| 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 | E | 52.9 | Low | 60.3 | Low | 198 Ų | 198 | 122.4 Ų | 122.4 | 93% | 0.925 | 62% | 0.615 | S | S | * | * | 0 | 125.6 | 0 | -169.2 | 175.7 | 108.7 | 0 | 0 | 109.2 | S3 R6 | E1-S3 PolarHBondContact O-N 3.08Å; E1-R6 IonicContact OE1-CZ 3.87Å; E1-R6 IonicContact OE1-NH1 3.91Å; E1-R6 IonicContact OE1-NH2 2.65Å; E1-R6 PolarHBondContact OE1-NH2 2.88Å | |||
| 2 | P | 51.4 | Low | 61.6 | Low | 93 Ų | 93 | 121.1 Ų | 121.1 | 60% | 0.604 | 60% | 0.603 | S | S | * | * | trans | -82 | 93 | -168.6 | 32.2 | -31.5 | 0 | 0 | 0 | 111 | I4 | P2-I4 PolarHBondContact O-N 3.23Å; P2-I4 VanDerWaalsContact O-N 3.11Å | ||
| 3 | S | 57.5 | Low | 62.4 | Low | 78 Ų | 78 | 119.1 Ų | 119.1 | 55% | 0.545 | 60% | 0.596 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -59.8 | -14.4 | 178 | -172.2 | 0 | 0 | 0 | 0 | 114.6 | E1 K5 R6 | E1-S3 PolarHBondContact O-N 3.08Å; S3-K5 PolarHBondContact O-N 3.44Å; S3-K5 VanDerWaalsContact O-N 3.1Å; S3-R6 PolarHBondContact O-N 3Å |
| 4 | I | 55.9 | Low | 63.1 | Low | 143 Ų | 143 | 121.4 Ų | 121.4 | 73% | 0.733 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -58.3 | -28.3 | -176.3 | -66.8 | 162.5 | 0 | 0 | 0 | 112.5 | P2 | P2-I4 PolarHBondContact O-N 3.23Å; P2-I4 VanDerWaalsContact O-N 3.11Å |
| 5 | K | 55.7 | Low | 63.8 | Low | 167 Ų | 167 | 117.7 Ų | 117.7 | 73% | 0.726 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -72.6 | -27.9 | -177.5 | -67.6 | -173.8 | 179.5 | -175.9 | 0 | 114.2 | S3 | S3-K5 PolarHBondContact O-N 3.44Å; S3-K5 VanDerWaalsContact O-N 3.1Å |
| 6 | R | 58 | Low | 64.1 | Low | 157 Ų | 157 | 116 Ų | 116 | 59% | 0.592 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -81.3 | -36.4 | -177.1 | -61.8 | -172.3 | -162.1 | 98.9 | -0.6 | 112.2 | E1 S3 L8 L9 N10 | E1-R6 IonicContact OE1-CZ 3.87Å; E1-R6 IonicContact OE1-NH1 3.91Å; E1-R6 IonicContact OE1-NH2 2.65Å; E1-R6 PolarHBondContact OE1-NH2 2.88Å; S3-R6 PolarHBondContact O-N 3Å; R6-L8 VanDerWaalsContact C-N 3.35Å; R6-L9 PolarHBondContact O-N 3.4Å; R6-N10 PolarHBondContact O-N 2.76Å |
| 7 | N | 58.8 | Low | 64.3 | Low | 111 Ų | 111 | 114.9 Ų | 114.9 | 59% | 0.594 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -65.3 | -40.7 | 179.5 | -165.5 | 15.4 | 0 | 0 | 0 | 111.6 | L9 N10 E11 | N7-L9 PolarHBondContact O-N 3.44Å; N7-N10 PolarHBondContact O-N 3.43Å; N7-E11 WeakPolarHBondContact O-CB 3.32Å; N7-E11 PolarHBondContact O-N 3.24Å |
| 8 | L | 66.9 | Low | 64.2 | Low | 93 Ų | 93 | 112.9 Ų | 112.9 | 49% | 0.487 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -65.4 | -38.8 | -179.5 | -171.1 | 65.3 | 0 | 0 | 0 | 112.6 | R6 E11 F12 | R6-L8 VanDerWaalsContact C-N 3.35Å; L8-E11 WeakPolarHBondContact O-CB 3.28Å; L8-E11 PolarHBondContact O-N 2.91Å; L8-F12 HydrophobicContact CD1-CE2 4.07Å; L8-F12 HydrophobicContact CD2-CE2 4.22Å; L8-F12 HydrophobicContact CG-CD2 4.17Å; L8-F12 HydrophobicContact CG-CE2 3.76Å; L8-F12 WeakPolarHBondContact O-CD2 3.36Å; L8-F12 PolarHBondContact O-N 3.49Å; L8-F12 VanDerWaalsContact O-N 3.09Å |
| 9 | L | 67 | Low | 64.2 | Low | 114 Ų | 114 | 112.6 Ų | 112.6 | 60% | 0.597 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -66.5 | -43.6 | 179.1 | -156.4 | 76 | 0 | 0 | 0 | 111.5 | R6 N7 E11 F12 D13 | R6-L9 PolarHBondContact O-N 3.4Å; N7-L9 PolarHBondContact O-N 3.44Å; L9-E11 VanDerWaalsContact C-N 3.26Å; L9-E11 PolarHBondContact O-N 2.83Å; L9-F12 WeakPolarHBondContact O-CB 3.46Å; L9-F12 PolarHBondContact O-N 3.12Å; L9-F12 VanDerWaalsContact O-N 3.14Å; L9-D13 PolarHBondContact O-N 3.44Å; L9-D13 VanDerWaalsContact O-N 3.08Å |
| 10 | N | 68.5 | Low | 63.9 | Low | 102 Ų | 102 | 114.4 Ų | 114.4 | 55% | 0.545 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -63.7 | -33.5 | 175.6 | -172 | 53.2 | 0 | 0 | 0 | 112.3 | R6 N7 R14 | R6-N10 PolarHBondContact O-N 2.76Å; N7-N10 PolarHBondContact O-N 3.43Å; N10-R14 WeakPolarHBondContact O-CB 3.41Å; N10-R14 PolarHBondContact O-N 3.37Å; N10-R14 VanDerWaalsContact O-N 3.09Å |
| 11 | E | 71 | Confident | 63.6 | Low | 90 Ų | 90 | 115.2 Ų | 115.2 | 42% | 0.421 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -65.5 | -41.3 | 173.8 | -160.6 | -176.1 | 144.2 | 0 | 0 | 111.5 | N7 L8 L9 R14 I15 | N7-E11 WeakPolarHBondContact O-CB 3.32Å; N7-E11 PolarHBondContact O-N 3.24Å; L8-E11 WeakPolarHBondContact O-CB 3.28Å; L8-E11 PolarHBondContact O-N 2.91Å; L9-E11 VanDerWaalsContact C-N 3.26Å; L9-E11 PolarHBondContact O-N 2.83Å; E11-R14 PolarHBondContact O-N 2.81Å; E11-I15 HydrophobicContact CG-CD1 4.03Å; E11-I15 WeakPolarHBondContact O-CB 3.39Å; E11-I15 WeakPolarHBondContact O-CD1 3.29Å; E11-I15 WeakPolarHBondContact O-CG1 3.44Å; E11-I15 PolarHBondContact O-N 2.96Å |
| 12 | F | 75.6 | Confident | 63.8 | Low | 107 Ų | 107 | 110.1 Ų | 110.1 | 47% | 0.469 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -62.2 | -47.9 | 175 | -82 | -67.9 | 0 | 0 | 0 | 112.6 | L8 L9 R14 I15 I16 | L8-F12 HydrophobicContact CD1-CE2 4.07Å; L8-F12 HydrophobicContact CD2-CE2 4.22Å; L8-F12 HydrophobicContact CG-CD2 4.17Å; L8-F12 HydrophobicContact CG-CE2 3.76Å; L8-F12 WeakPolarHBondContact O-CD2 3.36Å; L8-F12 PolarHBondContact O-N 3.49Å; L8-F12 VanDerWaalsContact O-N 3.09Å; L9-F12 WeakPolarHBondContact O-CB 3.46Å; L9-F12 PolarHBondContact O-N 3.12Å; L9-F12 VanDerWaalsContact O-N 3.14Å; F12-R14 VanDerWaalsContact C-N 3.27Å; F12-R14 PolarHBondContact O-N 2.82Å; F12-I15 PolarHBondContact O-N 3.02Å; F12-I15 VanDerWaalsContact O-N 3.13Å; F12-I16 VanDerWaalsContact O-CG1 3.32Å; F12-I16 WeakPolarHBondContact O-CG1 3.13Å; F12-I16 PolarHBondContact O-N 3.35Å |
| 13 | D | 71.4 | Confident | 64 | Low | 95 Ų | 95 | 111.8 Ų | 111.8 | 51% | 0.508 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -60.1 | -42.1 | 179.3 | -66.9 | -32.5 | 0 | 0 | 0 | 110.7 | L9 I15 I16 E17 | L9-D13 PolarHBondContact O-N 3.44Å; L9-D13 VanDerWaalsContact O-N 3.08Å; D13-I15 PolarHBondContact O-N 3.41Å; D13-I16 PolarHBondContact O-N 3.21Å; D13-E17 WeakPolarHBondContact O-CB 3.38Å; D13-E17 PolarHBondContact O-N 3.38Å |
| 14 | R | 73 | Confident | 63.9 | Low | 151 Ų | 151 | 117.5 Ų | 117.5 | 57% | 0.57 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -65.7 | -36.9 | 176 | -161.2 | -179.7 | 96.3 | -156.7 | 5.7 | 112.9 | N10 E11 F12 N18 | N10-R14 WeakPolarHBondContact O-CB 3.41Å; N10-R14 PolarHBondContact O-N 3.37Å; N10-R14 VanDerWaalsContact O-N 3.09Å; E11-R14 PolarHBondContact O-N 2.81Å; F12-R14 VanDerWaalsContact C-N 3.27Å; F12-R14 PolarHBondContact O-N 2.82Å; R14-N18 VanDerWaalsContact O-CB 3.22Å; R14-N18 WeakPolarHBondContact O-CB 3.17Å; R14-N18 PolarHBondContact O-N 3.47Å; R14-N18 PolarHBondContact O-ND2 2.8Å |
| 15 | I | 73.4 | Confident | 63.9 | Low | 66 Ų | 66 | 115.1 Ų | 115.1 | 34% | 0.338 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -67.8 | -43.3 | 177 | -70.8 | 161.6 | 0 | 0 | 0 | 110.2 | E11 F12 D13 N18 Q19 | E11-I15 HydrophobicContact CG-CD1 4.03Å; E11-I15 WeakPolarHBondContact O-CB 3.39Å; E11-I15 WeakPolarHBondContact O-CD1 3.29Å; E11-I15 WeakPolarHBondContact O-CG1 3.44Å; E11-I15 PolarHBondContact O-N 2.96Å; F12-I15 PolarHBondContact O-N 3.02Å; F12-I15 VanDerWaalsContact O-N 3.13Å; D13-I15 PolarHBondContact O-N 3.41Å; I15-N18 PolarHBondContact O-N 2.87Å; I15-Q19 HydrophobicContact CG2-CG 4.28Å; I15-Q19 VanDerWaalsContact CG2-NE2 3.29Å; I15-Q19 WeakPolarHBondContact O-CB 3.5Å; I15-Q19 VanDerWaalsContact O-CG 3.28Å; I15-Q19 WeakPolarHBondContact O-CG 3.19Å; I15-Q19 PolarHBondContact O-N 2.92Å |
| 16 | I | 68.9 | Low | 63.6 | Low | 91 Ų | 91 | 112.1 Ų | 112.1 | 47% | 0.467 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -63 | -49.3 | 177.8 | -66.3 | 165.3 | 0 | 0 | 0 | 109.8 | F12 D13 N18 Q19 E20 | F12-I16 VanDerWaalsContact O-CG1 3.32Å; F12-I16 WeakPolarHBondContact O-CG1 3.13Å; F12-I16 PolarHBondContact O-N 3.35Å; D13-I16 PolarHBondContact O-N 3.21Å; I16-N18 VanDerWaalsContact C-N 3.29Å; I16-N18 PolarHBondContact O-N 3.45Å; I16-Q19 PolarHBondContact O-N 2.76Å; I16-E20 PolarHBondContact O-N 3.28Å |
| 17 | E | 66.1 | Low | 63.3 | Low | 98 Ų | 98 | 114.9 Ų | 114.9 | 46% | 0.458 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -60.6 | -38.3 | 178.6 | -165.1 | -165.6 | 164.9 | 0 | 0 | 112.1 | D13 K21 | D13-E17 WeakPolarHBondContact O-CB 3.38Å; D13-E17 PolarHBondContact O-N 3.38Å; E17-K21 WeakPolarHBondContact O-CD 3.32Å; E17-K21 VanDerWaalsContact O-CG 3.28Å; E17-K21 WeakPolarHBondContact O-CG 3.35Å; E17-K21 PolarHBondContact O-N 2.89Å; E17-K21 IonicContact OE1-NZ 2.89Å; E17-K21 PolarHBondContact OE1-NZ 2.83Å |
| 18 | N | 63.6 | Low | 62.8 | Low | 78 Ų | 78 | 114.4 Ų | 114.4 | 42% | 0.417 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -76.4 | -31.9 | 177 | -74.6 | -22.6 | 0 | 0 | 0 | 113.1 | R14 I15 I16 K21 S22 | R14-N18 VanDerWaalsContact O-CB 3.22Å; R14-N18 WeakPolarHBondContact O-CB 3.17Å; R14-N18 PolarHBondContact O-N 3.47Å; R14-N18 PolarHBondContact O-ND2 2.8Å; I15-N18 PolarHBondContact O-N 2.87Å; I16-N18 VanDerWaalsContact C-N 3.29Å; I16-N18 PolarHBondContact O-N 3.45Å; N18-K21 PolarHBondContact O-N 2.93Å; N18-S22 WeakPolarHBondContact O-CB 3.38Å; N18-S22 PolarHBondContact O-N 3.14Å |
| 19 | Q | 63.4 | Low | 61.6 | Low | 108 Ų | 108 | 115.9 Ų | 115.9 | 51% | 0.505 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -68.8 | -42.7 | 174.1 | -78.7 | -178.1 | 20.6 | 0 | 0 | 111.2 | I15 I16 K21 S22 L23 | I15-Q19 HydrophobicContact CG2-CG 4.28Å; I15-Q19 VanDerWaalsContact CG2-NE2 3.29Å; I15-Q19 WeakPolarHBondContact O-CB 3.5Å; I15-Q19 VanDerWaalsContact O-CG 3.28Å; I15-Q19 WeakPolarHBondContact O-CG 3.19Å; I15-Q19 PolarHBondContact O-N 2.92Å; I16-Q19 PolarHBondContact O-N 2.76Å; Q19-K21 PolarHBondContact O-N 3.09Å; Q19-S22 CarbonylContact O-C 3.54Å; Q19-S22 PolarHBondContact O-N 3.45Å; Q19-L23 WeakPolarHBondContact O-CB 3.45Å; Q19-L23 WeakPolarHBondContact O-CD1 3.38Å; Q19-L23 WeakPolarHBondContact O-CG 3.13Å; Q19-L23 PolarHBondContact O-N 3.24Å |
| 20 | E | 58.5 | Low | 61 | Low | 147 Ų | 147 | 115.7 Ų | 115.7 | 69% | 0.687 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -58 | -33.4 | 173.6 | -73.1 | -173.5 | 143.9 | 0 | 0 | 112.1 | I16 | I16-E20 PolarHBondContact O-N 3.28Å |
| 21 | K | 57.5 | Low | 59.8 | Low | 133 Ų | 133 | 117.5 Ų | 117.5 | 58% | 0.578 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -77.7 | -32.1 | 173.4 | -67.1 | 168.9 | -170.4 | 171.6 | 0 | 113.2 | E17 N18 Q19 | E17-K21 WeakPolarHBondContact O-CD 3.32Å; E17-K21 VanDerWaalsContact O-CG 3.28Å; E17-K21 WeakPolarHBondContact O-CG 3.35Å; E17-K21 PolarHBondContact O-N 2.89Å; E17-K21 IonicContact OE1-NZ 2.89Å; E17-K21 PolarHBondContact OE1-NZ 2.83Å; N18-K21 PolarHBondContact O-N 2.93Å; Q19-K21 PolarHBondContact O-N 3.09Å |
| 22 | S | 57.8 | Low | 58.4 | Low | 91 Ų | 91 | 116.1 Ų | 116.1 | 64% | 0.636 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -90.7 | -12.6 | -175.4 | -171.7 | 0 | 0 | 0 | 0 | 114.4 | N18 Q19 K24 | N18-S22 WeakPolarHBondContact O-CB 3.38Å; N18-S22 PolarHBondContact O-N 3.14Å; Q19-S22 CarbonylContact O-C 3.54Å; Q19-S22 PolarHBondContact O-N 3.45Å; S22-K24 PolarHBondContact O-N 3.14Å |
| 23 | L | 54.8 | Low | 57.1 | Low | 127 Ų | 127 | 119.8 Ų | 119.8 | 67% | 0.665 | 64% | 0.639 | S | S | * | * | trans | -68.4 | 9.8 | -178.6 | -84.6 | 164.5 | 0 | 0 | 0 | 114.7 | Q19 A25 | Q19-L23 WeakPolarHBondContact O-CB 3.45Å; Q19-L23 WeakPolarHBondContact O-CD1 3.38Å; Q19-L23 WeakPolarHBondContact O-CG 3.13Å; Q19-L23 PolarHBondContact O-N 3.24Å; L23-A25 VanDerWaalsContact C-N 3.31Å; L23-A25 PolarHBondContact O-N 3.37Å; L23-A25 VanDerWaalsContact O-N 3.09Å | ||
| 24 | K | 55.6 | Low | 56.3 | Low | 198 Ų | 198 | 122.2 Ų | 122.2 | 86% | 0.861 | 65% | 0.651 | S | S | * | * | S | Bend | trans | -79.8 | 86.4 | 158.7 | -70.4 | -166.2 | 178.5 | -177.4 | 0 | 109.8 | S22 | S22-K24 PolarHBondContact O-N 3.14Š|
| 25 | A | 56.7 | Low | 55.1 | Low | 94 Ų | 94 | 124.5 Ų | 124.5 | 78% | 0.777 | 66% | 0.66 | S | S | * | * | trans | 61.8 | 106.5 | 159.8 | 0 | 0 | 0 | 0 | 0 | 117.3 | L23 | L23-A25 VanDerWaalsContact C-N 3.31Å; L23-A25 PolarHBondContact O-N 3.37Å; L23-A25 VanDerWaalsContact O-N 3.09Å | ||
| 26 | S | 48.5 | Very low | 53.7 | Low | 104 Ų | 104 | 128.9 Ų | 128.9 | 73% | 0.727 | 68% | 0.684 | S | S | * | * | trans | -145 | 107.5 | 141.6 | -153.8 | 0 | 0 | 0 | 0 | 109.8 | S28 | S26-S28 PolarHBondContact O-N 3.08Š| ||
| 27 | K | 52.9 | Low | 52.8 | Low | 214 Ų | 214 | 129.9 Ų | 129.9 | 93% | 0.93 | 69% | 0.694 | S | S | * | * | trans | -80.2 | 105.1 | 169.8 | -68 | 175.5 | 173.7 | 178.9 | 0 | 106.5 | ||||
| 28 | S | 48.4 | Very low | 52.2 | Low | 101 Ų | 101 | 133 Ų | 133 | 71% | 0.706 | 71% | 0.706 | S | S | * | * | trans | -125.2 | 118.4 | 173.1 | 65.3 | 0 | 0 | 0 | 0 | 111.1 | S26 | S26-S28 PolarHBondContact O-N 3.08Š| ||
| 29 | T | 41.8 | Very low | 51.5 | Low | 124 Ų | 124 | 141.3 Ų | 141.3 | 76% | 0.761 | 73% | 0.732 | S | S | * | * | trans | -53 | 136.8 | -179.1 | -34.3 | 0 | 0 | 0 | 0 | 112.7 | D31 | T29-D31 PolarHBondContact O-N 2.65Š| ||
| 30 | P | 53.1 | Low | 50.8 | Low | 111 Ų | 111 | 144.6 Ų | 144.6 | 72% | 0.721 | 74% | 0.741 | S | S | * | * | trans | -92.6 | 82 | -176.3 | 35.9 | -31 | 0 | 0 | 0 | 110.5 | ||||
| 31 | D | 43.1 | Very low | 50 | Low | 140 Ų | 140 | 149.6 Ų | 149.6 | 75% | 0.749 | 75% | 0.753 | S | S | * | * | trans | -101.5 | 112.5 | 175 | -130.4 | -72 | 0 | 0 | 0 | 112.5 | T29 Q33 | T29-D31 PolarHBondContact O-N 2.65Å; D31-Q33 PolarHBondContact O-N 3.09Å | ||
| 32 | A | 42.9 | Very low | 49.5 | Very low | 60 Ų | 60 | 149 Ų | 149 | 50% | 0.496 | 76% | 0.755 | S | S | . | * | S | Bend | trans | 67.4 | 20.7 | 150.5 | 0 | 0 | 0 | 0 | 0 | 121.7 | ||
| 33 | Q | 47.3 | Very low | 49.2 | Very low | 185 Ų | 185 | 154 Ų | 154 | 86% | 0.864 | 77% | 0.769 | S | S | * | * | trans | -120.5 | 21.4 | 179.6 | -139.5 | 165.2 | 7.8 | 0 | 0 | 117.2 | D31 | D31-Q33 PolarHBondContact O-N 3.09Š| ||
| 34 | L | 54.9 | Low | 49.1 | Very low | 146 Ų | 146 | 151.3 Ų | 151.3 | 76% | 0.764 | 75% | 0.754 | S | S | * | * | trans | -98.7 | 22.2 | 175.6 | -73.2 | 175.4 | 0 | 0 | 0 | 114.6 | V37 | L34-V37 HydrophobicContact CD2-CG2 4.3Š| ||
| 35 | R | 47.3 | Very low | 48.7 | Very low | 198 Ų | 198 | 148.3 Ų | 148.3 | 75% | 0.747 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -89.9 | -3.8 | -174.5 | -69 | -160.1 | -65.9 | -88.6 | -0.7 | 116.1 | ||
| 36 | N | 43.6 | Very low | 48.3 | Very low | 159 Ų | 159 | 148.6 Ų | 148.6 | 85% | 0.85 | 74% | 0.74 | S | S | * | * | trans | -138.4 | 34.8 | -176 | -72.8 | -45 | 0 | 0 | 0 | 114.7 | K38 | N36-K38 PolarHBondContact O-N 3.36Å; N36-K38 VanDerWaalsContact O-N 3.14Å | ||
| 37 | V | 51.6 | Low | 48.2 | Very low | 112 Ų | 112 | 149.7 Ų | 149.7 | 68% | 0.679 | 73% | 0.734 | S | S | * | * | trans | -79 | 98.3 | 170.9 | -122.7 | 0 | 0 | 0 | 0 | 108.8 | L34 R39 | L34-V37 HydrophobicContact CD2-CG2 4.3Å; V37-R39 PolarHBondContact O-N 2.91Å; V37-R39 VanDerWaalsContact O-N 3.14Å | ||
| 38 | K | 53.4 | Low | 48 | Very low | 163 Ų | 163 | 144 Ų | 144 | 71% | 0.709 | 71% | 0.713 | S | S | * | * | trans | -53.8 | 119.2 | 169.2 | -75.4 | -178.8 | 178.2 | 176.8 | 0 | 108.2 | N36 Y40 | N36-K38 PolarHBondContact O-N 3.36Å; N36-K38 VanDerWaalsContact O-N 3.14Å; K38-Y40 HydrophobicContact CB-CD2 4.46Å; K38-Y40 HydrophobicContact CB-CE2 3.87Å; K38-Y40 WeakPolarHBondContact O-CD2 3.41Å; K38-Y40 PolarHBondContact O-N 3.47Å | ||
| 39 | R | 49.3 | Very low | 48.2 | Very low | 252 Ų | 252 | 142.5 Ų | 142.5 | 95% | 0.951 | 70% | 0.699 | S | S | * | * | trans | -65.3 | 95.9 | 176 | -83.9 | -176.2 | -174.1 | 171.1 | 2.6 | 109.5 | V37 R41 | V37-R39 PolarHBondContact O-N 2.91Å; V37-R39 VanDerWaalsContact O-N 3.14Å; R39-R41 PolarHBondContact O-N 3.13Å | ||
| 40 | Y | 47.4 | Very low | 48.6 | Very low | 177 Ų | 177 | 143.5 Ų | 143.5 | 69% | 0.694 | 69% | 0.693 | S | S | * | * | trans | -79.9 | 113 | 164 | -62.8 | -78.2 | 0 | 0 | 0 | 107.9 | K38 I42 | K38-Y40 HydrophobicContact CB-CD2 4.46Å; K38-Y40 HydrophobicContact CB-CE2 3.87Å; K38-Y40 WeakPolarHBondContact O-CD2 3.41Å; K38-Y40 PolarHBondContact O-N 3.47Å; Y40-I42 PolarHBondContact O-N 3.37Å | ||
| 41 | R | 41.7 | Very low | 48.5 | Very low | 253 Ų | 253 | 141.6 Ų | 141.6 | 96% | 0.955 | 68% | 0.677 | S | S | * | * | trans | -77.6 | 67.8 | 175.5 | -154.9 | 179.9 | -171 | 176.9 | 1.8 | 108.8 | R39 Q43 | R39-R41 PolarHBondContact O-N 3.13Å; R41-Q43 PolarHBondContact O-N 2.91Å | ||
| 42 | I | 47.9 | Very low | 49 | Very low | 119 Ų | 119 | 142.3 Ų | 142.3 | 61% | 0.61 | 67% | 0.674 | S | S | * | * | trans | -74.9 | 122.1 | 171.5 | -52.8 | 174.8 | 0 | 0 | 0 | 105.3 | Y40 I44 | Y40-I42 PolarHBondContact O-N 3.37Å; I42-I44 HydrophobicContact CB-CD1 4.1Å; I42-I44 HydrophobicContact CB-CG1 3.78Å; I42-I44 HydrophobicContact CG2-CD1 4.19Å; I42-I44 HydrophobicContact CG2-CG1 3.53Å; I42-I44 PolarHBondContact O-N 3.41Å | ||
| 43 | Q | 50.6 | Low | 49.1 | Very low | 198 Ų | 198 | 142.7 Ų | 142.7 | 93% | 0.925 | 67% | 0.672 | S | S | * | * | trans | -69 | 77.2 | 171.2 | -68.3 | 177 | 55.1 | 0 | 0 | 107.8 | R41 | R41-Q43 PolarHBondContact O-N 2.91Š| ||
| 44 | I | 52.3 | Low | 49 | Very low | 70 Ų | 70 | 138.4 Ų | 138.4 | 36% | 0.359 | 65% | 0.654 | S | S | . | * | trans | -79.9 | 124.5 | 178.1 | -69.1 | 178.1 | 0 | 0 | 0 | 106.6 | I42 L48 V49 | I42-I44 HydrophobicContact CB-CD1 4.1Å; I42-I44 HydrophobicContact CB-CG1 3.78Å; I42-I44 HydrophobicContact CG2-CD1 4.19Å; I42-I44 HydrophobicContact CG2-CG1 3.53Å; I42-I44 PolarHBondContact O-N 3.41Å; I44-L48 HydrophobicContact CG2-CB 3.43Å; I44-L48 VanDerWaalsContact CG2-CB 3.43Å; I44-L48 HydrophobicContact CG2-CD2 3.38Å; I44-L48 HydrophobicContact CG2-CG 3.75Å; I44-V49 HydrophobicContact CB-CG2 4.02Å; I44-V49 HydrophobicContact CG2-CG2 3.83Å | ||
| 45 | L | 47.3 | Very low | 48.5 | Very low | 134 Ų | 134 | 136.3 Ų | 136.3 | 70% | 0.702 | 64% | 0.644 | S | S | * | * | trans | -45.4 | 132.1 | 176.2 | -164.1 | 70.4 | 0 | 0 | 0 | 109.6 | H47 L48 V49 | L45-H47 PolarHBondContact O-N 2.98Å; L45-L48 PolarHBondContact O-N 3.09Å; L45-V49 PolarHBondContact O-N 2.94Å | ||
| 46 | P | 48.8 | Very low | 48.4 | Very low | 100 Ų | 100 | 132 Ų | 132 | 65% | 0.649 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -56.6 | -20.9 | -168.2 | 16.1 | -29.5 | 0 | 0 | 0 | 114.6 | K50 | P46-K50 PolarHBondContact O-N 3.33Å; P46-K50 VanDerWaalsContact O-N 3.08Å |
| 47 | H | 47.4 | Very low | 48.5 | Very low | 128 Ų | 128 | 129.3 Ų | 129.3 | 59% | 0.593 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -67.2 | -38.3 | 173.1 | -162.7 | -81.5 | 0 | 0 | 0 | 113.3 | L45 K50 N51 | L45-H47 PolarHBondContact O-N 2.98Å; H47-K50 PolarHBondContact O-N 3.39Å; H47-N51 PolarHBondContact O-N 3.36Å; H47-N51 VanDerWaalsContact O-N 3.12Å |
| 48 | L | 48.4 | Very low | 47.8 | Very low | 94 Ų | 94 | 127.9 Ų | 127.9 | 49% | 0.492 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -77.2 | -30.1 | 179.2 | -168.6 | 82.6 | 0 | 0 | 0 | 111 | I44 L45 N51 F52 | I44-L48 HydrophobicContact CG2-CB 3.43Å; I44-L48 VanDerWaalsContact CG2-CB 3.43Å; I44-L48 HydrophobicContact CG2-CD2 3.38Å; I44-L48 HydrophobicContact CG2-CG 3.75Å; L45-L48 PolarHBondContact O-N 3.09Å; L48-N51 PolarHBondContact O-N 2.84Å; L48-F52 WeakPolarHBondContact O-CB 3.28Å; L48-F52 PolarHBondContact O-N 3.22Å |
| 49 | V | 52.9 | Low | 47 | Very low | 69 Ų | 69 | 127.2 Ų | 127.2 | 42% | 0.418 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -65.7 | -41.2 | 169.8 | -176 | 0 | 0 | 0 | 0 | 111.1 | I44 L45 N51 F52 C53 | I44-V49 HydrophobicContact CB-CG2 4.02Å; I44-V49 HydrophobicContact CG2-CG2 3.83Å; L45-V49 PolarHBondContact O-N 2.94Å; V49-N51 PolarHBondContact O-N 3Å; V49-F52 PolarHBondContact O-N 3.38Å; V49-C53 WeakPolarHBondContact O-CB 3.28Å; V49-C53 PolarHBondContact O-N 2.94Å |
| 50 | K | 50.2 | Low | 46.7 | Very low | 145 Ų | 145 | 120.6 Ų | 120.6 | 63% | 0.63 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -58.4 | -47.2 | 172.9 | -96.7 | -175.8 | 175.3 | -178 | 0 | 111.6 | P46 H47 F52 C53 L54 | P46-K50 PolarHBondContact O-N 3.33Å; P46-K50 VanDerWaalsContact O-N 3.08Å; H47-K50 PolarHBondContact O-N 3.39Å; K50-F52 VanDerWaalsContact C-N 3.32Å; K50-F52 PolarHBondContact O-N 3.14Å; K50-C53 PolarHBondContact O-N 3.18Å; K50-L54 VanDerWaalsContact O-CB 3.28Å; K50-L54 WeakPolarHBondContact O-CB 3.34Å; K50-L54 WeakPolarHBondContact O-CD1 3.37Å; K50-L54 PolarHBondContact O-N 2.82Å |
| 51 | N | 49.5 | Very low | 46.2 | Very low | 71 Ų | 71 | 122.1 Ų | 122.1 | 38% | 0.38 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -64.5 | -35.6 | 177.3 | -75.3 | -21.5 | 0 | 0 | 0 | 112.4 | H47 L48 V49 N55 | H47-N51 PolarHBondContact O-N 3.36Å; H47-N51 VanDerWaalsContact O-N 3.12Å; L48-N51 PolarHBondContact O-N 2.84Å; V49-N51 PolarHBondContact O-N 3Å; N51-N55 VanDerWaalsContact O-CB 3.29Å; N51-N55 WeakPolarHBondContact O-CB 3.19Å; N51-N55 PolarHBondContact O-N 2.86Å; N51-N55 PolarHBondContact O-ND2 3.29Å |
| 52 | F | 54.1 | Low | 46.5 | Very low | 156 Ų | 156 | 115.6 Ų | 115.6 | 68% | 0.684 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -71.5 | -41.4 | 176.7 | -146.1 | -90.9 | 0 | 0 | 0 | 112.1 | L48 V49 K50 L56 | L48-F52 WeakPolarHBondContact O-CB 3.28Å; L48-F52 PolarHBondContact O-N 3.22Å; V49-F52 PolarHBondContact O-N 3.38Å; K50-F52 VanDerWaalsContact C-N 3.32Å; K50-F52 PolarHBondContact O-N 3.14Å; F52-L56 WeakPolarHBondContact O-CB 3.16Å; F52-L56 PolarHBondContact O-N 3.32Å |
| 53 | C | 44.3 | Very low | 46.4 | Very low | 67 Ų | 67 | 115.4 Ų | 115.4 | 45% | 0.453 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -67.4 | -42.1 | 175.2 | -77.5 | 0 | 0 | 0 | 0 | 112.1 | V49 K50 L56 I57 | V49-C53 WeakPolarHBondContact O-CB 3.28Å; V49-C53 PolarHBondContact O-N 2.94Å; K50-C53 PolarHBondContact O-N 3.18Å; C53-L56 PolarHBondContact O-N 3.41Å; C53-I57 WeakPolarHBondContact O-CB 3.45Å; C53-I57 VanDerWaalsContact O-CD1 3.32Å; C53-I57 WeakPolarHBondContact O-CD1 3.22Å; C53-I57 WeakPolarHBondContact O-CG1 3.49Å; C53-I57 PolarHBondContact O-N 2.89Å |
| 54 | L | 47.1 | Very low | 46.1 | Very low | 95 Ų | 95 | 110.8 Ų | 110.8 | 50% | 0.497 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -65.8 | -42.7 | 176.1 | -88.2 | 146.4 | 0 | 0 | 0 | 111.4 | K50 L56 I57 C58 | K50-L54 VanDerWaalsContact O-CB 3.28Å; K50-L54 WeakPolarHBondContact O-CB 3.34Å; K50-L54 WeakPolarHBondContact O-CD1 3.37Å; K50-L54 PolarHBondContact O-N 2.82Å; L54-L56 VanDerWaalsContact C-N 3.3Å; L54-L56 PolarHBondContact O-N 3.47Å; L54-I57 PolarHBondContact O-N 3.1Å; L54-C58 WeakPolarHBondContact O-CB 3.39Å; L54-C58 PolarHBondContact O-N 3.11Å; L54-C58 PolarHBondContact O-SG 3.45Å |
| 55 | N | 43.6 | Very low | 45.8 | Very low | 102 Ų | 102 | 113.2 Ų | 113.2 | 55% | 0.545 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -65.1 | -34.6 | 175.5 | -82 | -64.1 | 0 | 0 | 0 | 112.5 | N51 M59 | N51-N55 VanDerWaalsContact O-CB 3.29Å; N51-N55 WeakPolarHBondContact O-CB 3.19Å; N51-N55 PolarHBondContact O-N 2.86Å; N51-N55 PolarHBondContact O-ND2 3.29Å; N55-M59 WeakPolarHBondContact O-CB 3.15Å; N55-M59 WeakPolarHBondContact O-CG 3.46Å; N55-M59 PolarHBondContact O-N 3.22Å |
| 56 | L | 44.5 | Very low | 45.7 | Very low | 107 Ų | 107 | 111.9 Ų | 111.9 | 56% | 0.56 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -72.6 | -34.4 | 175.9 | -158.9 | 71.7 | 0 | 0 | 0 | 112.5 | F52 C53 L54 N60 | F52-L56 WeakPolarHBondContact O-CB 3.16Å; F52-L56 PolarHBondContact O-N 3.32Å; C53-L56 PolarHBondContact O-N 3.41Å; L54-L56 VanDerWaalsContact C-N 3.3Å; L54-L56 PolarHBondContact O-N 3.47Å; L56-N60 PolarHBondContact O-ND2 3.21Å |
| 57 | I | 45.6 | Very low | 45.5 | Very low | 104 Ų | 104 | 112.7 Ų | 112.7 | 53% | 0.533 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -78.2 | -40.9 | 177.8 | -66.6 | 162.5 | 0 | 0 | 0 | 111.1 | C53 L54 M59 N60 I61 | C53-I57 WeakPolarHBondContact O-CB 3.45Å; C53-I57 VanDerWaalsContact O-CD1 3.32Å; C53-I57 WeakPolarHBondContact O-CD1 3.22Å; C53-I57 WeakPolarHBondContact O-CG1 3.49Å; C53-I57 PolarHBondContact O-N 2.89Å; L54-I57 PolarHBondContact O-N 3.1Å; I57-M59 VanDerWaalsContact C-N 3.29Å; I57-M59 PolarHBondContact O-N 3.33Å; I57-N60 CarbonylContact O-C 3.55Å; I57-N60 PolarHBondContact O-N 3Å; I57-I61 PolarHBondContact O-N 3.02Å |
| 58 | C | 37.6 | Very low | 45.3 | Very low | 81 Ų | 81 | 111.6 Ų | 111.6 | 55% | 0.547 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -72.2 | -18.5 | 178.8 | -68.8 | 0 | 0 | 0 | 0 | 113.6 | L54 N60 | L54-C58 WeakPolarHBondContact O-CB 3.39Å; L54-C58 PolarHBondContact O-N 3.11Å; L54-C58 PolarHBondContact O-SG 3.45Å; C58-N60 VanDerWaalsContact C-N 3.33Å |
| 59 | M | 37.2 | Very low | 45.1 | Very low | 149 Ų | 149 | 113 Ų | 113 | 73% | 0.734 | 59% | 0.59 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.9 | -4.1 | 167.3 | -77.3 | -86.5 | 98 | 0 | 0 | 113.3 | N55 I57 | N55-M59 WeakPolarHBondContact O-CB 3.15Å; N55-M59 WeakPolarHBondContact O-CG 3.46Å; N55-M59 PolarHBondContact O-N 3.22Å; I57-M59 VanDerWaalsContact C-N 3.29Å; I57-M59 PolarHBondContact O-N 3.33Å |
| 60 | N | 43.2 | Very low | 44.5 | Very low | 114 Ų | 114 | 116.7 Ų | 116.7 | 61% | 0.61 | 60% | 0.604 | S | S | * | * | trans | -117.6 | 15.6 | -179.1 | -83.1 | -83.9 | 0 | 0 | 0 | 113.9 | L56 I57 C58 | L56-N60 PolarHBondContact O-ND2 3.21Å; I57-N60 CarbonylContact O-C 3.55Å; I57-N60 PolarHBondContact O-N 3Å; C58-N60 VanDerWaalsContact C-N 3.33Å | ||
| 61 | I | 36.8 | Very low | 43.9 | Very low | 209 Ų | 209 | 114.1 Ų | 114.1 | 100% | 1.072 | 60% | 0.601 | S | S | * | * | trans | -121.2 | 0 | 167 | -85.9 | 171.1 | 0 | 0 | 0 | 109.6 | I57 | I57-I61 PolarHBondContact O-N 3.02Š|
Retrieved 61 of 61 residues in 30.9 ms
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