| 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 | 54.8 | Low | 63.2 | Low | 236 Ų | 236 | 120.4 Ų | 120.4 | 100% | 1.163 | 67% | 0.671 | S | S | * | * | 0 | 105.6 | 0 | -65.3 | 162.2 | 107.4 | 0 | 0 | 107 | |||||
| 2 | P | 54 | Low | 64.3 | Low | 96 Ų | 96 | 119 Ų | 119 | 62% | 0.623 | 66% | 0.661 | S | S | * | * | trans | -70.9 | 141 | -179.7 | 29.2 | -32.3 | 0 | 0 | 0 | 109.9 | S4 | P2-S4 PolarHBondContact O-N 3.49Š| ||
| 3 | P | 59.6 | Low | 65.5 | Low | 92 Ų | 92 | 119 Ų | 119 | 60% | 0.597 | 66% | 0.658 | S | S | * | * | trans | -64.8 | 129.4 | -176.7 | 26.1 | -33.1 | 0 | 0 | 0 | 110.4 | G5 L6 | P3-G5 PolarHBondContact O-N 2.88Å; P3-L6 HydrophobicContact CG-CD1 4.09Å; P3-L6 PolarHBondContact O-N 3.02Å | ||
| 4 | S | 63.1 | Low | 66.5 | Low | 107 Ų | 107 | 115.1 Ų | 115.1 | 75% | 0.748 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.6 | -11.4 | -171.1 | -49.5 | 0 | 0 | 0 | 0 | 115.5 | P2 | P2-S4 PolarHBondContact O-N 3.49Š|
| 5 | G | 61.8 | Low | 67.2 | Low | 55 Ų | 55 | 114.7 Ų | 114.7 | 57% | 0.567 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.1 | -31.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | P3 R7 L8 | P3-G5 PolarHBondContact O-N 2.88Å; G5-R7 VanDerWaalsContact C-N 3.3Å; G5-R7 PolarHBondContact O-N 3.37Å; G5-L8 PolarHBondContact O-N 2.97Å |
| 6 | L | 59.9 | Low | 67.9 | Low | 121 Ų | 121 | 114.3 Ų | 114.3 | 63% | 0.634 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.3 | -16.6 | -178.2 | -88.4 | 102.5 | 0 | 0 | 0 | 113.9 | P3 L8 L9 P10 | P3-L6 HydrophobicContact CG-CD1 4.09Å; P3-L6 PolarHBondContact O-N 3.02Å; L6-L8 VanDerWaalsContact C-N 3.34Å; L6-L9 WeakPolarHBondContact O-CB 3.01Å; L6-P10 WeakPolarHBondContact O-CD 3.42Å |
| 7 | R | 64.8 | Low | 68.6 | Low | 201 Ų | 201 | 117.7 Ų | 117.7 | 76% | 0.758 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.9 | -18.5 | 178.2 | -68.4 | -146.3 | 165.6 | 172.5 | -3.4 | 113.9 | G5 P10 | G5-R7 VanDerWaalsContact C-N 3.3Å; G5-R7 PolarHBondContact O-N 3.37Å; R7-P10 WeakPolarHBondContact O-CD 3.38Å |
| 8 | L | 65.5 | Low | 69.1 | Low | 99 Ų | 99 | 117.1 Ų | 117.1 | 52% | 0.518 | 63% | 0.629 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -89.1 | -19.1 | 176.3 | -73.5 | 157.6 | 0 | 0 | 0 | 112.2 | G5 L6 L11 L12 | G5-L8 PolarHBondContact O-N 2.97Å; L6-L8 VanDerWaalsContact C-N 3.34Å; L8-L11 PolarHBondContact O-N 2.58Å; L8-L12 HydrophobicContact CB-CD1 4.22Å; L8-L12 WeakPolarHBondContact O-CB 3.33Å; L8-L12 WeakPolarHBondContact O-CG 3.46Å; L8-L12 PolarHBondContact O-N 3Å |
| 9 | L | 69.6 | Low | 69.4 | Low | 103 Ų | 103 | 117.5 Ų | 117.5 | 54% | 0.539 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -54.1 | -47.3 | 177.9 | -159.5 | 103.7 | 0 | 0 | 0 | 114 | L6 L11 L12 L13 | L6-L9 WeakPolarHBondContact O-CB 3.01Å; L9-L11 PolarHBondContact O-N 3.19Å; L9-L12 PolarHBondContact O-N 3.37Å; L9-L13 PolarHBondContact O-N 2.76Å; L9-L13 VanDerWaalsContact O-N 3.1Å |
| 10 | P | 70.9 | Confident | 69.7 | Low | 93 Ų | 93 | 117.2 Ų | 117.2 | 60% | 0.604 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -71 | -12.7 | 178.4 | 29.5 | -36.7 | 0 | 0 | 0 | 113.8 | L6 R7 P14 | L6-P10 WeakPolarHBondContact O-CD 3.42Å; R7-P10 WeakPolarHBondContact O-CD 3.38Å; P10-P14 WeakPolarHBondContact O-CD 3.42Å; P10-P14 VanDerWaalsContact O-CG 3.26Å; P10-P14 WeakPolarHBondContact O-CG 3.43Å |
| 11 | L | 71.1 | Confident | 69.9 | Low | 121 Ų | 121 | 116.1 Ų | 116.1 | 63% | 0.634 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -94 | -34.1 | 175 | -165.5 | 79.1 | 0 | 0 | 0 | 111.6 | L8 L9 P14 L15 | L8-L11 PolarHBondContact O-N 2.58Å; L9-L11 PolarHBondContact O-N 3.19Å; L11-P14 WeakPolarHBondContact O-CD 3.2Å; L11-P14 WeakPolarHBondContact O-CG 3.46Å; L11-L15 WeakPolarHBondContact O-CB 3.3Å; L11-L15 PolarHBondContact O-N 2.61Å |
| 12 | L | 77 | Confident | 70.7 | Confident | 104 Ų | 104 | 108.2 Ų | 108.2 | 55% | 0.545 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -71.3 | -37.1 | 177.2 | -78.5 | 165.8 | 0 | 0 | 0 | 112.3 | L8 L9 L15 L16 | L8-L12 HydrophobicContact CB-CD1 4.22Å; L8-L12 WeakPolarHBondContact O-CB 3.33Å; L8-L12 WeakPolarHBondContact O-CG 3.46Å; L8-L12 PolarHBondContact O-N 3Å; L9-L12 PolarHBondContact O-N 3.37Å; L12-L15 PolarHBondContact O-N 3.2Å; L12-L16 VanDerWaalsContact O-CB 3.31Å; L12-L16 WeakPolarHBondContact O-CB 3.5Å; L12-L16 PolarHBondContact O-N 3.38Å |
| 13 | L | 79.7 | Confident | 71.1 | Confident | 119 Ų | 119 | 109.3 Ų | 109.3 | 62% | 0.623 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -60.5 | -50 | 179.7 | -136 | 112.4 | 0 | 0 | 0 | 113.6 | L9 L15 L16 W17 | L9-L13 PolarHBondContact O-N 2.76Å; L9-L13 VanDerWaalsContact O-N 3.1Å; L13-L15 VanDerWaalsContact C-N 3.34Å; L13-L16 PolarHBondContact O-N 2.93Å; L13-W17 WeakPolarHBondContact O-CB 3.42Å; L13-W17 PolarHBondContact O-N 3.21Å |
| 14 | P | 78.8 | Confident | 71.4 | Confident | 65 Ų | 65 | 107.5 Ų | 107.5 | 42% | 0.422 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -70 | -30.3 | 176.3 | 27.1 | -34.6 | 0 | 0 | 0 | 112.3 | P10 L11 W17 L18 | P10-P14 WeakPolarHBondContact O-CD 3.42Å; P10-P14 VanDerWaalsContact O-CG 3.26Å; P10-P14 WeakPolarHBondContact O-CG 3.43Å; L11-P14 WeakPolarHBondContact O-CD 3.2Å; L11-P14 WeakPolarHBondContact O-CG 3.46Å; P14-W17 PolarHBondContact O-N 3.49Å; P14-L18 WeakPolarHBondContact O-CB 3.39Å; P14-L18 PolarHBondContact O-N 3.32Å |
| 15 | L | 76.8 | Confident | 71.5 | Confident | 108 Ų | 108 | 108.2 Ų | 108.2 | 57% | 0.565 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -67.7 | -42 | 175.7 | -173.9 | 66.2 | 0 | 0 | 0 | 111.7 | L11 L12 L13 L18 L19 | L11-L15 WeakPolarHBondContact O-CB 3.3Å; L11-L15 PolarHBondContact O-N 2.61Å; L12-L15 PolarHBondContact O-N 3.2Å; L13-L15 VanDerWaalsContact C-N 3.34Å; L15-L18 PolarHBondContact O-N 3.39Å; L15-L19 WeakPolarHBondContact O-CB 3.49Å; L15-L19 PolarHBondContact O-N 2.92Å |
| 16 | L | 78.6 | Confident | 71.3 | Confident | 109 Ų | 109 | 111.2 Ų | 111.2 | 57% | 0.571 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -67.9 | -40.9 | 174.6 | -175.4 | 64.7 | 0 | 0 | 0 | 111.1 | L12 L13 L18 L19 V20 | L12-L16 VanDerWaalsContact O-CB 3.31Å; L12-L16 WeakPolarHBondContact O-CB 3.5Å; L12-L16 PolarHBondContact O-N 3.38Å; L13-L16 PolarHBondContact O-N 2.93Å; L16-L18 VanDerWaalsContact C-N 3.34Å; L16-L19 PolarHBondContact O-N 3.1Å; L16-V20 VanDerWaalsContact O-CG2 3.3Å; L16-V20 WeakPolarHBondContact O-CG2 3.46Å; L16-V20 PolarHBondContact O-N 3.13Å |
| 17 | W | 80.4 | Confident | 71.4 | Confident | 172 Ų | 172 | 110.1 Ų | 110.1 | 65% | 0.652 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -62.9 | -42 | 175.2 | -168.4 | 58 | 0 | 0 | 0 | 111.5 | L13 P14 L19 V20 L21 | L13-W17 WeakPolarHBondContact O-CB 3.42Å; L13-W17 PolarHBondContact O-N 3.21Å; P14-W17 PolarHBondContact O-N 3.49Å; W17-L19 VanDerWaalsContact C-N 3.35Å; W17-V20 PolarHBondContact O-N 3.14Å; W17-L21 HydrophobicContact CD2-CD1 4.36Å; W17-L21 HydrophobicContact CD2-CD2 4.31Å; W17-L21 HydrophobicContact CG-CD1 4.35Å; W17-L21 HydrophobicContact CH2-CD2 3.99Å; W17-L21 HydrophobicContact CZ2-CD1 4.37Å; W17-L21 HydrophobicContact CZ2-CD2 3.67Å; W17-L21 HydrophobicContact CZ3-CD2 4.42Å; W17-L21 WeakPolarHBondContact O-CB 3.26Å; W17-L21 PolarHBondContact O-N 2.75Å |
| 18 | L | 77.5 | Confident | 71.1 | Confident | 107 Ų | 107 | 104.7 Ų | 104.7 | 56% | 0.56 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -62.7 | -41.5 | 174 | -172.2 | 66.8 | 0 | 0 | 0 | 111.4 | P14 L15 L16 V20 L21 T22 | P14-L18 WeakPolarHBondContact O-CB 3.39Å; P14-L18 PolarHBondContact O-N 3.32Å; L15-L18 PolarHBondContact O-N 3.39Å; L16-L18 VanDerWaalsContact C-N 3.34Å; L18-V20 VanDerWaalsContact C-N 3.33Å; L18-V20 PolarHBondContact O-N 3.05Å; L18-L21 PolarHBondContact O-N 3.38Å; L18-T22 HydrophobicContact CG-CG2 4.48Å; L18-T22 WeakPolarHBondContact O-CB 3.47Å; L18-T22 WeakPolarHBondContact O-CG2 3.44Å; L18-T22 PolarHBondContact O-N 3.45Å; L18-T22 PolarHBondContact O-OG1 3.36Å |
| 19 | L | 74.4 | Confident | 70.6 | Confident | 124 Ų | 124 | 103 Ų | 103 | 65% | 0.649 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -65.7 | -35.3 | 177.7 | -171.1 | 65.1 | 0 | 0 | 0 | 112.5 | L15 L16 W17 T22 | L15-L19 WeakPolarHBondContact O-CB 3.49Å; L15-L19 PolarHBondContact O-N 2.92Å; L16-L19 PolarHBondContact O-N 3.1Å; W17-L19 VanDerWaalsContact C-N 3.35Å; L19-T22 WeakPolarHBondContact CA-OG1 3.38Å; L19-T22 PolarHBondContact O-OG1 3.28Å |
| 20 | V | 75.4 | Confident | 70.1 | Confident | 111 Ų | 111 | 106.6 Ų | 106.6 | 67% | 0.673 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -74.9 | -34.8 | 175.4 | 171.3 | 0 | 0 | 0 | 0 | 111.6 | L16 W17 L18 | L16-V20 VanDerWaalsContact O-CG2 3.3Å; L16-V20 WeakPolarHBondContact O-CG2 3.46Å; L16-V20 PolarHBondContact O-N 3.13Å; W17-V20 PolarHBondContact O-N 3.14Å; L18-V20 VanDerWaalsContact C-N 3.33Å; L18-V20 PolarHBondContact O-N 3.05Å |
| 21 | L | 73.3 | Confident | 69.2 | Low | 95 Ų | 95 | 106.1 Ų | 106.1 | 50% | 0.497 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -83.1 | -19.8 | 178.4 | -100.3 | 67.2 | 0 | 0 | 0 | 113.8 | W17 L18 P23 | W17-L21 HydrophobicContact CD2-CD1 4.36Å; W17-L21 HydrophobicContact CD2-CD2 4.31Å; W17-L21 HydrophobicContact CG-CD1 4.35Å; W17-L21 HydrophobicContact CH2-CD2 3.99Å; W17-L21 HydrophobicContact CZ2-CD1 4.37Å; W17-L21 HydrophobicContact CZ2-CD2 3.67Å; W17-L21 HydrophobicContact CZ3-CD2 4.42Å; W17-L21 WeakPolarHBondContact O-CB 3.26Å; W17-L21 PolarHBondContact O-N 2.75Å; L18-L21 PolarHBondContact O-N 3.38Å; L21-P23 WeakPolarHBondContact O-CD 3.34Å |
| 22 | T | 72.3 | Confident | 68.8 | Low | 70 Ų | 70 | 107.1 Ų | 107.1 | 43% | 0.429 | 65% | 0.65 | S | S | . | * | S | Bend | trans | -72 | 114.9 | 172.7 | 41.1 | 0 | 0 | 0 | 0 | 108.6 | L18 L19 G24 | L18-T22 HydrophobicContact CG-CG2 4.48Å; L18-T22 WeakPolarHBondContact O-CB 3.47Å; L18-T22 WeakPolarHBondContact O-CG2 3.44Å; L18-T22 PolarHBondContact O-N 3.45Å; L18-T22 PolarHBondContact O-OG1 3.36Å; L19-T22 WeakPolarHBondContact CA-OG1 3.38Å; L19-T22 PolarHBondContact O-OG1 3.28Å; T22-G24 PolarHBondContact O-N 3.05Å |
| 23 | P | 62.4 | Low | 67.9 | Low | 119 Ų | 119 | 106.8 Ų | 106.8 | 77% | 0.773 | 66% | 0.655 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 117 | 165 | 3.8 | 7.8 | 0 | 0 | 0 | 106 | L21 | L21-P23 WeakPolarHBondContact O-CD 3.34Š|
| 24 | G | 65.9 | Low | 67.1 | Low | 54 Ų | 54 | 110 Ų | 110 | 56% | 0.557 | 66% | 0.664 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 147.6 | 173.2 | 0 | 0 | 0 | 0 | 0 | 109.2 | T22 | T22-G24 PolarHBondContact O-N 3.05Š|
| 25 | P | 65.9 | Low | 66.6 | Low | 122 Ų | 122 | 113.4 Ų | 113.4 | 79% | 0.792 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -49.6 | 132.2 | 172 | 21.4 | -31 | 0 | 0 | 0 | 107.2 | A27 | P25-A27 PolarHBondContact O-N 3.29Š|
| 26 | P | 57.2 | Low | 66.3 | Low | 118 Ų | 118 | 113.7 Ų | 113.7 | 77% | 0.766 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 120 | 177.5 | 22.6 | -31.5 | 0 | 0 | 0 | 105.3 | A28 | P26-A28 PolarHBondContact O-N 2.85Š|
| 27 | A | 62.5 | Low | 66.6 | Low | 98 Ų | 98 | 112.5 Ų | 112.5 | 81% | 0.81 | 68% | 0.679 | S | S | * | * | trans | -57.7 | 95 | 165.5 | 0 | 0 | 0 | 0 | 0 | 103.6 | P25 G29 | P25-A27 PolarHBondContact O-N 3.29Å; A27-G29 PolarHBondContact O-N 2.89Å | ||
| 28 | A | 58.8 | Low | 67.1 | Low | 88 Ų | 88 | 109 Ų | 109 | 73% | 0.727 | 67% | 0.671 | S | S | * | * | trans | -56.8 | 102 | 171.7 | 0 | 0 | 0 | 0 | 0 | 102.4 | P26 L30 | P26-A28 PolarHBondContact O-N 2.85Å; A28-L30 PolarHBondContact O-N 3.17Å | ||
| 29 | G | 54.2 | Low | 67.7 | Low | 62 Ų | 62 | 108 Ų | 108 | 64% | 0.639 | 66% | 0.664 | S | S | * | * | trans | -48 | 133.2 | -173.2 | 0 | 0 | 0 | 0 | 0 | 107 | A27 S31 | A27-G29 PolarHBondContact O-N 2.89Å; G29-S31 PolarHBondContact O-N 3.35Å | ||
| 30 | L | 59.3 | Low | 68.4 | Low | 179 Ų | 179 | 106.6 Ų | 106.6 | 94% | 0.937 | 66% | 0.656 | S | S | * | * | trans | -66.6 | 59.1 | 169.1 | -62.5 | 172.6 | 0 | 0 | 0 | 108.1 | A28 T32 | A28-L30 PolarHBondContact O-N 3.17Å; L30-T32 PolarHBondContact O-N 2.92Å | ||
| 31 | S | 52.7 | Low | 69.3 | Low | 83 Ų | 83 | 103.4 Ų | 103.4 | 58% | 0.58 | 64% | 0.637 | S | S | * | * | trans | -83.1 | 110 | 171 | -172.1 | 0 | 0 | 0 | 0 | 104.5 | G29 C33 | G29-S31 PolarHBondContact O-N 3.35Å; S31-C33 PolarHBondContact O-N 3.49Å; S31-C33 WeakPolarHBondContact OG-CB 3.27Å; S31-C33 PolarHBondContact OG-SG 3.49Å | ||
| 32 | T | 61.7 | Low | 70.3 | Confident | 143 Ų | 143 | 104.2 Ų | 104.2 | 88% | 0.877 | 64% | 0.636 | S | S | * | * | trans | -62.6 | 13 | 171.1 | 53.6 | 0 | 0 | 0 | 0 | 112.7 | L30 K34 | L30-T32 PolarHBondContact O-N 2.92Å; T32-K34 PolarHBondContact O-N 2.89Å | ||
| 33 | C | 58.5 | Low | 71.4 | Confident | 96 Ų | 96 | 108 Ų | 108 | 65% | 0.649 | 64% | 0.643 | S | S | * | * | trans | -85.6 | 92.1 | 176.8 | -62.9 | 0 | 0 | 0 | 0 | 109.4 | S31 T35 | S31-C33 PolarHBondContact O-N 3.49Å; S31-C33 WeakPolarHBondContact OG-CB 3.27Å; S31-C33 PolarHBondContact OG-SG 3.49Å; C33-T35 PolarHBondContact O-N 3.32Å | ||
| 34 | K | 62.8 | Low | 72.9 | Confident | 186 Ų | 186 | 109.6 Ų | 109.6 | 81% | 0.809 | 64% | 0.637 | S | S | * | * | trans | -54.4 | 121.6 | 164 | -174.8 | 159.4 | 176.5 | 64.9 | 0 | 108.3 | T32 I36 | T32-K34 PolarHBondContact O-N 2.89Å; K34-I36 VanDerWaalsContact C-N 3.32Å; K34-I36 PolarHBondContact O-N 2.84Å | ||
| 35 | T | 67.6 | Low | 74.4 | Confident | 138 Ų | 138 | 115.1 Ų | 115.1 | 85% | 0.847 | 64% | 0.641 | S | S | * | * | trans | -59.1 | 99.1 | 167 | 51.6 | 0 | 0 | 0 | 0 | 107.4 | C33 | C33-T35 PolarHBondContact O-N 3.32Š| ||
| 36 | I | 70.7 | Confident | 75.9 | Confident | 114 Ų | 114 | 114.7 Ų | 114.7 | 59% | 0.585 | 63% | 0.631 | S | S | * | * | trans | -82.9 | 122.1 | -179.6 | -177.4 | 167.1 | 0 | 0 | 0 | 108.2 | K34 M38 V41 | K34-I36 VanDerWaalsContact C-N 3.32Å; K34-I36 PolarHBondContact O-N 2.84Å; I36-M38 HydrophobicContact CB-CE 4Å; I36-M38 HydrophobicContact CD1-CE 3.99Å; I36-M38 HydrophobicContact CG1-CE 3.63Å; I36-M38 HydrophobicContact CG2-CE 3.4Å; I36-M38 VanDerWaalsContact CG2-CE 3.4Å; I36-M38 PolarHBondContact O-N 3.3Å; I36-M38 VanDerWaalsContact O-N 3.13Å; I36-V41 HydrophobicContact CD1-CG2 3.53Å; I36-V41 HydrophobicContact CG1-CG2 3.8Å | ||
| 37 | D | 85.6 | Confident | 77.7 | Confident | 84 Ų | 84 | 116.3 Ų | 116.3 | 45% | 0.449 | 63% | 0.629 | S | S | . | * | trans | -70.8 | 107.8 | 175.1 | -175.6 | -7.9 | 0 | 0 | 0 | 109 | E39 L40 V41 | D37-E39 PolarHBondContact O-N 3.16Å; D37-E39 VanDerWaalsContact OD1-CB 3.3Å; D37-E39 WeakPolarHBondContact OD1-CB 3.37Å; D37-E39 PolarHBondContact OD1-N 2.91Å; D37-L40 HydrophobicContact CB-CB 4.25Å; D37-L40 HydrophobicContact CB-CD1 3.94Å; D37-L40 HydrophobicContact CB-CG 3.99Å; D37-L40 PolarHBondContact O-N 3.49Å; D37-L40 VanDerWaalsContact O-N 3.16Å; D37-V41 PolarHBondContact O-N 2.89Å | ||
| 38 | M | 90.8 | Very high | 79.3 | Confident | 97 Ų | 97 | 114.6 Ų | 114.6 | 48% | 0.478 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -62.3 | -26.9 | 178.6 | -69.9 | -64.7 | 87.9 | 0 | 0 | 112.4 | I36 L40 V41 K42 | I36-M38 HydrophobicContact CB-CE 4Å; I36-M38 HydrophobicContact CD1-CE 3.99Å; I36-M38 HydrophobicContact CG1-CE 3.63Å; I36-M38 HydrophobicContact CG2-CE 3.4Å; I36-M38 VanDerWaalsContact CG2-CE 3.4Å; I36-M38 PolarHBondContact O-N 3.3Å; I36-M38 VanDerWaalsContact O-N 3.13Å; M38-L40 VanDerWaalsContact C-N 3.33Å; M38-V41 HydrophobicContact CE-CB 4.29Å; M38-V41 HydrophobicContact CE-CG2 3.83Å; M38-V41 PolarHBondContact O-N 3.22Å; M38-K42 WeakPolarHBondContact O-CB 3.48Å; M38-K42 VanDerWaalsContact O-CG 3.27Å; M38-K42 WeakPolarHBondContact O-CG 3.42Å; M38-K42 PolarHBondContact O-N 3.28Å |
| 39 | E | 90.4 | Very high | 81.1 | Confident | 88 Ų | 88 | 114.1 Ų | 114.1 | 41% | 0.411 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -67.4 | -38.3 | 176.2 | -65.3 | -59.8 | 111.2 | 0 | 0 | 110.8 | D37 K42 R43 | D37-E39 PolarHBondContact O-N 3.16Å; D37-E39 VanDerWaalsContact OD1-CB 3.3Å; D37-E39 WeakPolarHBondContact OD1-CB 3.37Å; D37-E39 PolarHBondContact OD1-N 2.91Å; E39-K42 PolarHBondContact O-N 2.99Å; E39-K42 IonicContact OE1-NZ 2.77Å; E39-K42 PolarHBondContact OE1-NZ 3.1Å; E39-R43 WeakPolarHBondContact O-CB 3.26Å; E39-R43 VanDerWaalsContact O-CG 3.27Å; E39-R43 WeakPolarHBondContact O-CG 3.39Å; E39-R43 PolarHBondContact O-N 2.89Å |
| 40 | L | 89.1 | Confident | 83.1 | Confident | 94 Ų | 94 | 114.2 Ų | 114.2 | 49% | 0.492 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -66.2 | -38.4 | 173.6 | -67.1 | 179.5 | 0 | 0 | 0 | 112.3 | D37 M38 K44 | D37-L40 HydrophobicContact CB-CB 4.25Å; D37-L40 HydrophobicContact CB-CD1 3.94Å; D37-L40 HydrophobicContact CB-CG 3.99Å; D37-L40 PolarHBondContact O-N 3.49Å; D37-L40 VanDerWaalsContact O-N 3.16Å; M38-L40 VanDerWaalsContact C-N 3.33Å; L40-K44 WeakPolarHBondContact O-CG 3.45Å; L40-K44 PolarHBondContact O-N 3.4Å |
| 41 | V | 93.1 | Very high | 84.9 | Confident | 44 Ų | 44 | 107.8 Ų | 107.8 | 27% | 0.267 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -66.2 | -44 | 176.1 | 175.3 | 0 | 0 | 0 | 0 | 111.3 | I36 D37 M38 K44 R45 | I36-V41 HydrophobicContact CD1-CG2 3.53Å; I36-V41 HydrophobicContact CG1-CG2 3.8Å; D37-V41 PolarHBondContact O-N 2.89Å; M38-V41 HydrophobicContact CE-CB 4.29Å; M38-V41 HydrophobicContact CE-CG2 3.83Å; M38-V41 PolarHBondContact O-N 3.22Å; V41-K44 PolarHBondContact O-N 2.95Å; V41-R45 WeakPolarHBondContact O-CG 3.36Å; V41-R45 PolarHBondContact O-N 3.45Å |
| 42 | K | 94.9 | Very high | 87 | Confident | 111 Ų | 111 | 108.8 Ų | 108.8 | 48% | 0.483 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -60.9 | -46.7 | 176.2 | -71.7 | 172.3 | -168.7 | 168.4 | 0 | 111.1 | M38 E39 K44 R45 I46 | M38-K42 WeakPolarHBondContact O-CB 3.48Å; M38-K42 VanDerWaalsContact O-CG 3.27Å; M38-K42 WeakPolarHBondContact O-CG 3.42Å; M38-K42 PolarHBondContact O-N 3.28Å; E39-K42 PolarHBondContact O-N 2.99Å; E39-K42 IonicContact OE1-NZ 2.77Å; E39-K42 PolarHBondContact OE1-NZ 3.1Å; K42-K44 PolarHBondContact O-N 3.19Å; K42-R45 PolarHBondContact O-N 2.82Å; K42-R45 VanDerWaalsContact O-N 3.13Å; K42-I46 VanDerWaalsContact O-CG1 3.26Å; K42-I46 WeakPolarHBondContact O-CG1 3.39Å; K42-I46 PolarHBondContact O-N 3.44Å |
| 43 | R | 94.5 | Very high | 88.6 | Confident | 151 Ų | 151 | 106.2 Ų | 106.2 | 57% | 0.57 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -57.5 | -48.2 | 176.8 | -73.7 | 176.6 | -166.4 | -171 | 4.6 | 112 | E39 R45 I46 E47 | E39-R43 WeakPolarHBondContact O-CB 3.26Å; E39-R43 VanDerWaalsContact O-CG 3.27Å; E39-R43 WeakPolarHBondContact O-CG 3.39Å; E39-R43 PolarHBondContact O-N 2.89Å; R43-R45 VanDerWaalsContact C-N 3.28Å; R43-R45 PolarHBondContact O-N 3.18Å; R43-I46 PolarHBondContact O-N 3.42Å; R43-I46 VanDerWaalsContact O-N 3.13Å; R43-E47 WeakPolarHBondContact O-CG 3.31Å; R43-E47 PolarHBondContact O-N 3.07Å |
| 44 | K | 95.8 | Very high | 90.5 | Very high | 151 Ų | 151 | 103.4 Ų | 103.4 | 66% | 0.657 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -58.5 | -39.4 | 175.6 | -74.4 | -178.4 | 177.1 | -172.8 | 0 | 112.7 | L40 V41 K42 A48 | L40-K44 WeakPolarHBondContact O-CG 3.45Å; L40-K44 PolarHBondContact O-N 3.4Å; V41-K44 PolarHBondContact O-N 2.95Å; K42-K44 PolarHBondContact O-N 3.19Å; K44-A48 WeakPolarHBondContact O-CB 3.35Å; K44-A48 PolarHBondContact O-N 2.9Å |
| 45 | R | 96.4 | Very high | 92.1 | Very high | 171 Ų | 171 | 96.6 Ų | 96.6 | 65% | 0.645 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -67.7 | -43.3 | 175.1 | -75.9 | -178.2 | 174.4 | -97.2 | 2 | 111.8 | V41 K42 R43 E47 A48 I49 | V41-R45 WeakPolarHBondContact O-CG 3.36Å; V41-R45 PolarHBondContact O-N 3.45Å; K42-R45 PolarHBondContact O-N 2.82Å; K42-R45 VanDerWaalsContact O-N 3.13Å; R43-R45 VanDerWaalsContact C-N 3.28Å; R43-R45 PolarHBondContact O-N 3.18Å; R45-E47 PolarHBondContact O-N 3.06Å; R45-A48 PolarHBondContact O-N 2.88Å; R45-A48 VanDerWaalsContact O-N 3.16Å; R45-I49 HydrophobicContact CB-CD1 4.41Å; R45-I49 WeakPolarHBondContact O-CB 3.39Å; R45-I49 WeakPolarHBondContact O-CD1 2.89Å; R45-I49 WeakPolarHBondContact O-CG1 3.44Å; R45-I49 PolarHBondContact O-N 3.05Å |
| 46 | I | 96.5 | Very high | 93.5 | Very high | 113 Ų | 113 | 93.6 Ų | 93.6 | 58% | 0.579 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -60.2 | -35.6 | 177.4 | -69.2 | 163.1 | 0 | 0 | 0 | 111 | K42 R43 P50 | K42-I46 VanDerWaalsContact O-CG1 3.26Å; K42-I46 WeakPolarHBondContact O-CG1 3.39Å; K42-I46 PolarHBondContact O-N 3.44Å; R43-I46 PolarHBondContact O-N 3.42Å; R43-I46 VanDerWaalsContact O-N 3.13Å; I46-P50 WeakPolarHBondContact O-CD 3.26Å; I46-P50 WeakPolarHBondContact O-CG 3.49Å |
| 47 | E | 96.3 | Very high | 94.7 | Very high | 152 Ų | 152 | 92.5 Ų | 92.5 | 71% | 0.71 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -76.1 | -33.4 | 175.9 | -70.8 | 171.3 | -169.4 | 0 | 0 | 112.9 | R43 R45 | R43-E47 WeakPolarHBondContact O-CG 3.31Å; R43-E47 PolarHBondContact O-N 3.07Å; R45-E47 PolarHBondContact O-N 3.06Å |
| 48 | A | 96.2 | Very high | 95.2 | Very high | 61 Ų | 61 | 97 Ų | 97 | 50% | 0.504 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -79.1 | -35.8 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | K44 R45 G51 Q52 | K44-A48 WeakPolarHBondContact O-CB 3.35Å; K44-A48 PolarHBondContact O-N 2.9Å; R45-A48 PolarHBondContact O-N 2.88Å; R45-A48 VanDerWaalsContact O-N 3.16Å; A48-G51 PolarHBondContact O-N 3.29Å; A48-Q52 PolarHBondContact O-N 2.95Å; A48-Q52 VanDerWaalsContact O-N 3.11Å |
| 49 | I | 96.8 | Very high | 95.4 | Very high | 78 Ų | 78 | 95.8 Ų | 95.8 | 40% | 0.4 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -59 | -43.6 | -176.4 | -73.1 | 163.2 | 0 | 0 | 0 | 112.8 | R45 G51 Q52 I53 | R45-I49 HydrophobicContact CB-CD1 4.41Å; R45-I49 WeakPolarHBondContact O-CB 3.39Å; R45-I49 WeakPolarHBondContact O-CD1 2.89Å; R45-I49 WeakPolarHBondContact O-CG1 3.44Å; R45-I49 PolarHBondContact O-N 3.05Å; I49-G51 VanDerWaalsContact C-N 3.32Å; I49-G51 PolarHBondContact O-N 3.28Å; I49-Q52 WeakPolarHBondContact O-CA 3.5Å; I49-Q52 WeakPolarHBondContact O-CB 3.27Å; I49-Q52 PolarHBondContact O-N 2.87Å; I49-Q52 VanDerWaalsContact O-N 3.08Å; I49-I53 HydrophobicContact CG2-CD1 3.65Å; I49-I53 HydrophobicContact CG2-CG1 4.18Å; I49-I53 WeakPolarHBondContact O-CG1 3.16Å; I49-I53 PolarHBondContact O-N 2.99Å |
| 50 | P | 96.4 | Very high | 95.7 | Very high | 64 Ų | 64 | 96.7 Ų | 96.7 | 42% | 0.416 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -57.8 | -42.9 | 176.9 | -27.2 | 34.2 | 0 | 0 | 0 | 112.8 | I46 Q52 I53 L54 | I46-P50 WeakPolarHBondContact O-CD 3.26Å; I46-P50 WeakPolarHBondContact O-CG 3.49Å; P50-Q52 VanDerWaalsContact C-N 3.29Å; P50-Q52 PolarHBondContact O-N 2.69Å; P50-I53 PolarHBondContact O-N 2.94Å; P50-L54 WeakPolarHBondContact O-CB 3.49Å; P50-L54 VanDerWaalsContact O-CG 3.31Å; P50-L54 WeakPolarHBondContact O-CG 3.34Å; P50-L54 PolarHBondContact O-N 3.5Å |
| 51 | G | 95.9 | Very high | 95.9 | Very high | 45 Ų | 45 | 95.9 Ų | 95.9 | 46% | 0.464 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63 | -38.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112 | A48 I49 S55 | A48-G51 PolarHBondContact O-N 3.29Å; I49-G51 VanDerWaalsContact C-N 3.32Å; I49-G51 PolarHBondContact O-N 3.28Å; G51-S55 VanDerWaalsContact O-CB 3.26Å; G51-S55 WeakPolarHBondContact O-CB 3.47Å; G51-S55 PolarHBondContact O-N 3.08Å; G51-S55 PolarHBondContact O-OG 3.44Å |
| 52 | Q | 96.4 | Very high | 96 | Very high | 103 Ų | 103 | 98.4 Ų | 98.4 | 48% | 0.481 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.7 | -43.1 | 174.7 | -170.4 | -179.8 | 7.2 | 0 | 0 | 112.5 | A48 I49 P50 S55 K56 | A48-Q52 PolarHBondContact O-N 2.95Å; A48-Q52 VanDerWaalsContact O-N 3.11Å; I49-Q52 WeakPolarHBondContact O-CA 3.5Å; I49-Q52 WeakPolarHBondContact O-CB 3.27Å; I49-Q52 PolarHBondContact O-N 2.87Å; I49-Q52 VanDerWaalsContact O-N 3.08Å; P50-Q52 VanDerWaalsContact C-N 3.29Å; P50-Q52 PolarHBondContact O-N 2.69Å; Q52-S55 WeakPolarHBondContact CA-OG 3.36Å; Q52-S55 PolarHBondContact O-OG 3.47Å; Q52-K56 HydrophobicContact CG-CD 4.49Å; Q52-K56 WeakPolarHBondContact O-CB 3.3Å; Q52-K56 VanDerWaalsContact O-CG 3.27Å; Q52-K56 WeakPolarHBondContact O-CG 3.45Å; Q52-K56 PolarHBondContact O-N 3.11Å |
| 53 | I | 96.6 | Very high | 95.9 | Very high | 90 Ų | 90 | 97.6 Ų | 97.6 | 46% | 0.462 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65.8 | -48.6 | 178.7 | -66.6 | 168.6 | 0 | 0 | 0 | 110.3 | I49 P50 S55 K56 L57 | I49-I53 HydrophobicContact CG2-CD1 3.65Å; I49-I53 HydrophobicContact CG2-CG1 4.18Å; I49-I53 WeakPolarHBondContact O-CG1 3.16Å; I49-I53 PolarHBondContact O-N 2.99Å; P50-I53 PolarHBondContact O-N 2.94Å; I53-S55 PolarHBondContact O-N 3.37Å; I53-K56 PolarHBondContact O-N 3.25Å; I53-L57 HydrophobicContact CG2-CD1 3.93Å; I53-L57 WeakPolarHBondContact O-CG 3.3Å; I53-L57 PolarHBondContact O-N 3.42Å |
| 54 | L | 97.3 | Very high | 95.7 | Very high | 36 Ų | 36 | 95.2 Ų | 95.2 | 19% | 0.188 | 53% | 0.525 | C | S | . | . | H | α-helix | trans | -63.1 | -42.3 | -179 | -71.9 | 176.1 | 0 | 0 | 0 | 112.1 | P50 L57 R58 L59 | P50-L54 WeakPolarHBondContact O-CB 3.49Å; P50-L54 VanDerWaalsContact O-CG 3.31Å; P50-L54 WeakPolarHBondContact O-CG 3.34Å; P50-L54 PolarHBondContact O-N 3.5Å; L54-L57 CarbonylContact O-C 3.54Å; L54-L57 PolarHBondContact O-N 2.91Å; L54-R58 PolarHBondContact O-N 3.34Å; L54-L59 WeakPolarHBondContact CB-O 3.27Å; L54-L59 HydrophobicContact CD2-CB 3.86Å; L54-L59 PolarHBondContact O-N 2.95Å |
| 55 | S | 96.6 | Very high | 95.5 | Very high | 43 Ų | 43 | 96 Ų | 96 | 30% | 0.301 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -64.7 | -40.6 | 175.3 | 53.8 | 0 | 0 | 0 | 0 | 112.8 | G51 Q52 I53 L57 R58 Y103 Y104 | G51-S55 VanDerWaalsContact O-CB 3.26Å; G51-S55 WeakPolarHBondContact O-CB 3.47Å; G51-S55 PolarHBondContact O-N 3.08Å; G51-S55 PolarHBondContact O-OG 3.44Å; Q52-S55 WeakPolarHBondContact CA-OG 3.36Å; Q52-S55 PolarHBondContact O-OG 3.47Å; I53-S55 PolarHBondContact O-N 3.37Å; S55-L57 VanDerWaalsContact C-N 3.32Å; S55-L57 PolarHBondContact O-N 3.16Å; S55-R58 PolarHBondContact O-N 3.06Å; S55-Y103 PolarHBondContact OG-OH 2.85Å; S55-Y103 VanDerWaalsContact OG-OH 3.07Å; S55-Y104 WeakPolarHBondContact O-CD1 3.26Å; S55-Y104 WeakPolarHBondContact O-CE1 3.48Å |
| 56 | K | 96.9 | Very high | 94.9 | Very high | 75 Ų | 75 | 91.6 Ų | 91.6 | 33% | 0.326 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61.6 | -38.1 | 173.5 | -79.1 | -175.3 | 163.7 | -73.8 | 0 | 112.8 | Q52 I53 R58 Y103 A105 | Q52-K56 HydrophobicContact CG-CD 4.49Å; Q52-K56 WeakPolarHBondContact O-CB 3.3Å; Q52-K56 VanDerWaalsContact O-CG 3.27Å; Q52-K56 WeakPolarHBondContact O-CG 3.45Å; Q52-K56 PolarHBondContact O-N 3.11Å; I53-K56 PolarHBondContact O-N 3.25Å; K56-R58 VanDerWaalsContact C-N 3.34Å; K56-Y103 WeakPolarHBondContact CG-O 2.97Å; K56-Y103 PolarHBondContact NZ-O 2.82Å; K56-A105 PolarHBondContact O-N 3.48Å |
| 57 | L | 96.6 | Very high | 94.3 | Very high | 91 Ų | 91 | 94.9 Ų | 94.9 | 48% | 0.476 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -84.9 | -3.9 | 178.4 | -64.1 | 177.2 | 0 | 0 | 0 | 113.9 | I53 L54 S55 L59 A105 | I53-L57 HydrophobicContact CG2-CD1 3.93Å; I53-L57 WeakPolarHBondContact O-CG 3.3Å; I53-L57 PolarHBondContact O-N 3.42Å; L54-L57 CarbonylContact O-C 3.54Å; L54-L57 PolarHBondContact O-N 2.91Å; S55-L57 VanDerWaalsContact C-N 3.32Å; S55-L57 PolarHBondContact O-N 3.16Å; L57-L59 VanDerWaalsContact C-N 3.26Å; L57-L59 HydrophobicContact CB-CD1 3.93Å; L57-L59 HydrophobicContact CB-CG 3.94Å; L57-L59 HydrophobicContact CD1-CD1 4.14Å; L57-L59 PolarHBondContact O-N 3.44Å; L57-A105 HydrophobicContact CD2-CB 3.78Å |
| 58 | R | 96.2 | Very high | 94 | Very high | 178 Ų | 178 | 92.2 Ų | 92.2 | 67% | 0.672 | 55% | 0.546 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.1 | 35.8 | -173.8 | -56.6 | -179.2 | 171 | 176 | -2.4 | 113.5 | L54 S55 K56 Y104 | L54-R58 PolarHBondContact O-N 3.34Å; S55-R58 PolarHBondContact O-N 3.06Å; K56-R58 VanDerWaalsContact C-N 3.34Å; R58-Y104 HydrophobicContact CG-CD1 3.42Å; R58-Y104 VanDerWaalsContact CG-CD1 3.42Å; R58-Y104 HydrophobicContact CG-CE1 3.53Å; R58-Y104 HydrophobicContact CG-CG 4.33Å; R58-Y104 VanDerWaalsContact NE-CD1 3.27Å |
| 59 | L | 95.6 | Very high | 93.7 | Very high | 72 Ų | 72 | 94.3 Ų | 94.3 | 38% | 0.377 | 56% | 0.555 | S | S | . | * | trans | -105.7 | 139 | 177.4 | -62.7 | 176.3 | 0 | 0 | 0 | 110.2 | L54 L57 | L54-L59 WeakPolarHBondContact CB-O 3.27Å; L54-L59 HydrophobicContact CD2-CB 3.86Å; L54-L59 PolarHBondContact O-N 2.95Å; L57-L59 VanDerWaalsContact C-N 3.26Å; L57-L59 HydrophobicContact CB-CD1 3.93Å; L57-L59 HydrophobicContact CB-CG 3.94Å; L57-L59 HydrophobicContact CD1-CD1 4.14Å; L57-L59 PolarHBondContact O-N 3.44Å | ||
| 60 | A | 94.8 | Very high | 93.4 | Very high | 107 Ų | 107 | 97 Ų | 97 | 88% | 0.884 | 58% | 0.577 | S | S | * | * | S | Bend | trans | -80.7 | -29.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||
| 61 | S | 94.7 | Very high | 93.1 | Very high | 77 Ų | 77 | 96.7 Ų | 96.7 | 54% | 0.538 | 59% | 0.585 | S | S | . | * | S | Bend | trans | -148.4 | 161.3 | -179.3 | 60.3 | 0 | 0 | 0 | 0 | 110.4 | ||
| 62 | P | 94.4 | Very high | 93 | Very high | 98 Ų | 98 | 100.7 Ų | 100.7 | 64% | 0.636 | 60% | 0.603 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 136.9 | 172.5 | -24 | 34.7 | 0 | 0 | 0 | 111.4 | ||
| 63 | P | 92.8 | Very high | 92.9 | Very high | 94 Ų | 94 | 100.7 Ų | 100.7 | 61% | 0.61 | 61% | 0.606 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 152.8 | 178.5 | 29.9 | -33.3 | 0 | 0 | 0 | 111 | Q65 | P63-Q65 PolarHBondContact O-N 3.43Š|
| 64 | S | 91.8 | Very high | 92.8 | Very high | 101 Ų | 101 | 100.4 Ų | 100.4 | 71% | 0.706 | 61% | 0.61 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 130.6 | 175.7 | 49.9 | 0 | 0 | 0 | 0 | 111.2 | G66 | S64-G66 VanDerWaalsContact C-N 3.33Š|
| 65 | Q | 89.6 | Confident | 92.7 | Very high | 167 Ų | 167 | 106.7 Ų | 106.7 | 78% | 0.78 | 64% | 0.639 | S | S | * | * | trans | -87.6 | 1.4 | 177.8 | -65.5 | -172.9 | -17.2 | 0 | 0 | 113.9 | P63 E67 V68 | P63-Q65 PolarHBondContact O-N 3.43Å; Q65-E67 PolarHBondContact O-N 3.41Å; Q65-V68 HydrophobicContact CB-CG2 4.48Å; Q65-V68 WeakPolarHBondContact O-CB 3.38Å; Q65-V68 PolarHBondContact O-N 3Å; Q65-V68 VanDerWaalsContact O-N 3.1Å | ||
| 66 | G | 83.9 | Confident | 92.5 | Very high | 79 Ų | 79 | 107.5 Ų | 107.5 | 81% | 0.814 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64 | -23.1 | -172.8 | 0 | 0 | 0 | 0 | 0 | 115 | S64 | S64-G66 VanDerWaalsContact C-N 3.33Š|
| 67 | E | 84.8 | Confident | 92.4 | Very high | 182 Ų | 182 | 107.3 Ų | 107.3 | 85% | 0.85 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.9 | -4.1 | 178.7 | -64.2 | 179.2 | -179.3 | 0 | 0 | 113.1 | Q65 P69 | Q65-E67 PolarHBondContact O-N 3.41Å; E67-P69 WeakPolarHBondContact O-CD 3.41Å |
| 68 | V | 89.6 | Confident | 92.4 | Very high | 96 Ų | 96 | 106.5 Ų | 106.5 | 58% | 0.582 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -77.6 | 122 | -178.5 | -178.5 | 0 | 0 | 0 | 0 | 108.8 | Q65 | Q65-V68 HydrophobicContact CB-CG2 4.48Å; Q65-V68 WeakPolarHBondContact O-CB 3.38Å; Q65-V68 PolarHBondContact O-N 3Å; Q65-V68 VanDerWaalsContact O-N 3.1Å |
| 69 | P | 90.3 | Very high | 92.2 | Very high | 105 Ų | 105 | 99.8 Ų | 99.8 | 68% | 0.682 | 63% | 0.631 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 133.4 | 179.1 | 25 | -32.8 | 0 | 0 | 0 | 110 | E67 | E67-P69 WeakPolarHBondContact O-CD 3.41Š|
| 70 | P | 90.1 | Very high | 92.2 | Very high | 133 Ų | 133 | 98.1 Ų | 98.1 | 86% | 0.864 | 62% | 0.622 | S | S | * | * | S | Bend | trans | -70.4 | 141.8 | 174.5 | 29.9 | -33.9 | 0 | 0 | 0 | 109.9 | ||
| 71 | G | 90.3 | Very high | 92.2 | Very high | 58 Ų | 58 | 100 Ų | 100 | 60% | 0.598 | 61% | 0.607 | S | S | * | * | S | Bend | trans | 128.6 | -170.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||
| 72 | P | 93.4 | Very high | 92.2 | Very high | 129 Ų | 129 | 99.5 Ų | 99.5 | 84% | 0.838 | 60% | 0.599 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 146.5 | 178.9 | 28.5 | -33.4 | 0 | 0 | 0 | 111.1 | ||
| 73 | L | 94.3 | Very high | 92 | Very high | 104 Ų | 104 | 97.3 Ų | 97.3 | 55% | 0.545 | 59% | 0.586 | S | S | . | * | P | Polyproline II helix | trans | -64.6 | 148 | 172.5 | -90.5 | 67.8 | 0 | 0 | 0 | 110.4 | E75 V77 L78 | L73-E75 PolarHBondContact O-N 2.83Å; L73-V77 HydrophobicContact CD2-CG1 4.03Å; L73-L78 HydrophobicContact CB-CD2 4.16Å; L73-L78 HydrophobicContact CB-CG 4.1Å |
| 74 | P | 95.2 | Very high | 91.9 | Very high | 84 Ų | 84 | 95 Ų | 95 | 55% | 0.545 | 57% | 0.57 | S | S | . | * | P | Polyproline II helix | trans | -56.5 | 139.4 | 174 | -23.3 | 33 | 0 | 0 | 0 | 112 | A76 V77 L78 | P74-A76 PolarHBondContact O-N 3.13Å; P74-A76 VanDerWaalsContact O-N 3.13Å; P74-V77 HydrophobicContact CB-CG2 4.23Å; P74-V77 HydrophobicContact CG-CG2 4.34Å; P74-V77 WeakPolarHBondContact O-CB 3.35Å; P74-V77 PolarHBondContact O-N 3.32Å; P74-L78 PolarHBondContact O-N 3.45Å; P74-L78 VanDerWaalsContact O-N 3.16Å |
| 75 | E | 94.8 | Very high | 91.8 | Very high | 168 Ų | 168 | 96.3 Ų | 96.3 | 79% | 0.785 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -56.4 | -33.9 | -178.7 | -69.3 | -165.9 | 174.7 | 0 | 0 | 113 | L73 V77 L78 A79 | L73-E75 PolarHBondContact O-N 2.83Å; E75-V77 VanDerWaalsContact C-N 3.29Å; E75-V77 PolarHBondContact O-N 2.94Å; E75-L78 PolarHBondContact O-N 2.77Å; E75-A79 VanDerWaalsContact O-CB 3.3Å; E75-A79 WeakPolarHBondContact O-CB 3.46Å; E75-A79 PolarHBondContact O-N 3.25Å |
| 76 | A | 93.2 | Very high | 91.7 | Very high | 60 Ų | 60 | 92.4 Ų | 92.4 | 50% | 0.496 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -60.1 | -38.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | P74 L80 | P74-A76 PolarHBondContact O-N 3.13Å; P74-A76 VanDerWaalsContact O-N 3.13Å; A76-L80 WeakPolarHBondContact O-CB 3.21Å; A76-L80 PolarHBondContact O-N 3.13Å; A76-L80 VanDerWaalsContact O-N 3.1Å |
| 77 | V | 94.8 | Very high | 91.6 | Very high | 70 Ų | 70 | 98.4 Ų | 98.4 | 42% | 0.424 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -71.8 | -43.4 | 177.6 | 179.9 | 0 | 0 | 0 | 0 | 110.3 | L73 P74 E75 A79 L80 Y81 | L73-V77 HydrophobicContact CD2-CG1 4.03Å; P74-V77 HydrophobicContact CB-CG2 4.23Å; P74-V77 HydrophobicContact CG-CG2 4.34Å; P74-V77 WeakPolarHBondContact O-CB 3.35Å; P74-V77 PolarHBondContact O-N 3.32Å; E75-V77 VanDerWaalsContact C-N 3.29Å; E75-V77 PolarHBondContact O-N 2.94Å; V77-A79 PolarHBondContact O-N 3.3Å; V77-L80 PolarHBondContact O-N 3.04Å; V77-Y81 WeakPolarHBondContact O-CB 3.31Å; V77-Y81 PolarHBondContact O-N 2.9Å |
| 78 | L | 95.1 | Very high | 91.1 | Very high | 75 Ų | 75 | 95.7 Ų | 95.7 | 39% | 0.393 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -61.5 | -44.6 | 176.8 | -69.1 | 173 | 0 | 0 | 0 | 111.9 | L73 P74 E75 L80 Y81 N82 | L73-L78 HydrophobicContact CB-CD2 4.16Å; L73-L78 HydrophobicContact CB-CG 4.1Å; P74-L78 PolarHBondContact O-N 3.45Å; P74-L78 VanDerWaalsContact O-N 3.16Å; E75-L78 PolarHBondContact O-N 2.77Å; L78-L80 VanDerWaalsContact C-N 3.34Å; L78-L80 PolarHBondContact O-N 3.44Å; L78-Y81 PolarHBondContact O-N 3.16Å; L78-N82 WeakPolarHBondContact O-CB 3.42Å; L78-N82 VanDerWaalsContact O-CG 3.23Å; L78-N82 PolarHBondContact O-N 3.25Å; L78-N82 PolarHBondContact O-ND2 3.13Å |
| 79 | A | 93.6 | Very high | 90.5 | Very high | 36 Ų | 36 | 95 Ų | 95 | 30% | 0.298 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -65.7 | -37.6 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | E75 V77 S83 | E75-A79 VanDerWaalsContact O-CB 3.3Å; E75-A79 WeakPolarHBondContact O-CB 3.46Å; E75-A79 PolarHBondContact O-N 3.25Å; V77-A79 PolarHBondContact O-N 3.3Å; A79-S83 WeakPolarHBondContact O-CB 3.21Å; A79-S83 PolarHBondContact O-N 3.3Å; A79-S83 PolarHBondContact O-OG 2.86Å |
| 80 | L | 95.3 | Very high | 89.1 | Confident | 37 Ų | 37 | 92 Ų | 92 | 19% | 0.194 | 53% | 0.53 | C | S | . | . | H | α-helix | trans | -64.2 | -47.5 | 173.3 | -176.3 | 62.9 | 0 | 0 | 0 | 111.8 | A76 V77 L78 S83 T84 V108 R110 | A76-L80 WeakPolarHBondContact O-CB 3.21Å; A76-L80 PolarHBondContact O-N 3.13Å; A76-L80 VanDerWaalsContact O-N 3.1Å; V77-L80 PolarHBondContact O-N 3.04Å; L78-L80 VanDerWaalsContact C-N 3.34Å; L78-L80 PolarHBondContact O-N 3.44Å; L80-S83 PolarHBondContact O-N 2.91Å; L80-S83 PolarHBondContact O-OG 2.66Å; L80-T84 PolarHBondContact O-N 3.2Å; L80-T84 PolarHBondContact O-OG1 2.89Å; L80-V108 HydrophobicContact CD1-CG1 3.94Å; L80-V108 WeakPolarHBondContact CD2-O 3.48Å; L80-V108 HydrophobicContact CG-CG1 4.35Å; L80-R110 HydrophobicContact CD1-CB 3.78Å; L80-R110 HydrophobicContact CD1-CG 3.87Å |
| 81 | Y | 95 | Very high | 87.5 | Confident | 146 Ų | 146 | 95.3 Ų | 95.3 | 57% | 0.573 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -59 | -48.2 | 176.9 | 174.7 | -98.7 | 0 | 0 | 0 | 111.8 | V77 L78 S83 T84 R85 | V77-Y81 WeakPolarHBondContact O-CB 3.31Å; V77-Y81 PolarHBondContact O-N 2.9Å; L78-Y81 PolarHBondContact O-N 3.16Å; Y81-S83 PolarHBondContact O-N 3.43Å; Y81-T84 PolarHBondContact O-N 3.19Å; Y81-T84 VanDerWaalsContact O-N 3.14Å; Y81-R85 WeakPolarHBondContact O-CB 3.34Å; Y81-R85 PolarHBondContact O-N 3.42Å |
| 82 | N | 93.4 | Very high | 85.7 | Confident | 67 Ų | 67 | 97.9 Ų | 97.9 | 36% | 0.358 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -60.4 | -45.8 | 178.9 | -71.2 | -17.6 | 0 | 0 | 0 | 111.3 | L78 T84 R85 D86 | L78-N82 WeakPolarHBondContact O-CB 3.42Å; L78-N82 VanDerWaalsContact O-CG 3.23Å; L78-N82 PolarHBondContact O-N 3.25Å; L78-N82 PolarHBondContact O-ND2 3.13Å; N82-T84 VanDerWaalsContact C-N 3.26Å; N82-T84 PolarHBondContact O-N 2.75Å; N82-R85 PolarHBondContact O-N 2.84Å; N82-D86 WeakPolarHBondContact O-CB 3.45Å; N82-D86 PolarHBondContact O-N 2.67Å |
| 83 | S | 91.3 | Very high | 83.9 | Confident | 52 Ų | 52 | 95.7 Ų | 95.7 | 36% | 0.364 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -60.6 | -35 | 176.6 | 72 | 0 | 0 | 0 | 0 | 113.2 | A79 L80 Y81 R87 | A79-S83 WeakPolarHBondContact O-CB 3.21Å; A79-S83 PolarHBondContact O-N 3.3Å; A79-S83 PolarHBondContact O-OG 2.86Å; L80-S83 PolarHBondContact O-N 2.91Å; L80-S83 PolarHBondContact O-OG 2.66Å; Y81-S83 PolarHBondContact O-N 3.43Å; S83-R87 WeakPolarHBondContact O-CD 3.37Å; S83-R87 WeakPolarHBondContact O-CG 3.49Å; S83-R87 PolarHBondContact O-N 3.31Å |
| 84 | T | 91.2 | Very high | 82 | Confident | 47 Ų | 47 | 98.7 Ų | 98.7 | 29% | 0.288 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -73.3 | -46.6 | 177.9 | -53.5 | 0 | 0 | 0 | 0 | 110.9 | L80 Y81 N82 D86 R87 V88 | L80-T84 PolarHBondContact O-N 3.2Å; L80-T84 PolarHBondContact O-OG1 2.89Å; Y81-T84 PolarHBondContact O-N 3.19Å; Y81-T84 VanDerWaalsContact O-N 3.14Å; N82-T84 VanDerWaalsContact C-N 3.26Å; N82-T84 PolarHBondContact O-N 2.75Å; T84-D86 VanDerWaalsContact C-N 3.32Å; T84-D86 PolarHBondContact O-N 3.04Å; T84-R87 PolarHBondContact O-N 3.47Å; T84-V88 WeakPolarHBondContact O-CG2 3.37Å; T84-V88 PolarHBondContact O-N 2.98Å |
| 85 | R | 89.4 | Confident | 80.1 | Confident | 128 Ų | 128 | 100.6 Ų | 100.6 | 48% | 0.483 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -59.5 | -45 | 177.9 | -174.7 | -164.9 | 68.4 | 169.7 | -1.4 | 111.1 | Y81 N82 R87 V88 A89 | Y81-R85 WeakPolarHBondContact O-CB 3.34Å; Y81-R85 PolarHBondContact O-N 3.42Å; N82-R85 PolarHBondContact O-N 2.84Å; R85-R87 VanDerWaalsContact C-N 3.34Å; R85-R87 PolarHBondContact O-N 2.97Å; R85-V88 PolarHBondContact O-N 2.8Å; R85-A89 VanDerWaalsContact O-CB 3.26Å; R85-A89 WeakPolarHBondContact O-CB 3.36Å; R85-A89 PolarHBondContact O-N 3.3Å |
| 86 | D | 87 | Confident | 78.3 | Confident | 84 Ų | 84 | 99.6 Ų | 99.6 | 45% | 0.449 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -69.7 | -32.8 | -177 | -60.7 | -13.8 | 0 | 0 | 0 | 111.2 | N82 T84 G90 | N82-D86 WeakPolarHBondContact O-CB 3.45Å; N82-D86 PolarHBondContact O-N 2.67Å; T84-D86 VanDerWaalsContact C-N 3.32Å; T84-D86 PolarHBondContact O-N 3.04Å; D86-G90 PolarHBondContact O-N 2.85Å |
| 87 | R | 81.3 | Confident | 76.5 | Confident | 205 Ų | 205 | 102.4 Ų | 102.4 | 77% | 0.774 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -65 | -37.2 | 169.5 | -74.6 | 171.2 | 68.8 | 90 | 3.4 | 113.2 | S83 T84 R85 | S83-R87 WeakPolarHBondContact O-CD 3.37Å; S83-R87 WeakPolarHBondContact O-CG 3.49Å; S83-R87 PolarHBondContact O-N 3.31Å; T84-R87 PolarHBondContact O-N 3.47Å; R85-R87 VanDerWaalsContact C-N 3.34Å; R85-R87 PolarHBondContact O-N 2.97Å |
| 88 | V | 75.3 | Confident | 74.8 | Confident | 125 Ų | 125 | 106.5 Ų | 106.5 | 76% | 0.758 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -77.8 | -31.8 | 178.8 | 173.9 | 0 | 0 | 0 | 0 | 111.6 | T84 R85 | T84-V88 WeakPolarHBondContact O-CG2 3.37Å; T84-V88 PolarHBondContact O-N 2.98Å; R85-V88 PolarHBondContact O-N 2.8Å |
| 89 | A | 75.5 | Confident | 73.5 | Confident | 81 Ų | 81 | 108.3 Ų | 108.3 | 67% | 0.669 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -86.8 | -18.6 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | R85 | R85-A89 VanDerWaalsContact O-CB 3.26Å; R85-A89 WeakPolarHBondContact O-CB 3.36Å; R85-A89 PolarHBondContact O-N 3.3Å |
| 90 | G | 60.8 | Low | 72.5 | Confident | 42 Ų | 42 | 115.6 Ų | 115.6 | 43% | 0.433 | 63% | 0.626 | S | S | . | * | S | Bend | trans | -85.1 | 120.2 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | D86 S92 | D86-G90 PolarHBondContact O-N 2.85Å; G90-S92 PolarHBondContact O-N 2.92Å |
| 91 | E | 56.4 | Low | 71.4 | Confident | 203 Ų | 203 | 117.8 Ų | 117.8 | 95% | 0.949 | 65% | 0.65 | S | S | * | * | S | Bend | trans | -68.9 | 30.6 | -176.4 | -155.3 | 157 | 126.6 | 0 | 0 | 115.8 | ||
| 92 | S | 53.4 | Low | 70.9 | Confident | 112 Ų | 112 | 115.7 Ų | 115.7 | 78% | 0.783 | 65% | 0.648 | S | S | * | * | trans | -157.2 | 46.7 | -177.6 | -142.9 | 0 | 0 | 0 | 0 | 114.8 | G90 | G90-S92 PolarHBondContact O-N 2.92Š| ||
| 93 | A | 55.6 | Low | 70.8 | Confident | 83 Ų | 83 | 118.5 Ų | 118.5 | 69% | 0.686 | 66% | 0.655 | S | S | * | * | trans | -80.5 | 114.3 | 135.6 | 0 | 0 | 0 | 0 | 0 | 103.9 | ||||
| 94 | E | 54.2 | Low | 71 | Confident | 168 Ų | 168 | 121 Ų | 121 | 79% | 0.785 | 66% | 0.657 | S | S | * | * | trans | -42.8 | 137.9 | 152.3 | -79.9 | -138.8 | 126.9 | 0 | 0 | 106.6 | E96 | E94-E96 PolarHBondContact O-N 3.47Š| ||
| 95 | P | 55.3 | Low | 71 | Confident | 123 Ų | 123 | 121.6 Ų | 121.6 | 80% | 0.799 | 67% | 0.666 | S | S | * | * | trans | -62.5 | 86.8 | 169.2 | 27.6 | -31 | 0 | 0 | 0 | 105.8 | ||||
| 96 | E | 57.3 | Low | 71.2 | Confident | 148 Ų | 148 | 122.5 Ų | 122.5 | 69% | 0.692 | 67% | 0.674 | S | S | * | * | trans | -40.2 | 132.5 | 149.6 | -93.7 | -80 | 143.9 | 0 | 0 | 104.5 | E94 E98 | E94-E96 PolarHBondContact O-N 3.47Å; E96-E98 PolarHBondContact O-N 3.25Å | ||
| 97 | P | 55.4 | Low | 71.4 | Confident | 118 Ų | 118 | 127 Ų | 127 | 77% | 0.766 | 69% | 0.692 | S | S | * | * | trans | -63.8 | 78.9 | 178.3 | 26 | -32.3 | 0 | 0 | 0 | 107.9 | ||||
| 98 | E | 59.4 | Low | 72 | Confident | 157 Ų | 157 | 121 Ų | 121 | 73% | 0.734 | 68% | 0.678 | S | S | * | * | trans | -71.9 | 126.7 | -179.3 | -80.3 | -141.7 | 152.3 | 0 | 0 | 105.6 | E96 | E96-E98 PolarHBondContact O-N 3.25Š| ||
| 99 | P | 67.4 | Low | 72.9 | Confident | 113 Ų | 113 | 120.2 Ų | 120.2 | 73% | 0.734 | 67% | 0.674 | S | S | * | * | trans | -54.4 | 151 | 164.9 | 26.5 | -33.3 | 0 | 0 | 0 | 108.6 | A101 | P99-A101 PolarHBondContact O-N 2.93Š| ||
| 100 | E | 72.2 | Confident | 73.6 | Confident | 188 Ų | 188 | 121.9 Ų | 121.9 | 88% | 0.879 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -40.8 | 115.7 | 178.2 | -64.7 | 177.1 | 178.8 | 0 | 0 | 110.6 | D102 | E100-D102 PolarHBondContact O-N 3.46Š|
| 101 | A | 71.9 | Confident | 75 | Confident | 84 Ų | 84 | 126.5 Ų | 126.5 | 69% | 0.694 | 68% | 0.682 | S | S | * | * | trans | -57.3 | 126.4 | -173.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | P99 Y103 | P99-A101 PolarHBondContact O-N 2.93Å; A101-Y103 PolarHBondContact O-N 2.93Å | ||
| 102 | D | 86.1 | Confident | 76.6 | Confident | 101 Ų | 101 | 123.4 Ų | 123.4 | 54% | 0.54 | 67% | 0.671 | S | S | . | * | trans | -53.5 | 136 | 179.7 | -65.7 | -57.2 | 0 | 0 | 0 | 110.7 | E100 Y104 K106 | E100-D102 PolarHBondContact O-N 3.46Å; D102-Y104 PolarHBondContact O-N 3.1Å; D102-Y104 VanDerWaalsContact O-N 3.17Å; D102-K106 WeakPolarHBondContact OD2-CE 3.5Å; D102-K106 IonicContact OD2-NZ 2.76Å; D102-K106 PolarHBondContact OD2-NZ 3.34Å | ||
| 103 | Y | 91.4 | Very high | 78.4 | Confident | 126 Ų | 126 | 127 Ų | 127 | 49% | 0.494 | 68% | 0.678 | S | S | . | * | S | Bend | trans | -57 | -35 | -178.8 | 175.6 | -101.7 | 0 | 0 | 0 | 112.9 | S55 K56 A101 | S55-Y103 PolarHBondContact OG-OH 2.85Å; S55-Y103 VanDerWaalsContact OG-OH 3.07Å; K56-Y103 WeakPolarHBondContact CG-O 2.97Å; K56-Y103 PolarHBondContact NZ-O 2.82Å; A101-Y103 PolarHBondContact O-N 2.93Å |
| 104 | Y | 94.4 | Very high | 80.2 | Confident | 106 Ų | 106 | 129.6 Ų | 129.6 | 42% | 0.416 | 69% | 0.685 | S | S | . | * | S | Bend | trans | -81.7 | 152.4 | -176.6 | -64.1 | -72.2 | 0 | 0 | 0 | 113 | S55 R58 D102 | S55-Y104 WeakPolarHBondContact O-CD1 3.26Å; S55-Y104 WeakPolarHBondContact O-CE1 3.48Å; R58-Y104 HydrophobicContact CG-CD1 3.42Å; R58-Y104 VanDerWaalsContact CG-CD1 3.42Å; R58-Y104 HydrophobicContact CG-CE1 3.53Å; R58-Y104 HydrophobicContact CG-CG 4.33Å; R58-Y104 VanDerWaalsContact NE-CD1 3.27Å; D102-Y104 PolarHBondContact O-N 3.1Å; D102-Y104 VanDerWaalsContact O-N 3.17Å |
| 105 | A | 92.3 | Very high | 81.7 | Confident | 58 Ų | 58 | 130.2 Ų | 130.2 | 48% | 0.479 | 69% | 0.688 | S | S | . | * | trans | -64.1 | 145.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | K56 L57 | K56-A105 PolarHBondContact O-N 3.48Å; L57-A105 HydrophobicContact CD2-CB 3.78Å | ||
| 106 | K | 92.5 | Very high | 82.8 | Confident | 148 Ų | 148 | 129.9 Ų | 129.9 | 64% | 0.643 | 68% | 0.684 | S | S | * | * | trans | -108 | 140 | 172.8 | -63.5 | -170.7 | 179 | -172.7 | 0 | 109.7 | D102 | D102-K106 WeakPolarHBondContact OD2-CE 3.5Å; D102-K106 IonicContact OD2-NZ 2.76Å; D102-K106 PolarHBondContact OD2-NZ 3.34Å | ||
| 107 | E | 92.4 | Very high | 83.2 | Confident | 178 Ų | 178 | 130.8 Ų | 130.8 | 83% | 0.832 | 69% | 0.688 | S | S | * | * | trans | -72.2 | 132.1 | 170.5 | -173.1 | 178.2 | 176.1 | 0 | 0 | 109.4 | T109 | E107-T109 HydrophobicContact CG-CG2 4.4Š| ||
| 108 | V | 93.3 | Very high | 83.3 | Confident | 78 Ų | 78 | 132.4 Ų | 132.4 | 47% | 0.473 | 69% | 0.69 | S | S | . | * | trans | -102.2 | 129.1 | 178.4 | -174.4 | 0 | 0 | 0 | 0 | 108 | L80 | L80-V108 HydrophobicContact CD1-CG1 3.94Å; L80-V108 WeakPolarHBondContact CD2-O 3.48Å; L80-V108 HydrophobicContact CG-CG1 4.35Å | ||
| 109 | T | 92.9 | Very high | 82.6 | Confident | 109 Ų | 109 | 127.4 Ų | 127.4 | 67% | 0.669 | 68% | 0.681 | S | S | * | * | trans | -133.9 | 155.7 | 174.5 | 54.2 | 0 | 0 | 0 | 0 | 109.4 | E107 | E107-T109 HydrophobicContact CG-CG2 4.4Š| ||
| 110 | R | 90.3 | Very high | 81.7 | Confident | 117 Ų | 117 | 131.6 Ų | 131.6 | 44% | 0.442 | 69% | 0.691 | S | S | . | * | trans | -127.3 | 142.2 | 176.4 | 67.9 | 179.2 | -174.7 | 169.2 | 5.4 | 110.6 | L80 | L80-R110 HydrophobicContact CD1-CB 3.78Å; L80-R110 HydrophobicContact CD1-CG 3.87Å | ||
| 111 | V | 92.1 | Very high | 80.4 | Confident | 139 Ų | 139 | 130.5 Ų | 130.5 | 84% | 0.842 | 69% | 0.69 | S | S | * | * | trans | -119.4 | 129.2 | 173.9 | -176.4 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 112 | L | 89.1 | Confident | 79.1 | Confident | 137 Ų | 137 | 130.5 Ų | 130.5 | 72% | 0.717 | 70% | 0.698 | S | S | * | * | P | Polyproline II helix | trans | -85.5 | 147.3 | 177.9 | -59 | 178.5 | 0 | 0 | 0 | 109.9 | ||
| 113 | M | 91.9 | Very high | 76.7 | Confident | 189 Ų | 189 | 129.2 Ų | 129.2 | 93% | 0.931 | 71% | 0.709 | S | S | * | * | P | Polyproline II helix | trans | -71 | 154.1 | 174 | -66.1 | -178.8 | 173.3 | 0 | 0 | 110.8 | ||
| 114 | V | 91.8 | Very high | 74.7 | Confident | 136 Ų | 136 | 128.6 Ų | 128.6 | 82% | 0.824 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 135.1 | 175.3 | -179.4 | 0 | 0 | 0 | 0 | 109.5 | T116 | V114-T116 PolarHBondContact O-N 2.87Š|
| 115 | E | 85.8 | Confident | 72.2 | Confident | 181 Ų | 181 | 127.2 Ų | 127.2 | 85% | 0.846 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -65 | 126.1 | 178.9 | -164.7 | 161.3 | -158.5 | 0 | 0 | 110.5 | H117 | E115-H117 PolarHBondContact O-N 3.4Š|
| 116 | T | 79.7 | Confident | 69.9 | Low | 117 Ų | 117 | 133.5 Ų | 133.5 | 72% | 0.718 | 77% | 0.767 | S | S | * | * | trans | -79.5 | 102.8 | 176.1 | -50.9 | 0 | 0 | 0 | 0 | 107.5 | V114 N118 | V114-T116 PolarHBondContact O-N 2.87Å; T116-N118 VanDerWaalsContact C-N 3.34Å; T116-N118 PolarHBondContact O-N 3.24Å | ||
| 117 | H | 64.8 | Low | 68.1 | Low | 166 Ų | 166 | 132.4 Ų | 132.4 | 77% | 0.769 | 78% | 0.775 | S | S | * | * | trans | -67.6 | 97.2 | 166.5 | 66 | -78.5 | 0 | 0 | 0 | 107.4 | E115 G119 | E115-H117 PolarHBondContact O-N 3.4Å; H117-G119 PolarHBondContact O-N 2.88Å | ||
| 118 | N | 57.6 | Low | 65.6 | Low | 152 Ų | 152 | 127.6 Ų | 127.6 | 81% | 0.813 | 77% | 0.774 | S | S | * | * | trans | -67.5 | 106.6 | 161.6 | -97.6 | 12.6 | 0 | 0 | 0 | 106.2 | T116 E120 | T116-N118 VanDerWaalsContact C-N 3.34Å; T116-N118 PolarHBondContact O-N 3.24Å; N118-E120 PolarHBondContact O-N 3.47Å | ||
| 119 | G | 45.9 | Very low | 63 | Low | 53 Ų | 53 | 127.6 Ų | 127.6 | 55% | 0.546 | 79% | 0.789 | S | S | . | * | trans | -48.9 | 131.7 | -177.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | H117 L121 | H117-G119 PolarHBondContact O-N 2.88Å; G119-L121 VanDerWaalsContact C-N 3.3Å; G119-L121 PolarHBondContact O-N 3.37Å | ||
| 120 | E | 48.4 | Very low | 60.5 | Low | 201 Ų | 201 | 126.1 Ų | 126.1 | 94% | 0.939 | 80% | 0.796 | S | S | * | * | trans | -49.2 | 94.2 | 157.1 | -168.5 | 155.4 | 87.6 | 0 | 0 | 109.3 | N118 | N118-E120 PolarHBondContact O-N 3.47Š| ||
| 121 | L | 43.3 | Very low | 58.7 | Low | 165 Ų | 165 | 126.4 Ų | 126.4 | 86% | 0.864 | 81% | 0.813 | S | S | * | * | trans | -120.8 | 99.4 | 163.3 | -93.8 | 154.3 | 0 | 0 | 0 | 106 | G119 G123 | G119-L121 VanDerWaalsContact C-N 3.3Å; G119-L121 PolarHBondContact O-N 3.37Å; L121-G123 PolarHBondContact O-N 3.26Å | ||
| 122 | G | 45.3 | Very low | 56.7 | Low | 84 Ų | 84 | 125.9 Ų | 125.9 | 87% | 0.866 | 81% | 0.812 | S | S | * | * | trans | -54.6 | 135.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 123 | G | 36.8 | Very low | 54.6 | Low | 74 Ų | 74 | 123.3 Ų | 123.3 | 76% | 0.763 | 82% | 0.819 | S | S | * | * | trans | -164.3 | 107.8 | 167.8 | 0 | 0 | 0 | 0 | 0 | 108.1 | L121 | L121-G123 PolarHBondContact O-N 3.26Š| ||
| 124 | A | 49.3 | Very low | 52.3 | Low | 112 Ų | 112 | 118.1 Ų | 118.1 | 93% | 0.926 | 81% | 0.814 | S | S | * | * | trans | -65.4 | 150.2 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 125 | G | 41.8 | Very low | 50.2 | Low | 78 Ų | 78 | 116.3 Ų | 116.3 | 80% | 0.804 | 81% | 0.813 | S | S | * | * | trans | 108.2 | 122.2 | 169.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 126 | E | 42.3 | Very low | 48.2 | Very low | 189 Ų | 189 | 111.3 Ų | 111.3 | 88% | 0.883 | 81% | 0.81 | S | S | * | * | cis | -159.7 | 162.5 | 22.2 | -114.7 | -166 | 94 | 0 | 0 | 108.4 | ||||
| 127 | P | 54.5 | Low | 47 | Very low | 126 Ų | 126 | 112.3 Ų | 112.3 | 82% | 0.818 | 82% | 0.816 | S | S | * | * | trans | -88.7 | 110.7 | 174.9 | 33.5 | -27 | 0 | 0 | 0 | 111.2 | ||||
| 128 | G | 40.9 | Very low | 46.6 | Very low | 77 Ų | 77 | 110 Ų | 110 | 79% | 0.794 | 82% | 0.816 | S | S | * | * | trans | -137.7 | 92.9 | -177.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 129 | G | 38.4 | Very low | 46.7 | Very low | 78 Ų | 78 | 105.8 Ų | 105.8 | 80% | 0.804 | 81% | 0.807 | S | S | * | * | trans | 70.7 | 93.6 | 142.7 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 130 | G | 41.3 | Very low | 47.4 | Very low | 78 Ų | 78 | 109.2 Ų | 109.2 | 80% | 0.804 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -77.4 | 144.4 | 154.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||
| 131 | P | 52.1 | Low | 48 | Very low | 123 Ų | 123 | 111.4 Ų | 111.4 | 80% | 0.799 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -87.6 | 154.7 | 163.9 | 29.5 | -21.7 | 0 | 0 | 0 | 111.7 | ||
| 132 | P | 49.3 | Very low | 48.8 | Very low | 127 Ų | 127 | 110.4 Ų | 110.4 | 83% | 0.825 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -78 | 158.3 | -163.8 | 31.5 | -36.1 | 0 | 0 | 0 | 114 | ||
| 133 | G | 44.7 | Very low | 49.2 | Very low | 83 Ų | 83 | 113.3 Ų | 113.3 | 86% | 0.856 | 85% | 0.85 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 142.3 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||
| 134 | G | 43.5 | Very low | 49.8 | Very low | 81 Ų | 81 | 115.3 Ų | 115.3 | 84% | 0.835 | 86% | 0.855 | S | S | * | * | P | Polyproline II helix | trans | -99.6 | 129.1 | 165.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||
| 135 | A | 48.9 | Very low | 49.8 | Very low | 98 Ų | 98 | 115.5 Ų | 115.5 | 81% | 0.81 | 85% | 0.851 | S | S | * | * | P | Polyproline II helix | trans | -49.9 | 138.6 | -171.2 | 0 | 0 | 0 | 0 | 0 | 116 | ||
| 136 | G | 43.1 | Very low | 50.3 | Low | 75 Ų | 75 | 117.6 Ų | 117.6 | 77% | 0.773 | 85% | 0.854 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 134.3 | 164.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 137 | V | 54.5 | Low | 50.7 | Low | 139 Ų | 139 | 113.4 Ų | 113.4 | 84% | 0.842 | 85% | 0.852 | S | S | * | * | P | Polyproline II helix | trans | -76 | 127.1 | 171.6 | -179.1 | 0 | 0 | 0 | 0 | 108.4 | G139 | V137-G139 PolarHBondContact O-N 3.37Š|
| 138 | P | 57 | Low | 50.5 | Low | 118 Ų | 118 | 112.6 Ų | 112.6 | 77% | 0.766 | 85% | 0.854 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 126.5 | 176.3 | 27.8 | -31.7 | 0 | 0 | 0 | 110.6 | ||
| 139 | G | 59.8 | Low | 51.1 | Low | 62 Ų | 62 | 114.9 Ų | 114.9 | 64% | 0.639 | 86% | 0.858 | S | S | * | * | P | Polyproline II helix | trans | -67 | 159.4 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | V137 R141 | V137-G139 PolarHBondContact O-N 3.37Å; G139-R141 PolarHBondContact O-N 3.06Å |
| 140 | P | 59.8 | Low | 52.1 | Low | 125 Ų | 125 | 117.6 Ų | 117.6 | 81% | 0.812 | 86% | 0.862 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 127.4 | -177.2 | 29.1 | -31.9 | 0 | 0 | 0 | 110.6 | V142 | P140-V142 PolarHBondContact O-N 3.37Š|
| 141 | R | 60.5 | Low | 52.9 | Low | 248 Ų | 248 | 120.6 Ų | 120.6 | 94% | 0.936 | 87% | 0.866 | S | S | * | * | P | Polyproline II helix | trans | -75 | 117.3 | 166.4 | -73.3 | -169.9 | -177.8 | -147.2 | 1.7 | 108.5 | G139 | G139-R141 PolarHBondContact O-N 3.06Š|
| 142 | V | 60 | Low | 52.9 | Low | 143 Ų | 143 | 120.4 Ų | 120.4 | 87% | 0.867 | 87% | 0.872 | S | S | * | * | P | Polyproline II helix | trans | -78.2 | 122.8 | 165.2 | -175.6 | 0 | 0 | 0 | 0 | 107.3 | P140 | P140-V142 PolarHBondContact O-N 3.37Š|
| 143 | G | 54.3 | Low | 53.3 | Low | 146 Ų | 146 | 119.8 Ų | 119.8 | 100% | 1.505 | 88% | 0.876 | S | S | * | * | trans | -113.7 | 0 | 161.6 | 0 | 0 | 0 | 0 | 0 | 109 |
Retrieved 143 of 143 residues in 133.4 ms
(Link to these results)