondContact O-N 3.06Å; L73-K77 VanDerWaalsContact O-N 3.08Å |
| 74 | A | 85.6 | Confident | 81.4 | Confident | 57 Ų | 57 | 99 Ų | 99 | 47% | 0.471 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -67.1 | -42.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | K70 L71 E72 K77 A78 | K70-A74 WeakPolarHBondContact O-CB 3.42Å; K70-A74 PolarHBondContact O-N 2.9Å; L71-A74 WeakPolarHBondContact O-CB 3.47Å; L71-A74 PolarHBondContact O-N 3.42Å; E72-A74 VanDerWaalsContact C-N 3.33Å; A74-K77 PolarHBondContact O-N 3Å; A74-A78 WeakPolarHBondContact O-CB 2.83Å; A74-A78 PolarHBondContact O-N 3.1Å |
| 75 | E | 83.3 | Confident | 79.5 | Confident | 109 Ų | 109 | 97.7 Ų | 97.7 | 51% | 0.509 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65 | -42.8 | 176.9 | -70.9 | 179.2 | 164 | 0 | 0 | 112.2 | L71 E72 K77 A78 T79 | L71-E75 WeakPolarHBondContact O-CG 3.46Å; L71-E75 PolarHBondContact O-N 3.04Å; E72-E75 PolarHBondContact O-N 3.26Å; E75-K77 VanDerWaalsContact C-N 3.32Å; E75-K77 PolarHBondContact O-N 3.24Å; E75-A78 PolarHBondContact O-N 2.87Å; E75-T79 WeakPolarHBondContact O-CB 3.4Å; E75-T79 WeakPolarHBondContact O-CG2 3.45Å; E75-T79 PolarHBondContact O-N 3Å; E75-T79 PolarHBondContact O-OG1 3.48Å |
| 76 | K | 83.3 | Confident | 77.4 | Confident | 118 Ų | 118 | 98.7 Ų | 98.7 | 51% | 0.513 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.7 | -40.9 | 173.6 | -74.1 | 167.8 | -171.5 | 156 | 0 | 111.7 | E72 T79 D80 | E72-K76 WeakPolarHBondContact O-CB 3.41Å; E72-K76 VanDerWaalsContact O-CG 3.26Å; E72-K76 WeakPolarHBondContact O-CG 3.39Å; E72-K76 PolarHBondContact O-N 3.27Å; E72-K76 IonicContact OE2-NZ 3.79Å; E72-K76 PolarHBondContact OE2-NZ 3.16Å; K76-T79 WeakPolarHBondContact CA-OG1 3.45Å; K76-T79 PolarHBondContact O-OG1 3.13Å; K76-D80 WeakPolarHBondContact O-CB 3.4Å; K76-D80 PolarHBondContact O-N 3.3Å |
| 77 | K | 82.3 | Confident | 75 | Confident | 144 Ų | 144 | 99.7 Ų | 99.7 | 63% | 0.626 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -66.6 | -44.9 | 175.5 | -74.2 | 172.4 | -176.9 | 179.2 | 0 | 111.9 | L73 A74 E75 T79 D80 V81 | L73-K77 WeakPolarHBondContact O-CB 3.4Å; L73-K77 VanDerWaalsContact O-CG 3.26Å; L73-K77 WeakPolarHBondContact O-CG 3.44Å; L73-K77 PolarHBondContact O-N 3.06Å; L73-K77 VanDerWaalsContact O-N 3.08Å; A74-K77 PolarHBondContact O-N 3Å; E75-K77 VanDerWaalsContact C-N 3.32Å; E75-K77 PolarHBondContact O-N 3.24Å; K77-T79 VanDerWaalsContact C-N 3.32Å; K77-T79 PolarHBondContact O-N 3.44Å; K77-D80 PolarHBondContact O-N 2.84Å; K77-V81 VanDerWaalsContact O-CG2 3.28Å; K77-V81 WeakPolarHBondContact O-CG2 3.35Å; K77-V81 PolarHBondContact O-N 2.9Å |
| 78 | A | 74.6 | Confident | 72.4 | Confident | 63 Ų | 63 | 102.4 Ų | 102.4 | 52% | 0.521 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.6 | -39 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | A74 E75 S82 | A74-A78 WeakPolarHBondContact O-CB 2.83Å; A74-A78 PolarHBondContact O-N 3.1Å; E75-A78 PolarHBondContact O-N 2.87Å; A78-S82 WeakPolarHBondContact O-CB 3.47Å; A78-S82 PolarHBondContact O-N 2.99Å |
| 79 | T | 72.5 | Confident | 70.7 | Confident | 88 Ų | 88 | 102.4 Ų | 102.4 | 54% | 0.54 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -71 | -39.6 | 176.2 | 49.3 | 0 | 0 | 0 | 0 | 112.7 | E75 K76 K77 V81 S82 A83 | E75-T79 WeakPolarHBondContact O-CB 3.4Å; E75-T79 WeakPolarHBondContact O-CG2 3.45Å; E75-T79 PolarHBondContact O-N 3Å; E75-T79 PolarHBondContact O-OG1 3.48Å; K76-T79 WeakPolarHBondContact CA-OG1 3.45Å; K76-T79 PolarHBondContact O-OG1 3.13Å; K77-T79 VanDerWaalsContact C-N 3.32Å; K77-T79 PolarHBondContact O-N 3.44Å; T79-V81 PolarHBondContact O-N 3.02Å; T79-S82 PolarHBondContact O-N 3.24Å; T79-A83 WeakPolarHBondContact O-CB 3.36Å; T79-A83 PolarHBondContact O-N 3.18Å |
| 80 | D | 72.7 | Confident | 68.3 | Low | 81 Ų | 81 | 103.7 Ų | 103.7 | 43% | 0.433 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -60.9 | -43.4 | 173.1 | -177.4 | -98 | 0 | 0 | 0 | 111.7 | K76 K77 A83 R84 | K76-D80 WeakPolarHBondContact O-CB 3.4Å; K76-D80 PolarHBondContact O-N 3.3Å; K77-D80 PolarHBondContact O-N 2.84Å; D80-A83 PolarHBondContact O-N 3.28Å; D80-R84 WeakPolarHBondContact O-CB 3.48Å; D80-R84 VanDerWaalsContact O-CG 3.31Å; D80-R84 WeakPolarHBondContact O-CG 3.38Å; D80-R84 PolarHBondContact O-N 3.49Å; D80-R84 WeakPolarHBondContact OD1-CD 3.49Å; D80-R84 IonicContact OD1-CZ 2.99Å; D80-R84 IonicContact OD1-NE 2.86Å; D80-R84 PolarHBondContact OD1-NE 3.09Å; D80-R84 IonicContact OD1-NH2 3.73Å; D80-R84 IonicContact OD2-NE 3.66Å |
| 81 | V | 70.2 | Confident | 66 | Low | 89 Ų | 89 | 102 Ų | 102 | 54% | 0.539 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -64.7 | -46.4 | 176.3 | 174.7 | 0 | 0 | 0 | 0 | 111.1 | K77 T79 A83 R84 S85 | K77-V81 VanDerWaalsContact O-CG2 3.28Å; K77-V81 WeakPolarHBondContact O-CG2 3.35Å; K77-V81 PolarHBondContact O-N 2.9Å; T79-V81 PolarHBondContact O-N 3.02Å; V81-A83 VanDerWaalsContact C-N 3.35Å; V81-A83 PolarHBondContact O-N 3.16Å; V81-R84 PolarHBondContact O-N 3.49Å; V81-S85 PolarHBondContact O-N 3.24Å; V81-S85 PolarHBondContact O-OG 3.43Å |
| 82 | S | 59.7 | Low | 63.8 | Low | 58 Ų | 58 | 102.9 Ų | 102.9 | 41% | 0.406 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -62.3 | -40.4 | 176.8 | 179.8 | 0 | 0 | 0 | 0 | 112.5 | A78 T79 S85 H86 | A78-S82 WeakPolarHBondContact O-CB 3.47Å; A78-S82 PolarHBondContact O-N 2.99Å; T79-S82 PolarHBondContact O-N 3.24Å; S82-S85 PolarHBondContact O-N 2.91Å; S82-H86 WeakPolarHBondContact O-CB 3.34Å; S82-H86 PolarHBondContact O-N 3.47Å; S82-H86 PolarHBondContact O-ND1 3Å |
| 83 | A | 60.4 | Low | 61.7 | Low | 58 Ų | 58 | 103.4 Ų | 103.4 | 48% | 0.479 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -68.1 | -41 | 178 | 0 | 0 | 0 | 0 | 0 | 111.6 | T79 D80 V81 S85 H86 C87 | T79-A83 WeakPolarHBondContact O-CB 3.36Å; T79-A83 PolarHBondContact O-N 3.18Å; D80-A83 PolarHBondContact O-N 3.28Å; V81-A83 VanDerWaalsContact C-N 3.35Å; V81-A83 PolarHBondContact O-N 3.16Å; A83-S85 VanDerWaalsContact C-N 3.35Å; A83-H86 PolarHBondContact O-N 2.93Å; A83-C87 WeakPolarHBondContact O-CB 3.35Å; A83-C87 PolarHBondContact O-N 3.11Å |
| 84 | R | 53.9 | Low | 59.7 | Low | 169 Ų | 169 | 103.5 Ų | 103.5 | 64% | 0.638 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -62.6 | -40.6 | 172.8 | -75.5 | 174.3 | -174.7 | -103 | -3.4 | 112 | D80 V81 F88 | D80-R84 WeakPolarHBondContact O-CB 3.48Å; D80-R84 VanDerWaalsContact O-CG 3.31Å; D80-R84 WeakPolarHBondContact O-CG 3.38Å; D80-R84 PolarHBondContact O-N 3.49Å; D80-R84 WeakPolarHBondContact OD1-CD 3.49Å; D80-R84 IonicContact OD1-CZ 2.99Å; D80-R84 IonicContact OD1-NE 2.86Å; D80-R84 PolarHBondContact OD1-NE 3.09Å; D80-R84 IonicContact OD1-NH2 3.73Å; D80-R84 IonicContact OD2-NE 3.66Å; V81-R84 PolarHBondContact O-N 3.49Å; R84-F88 PolarHBondContact O-N 3.35Å |
| 85 | S | 53.7 | Low | 57.4 | Low | 75 Ų | 75 | 111.7 Ų | 111.7 | 52% | 0.524 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -68 | -36.9 | 174.9 | -70.2 | 0 | 0 | 0 | 0 | 113 | V81 S82 A83 | V81-S85 PolarHBondContact O-N 3.24Å; V81-S85 PolarHBondContact O-OG 3.43Å; S82-S85 PolarHBondContact O-N 2.91Å; A83-S85 VanDerWaalsContact C-N 3.35Å |
| 86 | H | 50.4 | Low | 55.6 | Low | 150 Ų | 150 | 111.1 Ų | 111.1 | 69% | 0.694 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -74.6 | -31.3 | 176.5 | -86.3 | 91.4 | 0 | 0 | 0 | 113.5 | S82 A83 P89 | S82-H86 WeakPolarHBondContact O-CB 3.34Å; S82-H86 PolarHBondContact O-N 3.47Å; S82-H86 PolarHBondContact O-ND1 3Å; A83-H86 PolarHBondContact O-N 2.93Å; H86-P89 WeakPolarHBondContact O-CD 3.48Å |
| 87 | C | 43.7 | Very low | 53.9 | Low | 109 Ų | 109 | 114.3 Ų | 114.3 | 74% | 0.736 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -83 | -15.5 | 178 | -116.8 | 0 | 0 | 0 | 0 | 113.9 | A83 P89 | A83-C87 WeakPolarHBondContact O-CB 3.35Å; A83-C87 PolarHBondContact O-N 3.11Å; C87-P89 VanDerWaalsContact C-CD 3.41Å; C87-P89 WeakPolarHBondContact O-CD 3.48Å |
| 88 | F | 38.4 | Very low | 52 | Low | 111 Ų | 111 | 118 Ų | 118 | 49% | 0.487 | 64% | 0.638 | S | S | . | * | trans | -119.1 | 67.2 | 171.6 | -89 | -78.3 | 0 | 0 | 0 | 113 | R84 H90 L91 | R84-F88 PolarHBondContact O-N 3.35Å; F88-H90 AromaticContact CD1-ND1 3.83Å; F88-H90 AromaticContact CE1-CE1 3.91Å; F88-H90 PolarHBondContact O-N 3.28Å; F88-L91 HydrophobicContact CD1-CB 3.84Å; F88-L91 HydrophobicContact CD1-CD1 3.28Å; F88-L91 HydrophobicContact CD1-CG 4.18Å; F88-L91 HydrophobicContact CE1-CD1 3.1Å; F88-L91 HydrophobicContact CE1-CG 4.39Å; F88-L91 HydrophobicContact CG-CD1 4.49Å; F88-L91 HydrophobicContact CZ-CD1 4.23Å | ||
| 89 | P | 51.6 | Low | 50.5 | Low | 104 Ų | 104 | 118.4 Ų | 118.4 | 68% | 0.675 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.8 | -19.4 | 169.1 | -8.5 | 22.3 | 0 | 0 | 0 | 112.4 | H86 C87 | H86-P89 WeakPolarHBondContact O-CD 3.48Å; C87-P89 VanDerWaalsContact C-CD 3.41Å; C87-P89 WeakPolarHBondContact O-CD 3.48Å |
| 90 | H | 41.9 | Very low | 49.5 | Very low | 150 Ų | 150 | 123.3 Ų | 123.3 | 69% | 0.694 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.7 | -2.4 | -167.9 | 100.9 | -83.2 | 0 | 0 | 0 | 115.5 | F88 | F88-H90 AromaticContact CD1-ND1 3.83Å; F88-H90 AromaticContact CE1-CE1 3.91Å; F88-H90 PolarHBondContact O-N 3.28Å |
| 91 | L | 43.4 | Very low | 48.4 | Very low | 109 Ų | 109 | 127.7 Ų | 127.7 | 57% | 0.571 | 68% | 0.683 | S | S | * | * | trans | -117.1 | 9.1 | -175.3 | -105 | 138.7 | 0 | 0 | 0 | 114.9 | F88 P93 | F88-L91 HydrophobicContact CD1-CB 3.84Å; F88-L91 HydrophobicContact CD1-CD1 3.28Å; F88-L91 HydrophobicContact CD1-CG 4.18Å; F88-L91 HydrophobicContact CE1-CD1 3.1Å; F88-L91 HydrophobicContact CE1-CG 4.39Å; F88-L91 HydrophobicContact CG-CD1 4.49Å; F88-L91 HydrophobicContact CZ-CD1 4.23Å; L91-P93 VanDerWaalsContact O-CD 3.24Å; L91-P93 WeakPolarHBondContact O-CD 3.43Å | ||
| 92 | L | 40.6 | Very low | 47.2 | Very low | 123 Ų | 123 | 134.9 Ų | 134.9 | 64% | 0.644 | 70% | 0.7 | S | S | * | * | trans | -73.8 | 111.4 | 162.5 | -84 | 133.1 | 0 | 0 | 0 | 108.3 | A94 | L92-A94 PolarHBondContact O-N 2.96Š| ||
| 93 | P | 44.3 | Very low | 46.7 | Very low | 111 Ų | 111 | 137 Ų | 137 | 72% | 0.721 | 72% | 0.721 | S | S | * | * | trans | -65.3 | 127.4 | 165.5 | 7.6 | 7 | 0 | 0 | 0 | 106.1 | L91 W95 | L91-P93 VanDerWaalsContact O-CD 3.24Å; L91-P93 WeakPolarHBondContact O-CD 3.43Å; P93-W95 PolarHBondContact O-N 3.39Å | ||
| 94 | A | 48.2 | Very low | 46.1 | Very low | 97 Ų | 97 | 137 Ų | 137 | 80% | 0.802 | 73% | 0.727 | S | S | * | * | trans | -45.5 | 104.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 110.1 | L92 P96 | L92-A94 PolarHBondContact O-N 2.96Å; A94-P96 WeakPolarHBondContact O-CD 3.34Å | ||
| 95 | W | 36.3 | Very low | 45.8 | Very low | 230 Ų | 230 | 137.6 Ų | 137.6 | 87% | 0.871 | 74% | 0.737 | S | S | * | * | trans | -61.8 | 124.5 | 167.5 | -96.8 | -33.5 | 0 | 0 | 0 | 106.8 | P93 L97 | P93-W95 PolarHBondContact O-N 3.39Å; W95-L97 PolarHBondContact O-N 3.32Å | ||
| 96 | P | 44.4 | Very low | 45.3 | Very low | 97 Ų | 97 | 146.8 Ų | 146.8 | 63% | 0.63 | 77% | 0.772 | S | S | * | * | trans | -72.5 | 118.8 | -179.9 | 23.1 | -20.8 | 0 | 0 | 0 | 108 | A94 R98 | A94-P96 WeakPolarHBondContact O-CD 3.34Å; P96-R98 PolarHBondContact O-N 3.03Å | ||
| 97 | L | 48 | Very low | 45 | Very low | 184 Ų | 184 | 146.7 Ų | 146.7 | 96% | 0.963 | 78% | 0.776 | S | S | * | * | trans | -59.6 | 78.5 | 152.4 | -82.4 | 119.1 | 0 | 0 | 0 | 108.2 | W95 | W95-L97 PolarHBondContact O-N 3.32Š| ||
| 98 | R | 42.3 | Very low | 45.1 | Very low | 222 Ų | 222 | 148.6 Ų | 148.6 | 84% | 0.838 | 78% | 0.778 | S | S | * | * | trans | -97.6 | 93.4 | 168.3 | -165 | 178.8 | -72.1 | -99.4 | 3.2 | 106.9 | P96 H100 | P96-R98 PolarHBondContact O-N 3.03Å; R98-H100 PolarHBondContact O-N 3.39Å | ||
| 99 | G | 43.5 | Very low | 45.5 | Very low | 71 Ų | 71 | 150.7 Ų | 150.7 | 73% | 0.732 | 79% | 0.794 | S | S | * | * | trans | -55.7 | 130.8 | 176 | 0 | 0 | 0 | 0 | 0 | 112 | H101 | G99-H101 PolarHBondContact O-N 3.41Š| ||
| 100 | H | 51 | Low | 45.1 | Very low | 191 Ų | 191 | 153.5 Ų | 153.5 | 88% | 0.884 | 80% | 0.801 | S | S | * | * | S | Bend | trans | -61.2 | 106.3 | 154.6 | -101.6 | -95.9 | 0 | 0 | 0 | 108.9 | R98 | R98-H100 PolarHBondContact O-N 3.39Š|
| 101 | H | 50.2 | Low | 45.3 | Very low | 174 Ų | 174 | 153.7 Ų | 153.7 | 81% | 0.806 | 81% | 0.807 | S | S | * | * | trans | 160.9 | 101.8 | 134 | -111.2 | -79.6 | 0 | 0 | 0 | 111 | G99 | G99-H101 PolarHBondContact O-N 3.41Š| ||
| 102 | R | 45.3 | Very low | 45.4 | Very low | 239 Ų | 239 | 156.7 Ų | 156.7 | 90% | 0.902 | 82% | 0.823 | S | S | * | * | trans | -160.1 | 81.7 | 139.7 | -143.7 | 179.4 | -135.1 | -131.6 | 3.4 | 109.4 | ||||
| 103 | A | 48.4 | Very low | 45.8 | Very low | 102 Ų | 102 | 159.1 Ų | 159.1 | 84% | 0.843 | 84% | 0.836 | S | S | * | * | trans | -100.3 | 113 | 157.9 | 0 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 104 | G | 49.5 | Very low | 45.9 | Very low | 59 Ų | 59 | 162.8 Ų | 162.8 | 61% | 0.608 | 85% | 0.845 | S | S | * | * | trans | 160.3 | 123.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 105 | E | 45.9 | Very low | 45.7 | Very low | 181 Ų | 181 | 168.3 Ų | 168.3 | 85% | 0.846 | 85% | 0.848 | S | S | * | * | trans | 84.2 | 83.3 | 176.1 | -58.5 | -170 | 105.7 | 0 | 0 | 117.8 | ||||
| 106 | Q | 43.4 | Very low | 46.5 | Very low | 269 Ų | 269 | 162.6 Ų | 162.6 | 100% | 1.257 | 85% | 0.846 | S | S | * | * | -176.6 | 0 | 93.3 | -97.3 | 170.2 | 70.9 | 0 | 0 | 110.4 |
Retrieved 106 of 106 residues in 52.2 ms
(Link to these results)