| 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 | 56.3 | Low | 73.6 | Confident | 241 Ų | 241 | 139.7 Ų | 139.7 | 100% | 1.187 | 69% | 0.691 | S | S | * | * | 0 | 113.9 | 0 | -67.1 | -73.8 | 178.2 | 0 | 0 | 107.7 | |||||
| 2 | S | 62.4 | Low | 73.2 | Confident | 122 Ų | 122 | 133.7 Ų | 133.7 | 85% | 0.853 | 69% | 0.691 | S | S | * | * | trans | -77.9 | 120.7 | 175.8 | -176.7 | 0 | 0 | 0 | 0 | 108.7 | K4 | S2-K4 PolarHBondContact O-N 3.12Å; S2-K4 VanDerWaalsContact O-N 3.17Å | ||
| 3 | T | 66.5 | Low | 72.8 | Confident | 122 Ų | 122 | 128.8 Ų | 128.8 | 75% | 0.748 | 68% | 0.675 | S | S | * | * | trans | -68.4 | 111.2 | 178.9 | 52.1 | 0 | 0 | 0 | 0 | 108.8 | V5 | T3-V5 PolarHBondContact O-N 3.24Å; T3-V5 VanDerWaalsContact O-N 3.08Å | ||
| 4 | K | 77.9 | Confident | 72.8 | Confident | 207 Ų | 207 | 135.7 Ų | 135.7 | 90% | 0.9 | 69% | 0.688 | S | S | * | * | trans | -63.2 | 112.2 | 176.1 | -89.2 | 178.8 | 174.6 | 173.4 | 0 | 109.1 | S2 | S2-K4 PolarHBondContact O-N 3.12Å; S2-K4 VanDerWaalsContact O-N 3.17Å | ||
| 5 | V | 78.6 | Confident | 72.3 | Confident | 93 Ų | 93 | 141.3 Ų | 141.3 | 56% | 0.564 | 71% | 0.706 | S | S | * | * | trans | -71.4 | 132.3 | 171.7 | 179.6 | 0 | 0 | 0 | 0 | 108.5 | T3 L9 | T3-V5 PolarHBondContact O-N 3.24Å; T3-V5 VanDerWaalsContact O-N 3.08Å; V5-L9 HydrophobicContact CG1-CB 3.77Å; V5-L9 HydrophobicContact CG1-CD1 4.19Å | ||
| 6 | P | 80.6 | Confident | 72.3 | Confident | 50 Ų | 50 | 137.8 Ų | 137.8 | 33% | 0.325 | 72% | 0.716 | S | S | . | * | trans | -55 | 141.4 | 176 | -21.9 | 27.5 | 0 | 0 | 0 | 112.8 | Y8 L9 K10 | P6-Y8 HydrophobicContact CB-CD1 3.63Å; P6-Y8 HydrophobicContact CB-CD2 4.35Å; P6-Y8 HydrophobicContact CB-CE1 3.13Å; P6-Y8 HydrophobicContact CB-CE2 3.93Å; P6-Y8 HydrophobicContact CB-CG 4.21Å; P6-Y8 HydrophobicContact CG-CE1 3.98Å; P6-Y8 HydrophobicContact CG-CE2 4.38Å; P6-Y8 WeakPolarHBondContact CG-OH 3.44Å; P6-Y8 PolarHBondContact O-N 3.47Å; P6-L9 HydrophobicContact CG-CD1 4.26Å; P6-L9 WeakPolarHBondContact O-CB 3.23Å; P6-L9 PolarHBondContact O-N 3.35Å; P6-K10 PolarHBondContact O-N 3.06Å | ||
| 7 | I | 80.7 | Confident | 72.4 | Confident | 150 Ų | 150 | 139.5 Ų | 139.5 | 77% | 0.769 | 72% | 0.717 | S | S | * | * | G | 310 helix | trans | -60.8 | -33.4 | -173.8 | -60.5 | 170.5 | 0 | 0 | 0 | 111.7 | L9 K10 | I7-L9 PolarHBondContact O-N 3.13Å; I7-K10 WeakPolarHBondContact O-CB 3.37Å; I7-K10 PolarHBondContact O-N 3.27Å |
| 8 | Y | 77 | Confident | 72.6 | Confident | 181 Ų | 181 | 142.3 Ų | 142.3 | 71% | 0.71 | 72% | 0.723 | S | S | * | * | G | 310 helix | trans | -66.2 | -21.1 | 177.4 | 58.8 | -99.6 | 0 | 0 | 0 | 113.6 | P6 | P6-Y8 HydrophobicContact CB-CD1 3.63Å; P6-Y8 HydrophobicContact CB-CD2 4.35Å; P6-Y8 HydrophobicContact CB-CE1 3.13Å; P6-Y8 HydrophobicContact CB-CE2 3.93Å; P6-Y8 HydrophobicContact CB-CG 4.21Å; P6-Y8 HydrophobicContact CG-CE1 3.98Å; P6-Y8 HydrophobicContact CG-CE2 4.38Å; P6-Y8 WeakPolarHBondContact CG-OH 3.44Å; P6-Y8 PolarHBondContact O-N 3.47Å |
| 9 | L | 80.8 | Confident | 72.8 | Confident | 30 Ų | 30 | 138.1 Ų | 138.1 | 16% | 0.157 | 70% | 0.7 | C | S | . | * | G | 310 helix | trans | -87.7 | -12.7 | 171.5 | -63.4 | -177.7 | 0 | 0 | 0 | 112.7 | V5 P6 I7 R11 L25 | V5-L9 HydrophobicContact CG1-CB 3.77Å; V5-L9 HydrophobicContact CG1-CD1 4.19Å; P6-L9 HydrophobicContact CG-CD1 4.26Å; P6-L9 WeakPolarHBondContact O-CB 3.23Å; P6-L9 PolarHBondContact O-N 3.35Å; I7-L9 PolarHBondContact O-N 3.13Å; L9-R11 VanDerWaalsContact C-N 3.35Å; L9-R11 PolarHBondContact O-N 2.97Å; L9-R11 VanDerWaalsContact O-N 3.09Å; L9-L25 HydrophobicContact CD2-CD1 4.09Å; L9-L25 HydrophobicContact CD2-CD2 3.46Å; L9-L25 VanDerWaalsContact CD2-CD2 3.46Å; L9-L25 HydrophobicContact CD2-CG 3.68Å |
| 10 | K | 75.4 | Confident | 73.4 | Confident | 168 Ų | 168 | 136.5 Ų | 136.5 | 73% | 0.73 | 69% | 0.688 | S | S | * | * | trans | -87.6 | 76.3 | -176.4 | -169.6 | 175.7 | 177.9 | 177.5 | 0 | 109.4 | P6 I7 | P6-K10 PolarHBondContact O-N 3.06Å; I7-K10 WeakPolarHBondContact O-CB 3.37Å; I7-K10 PolarHBondContact O-N 3.27Å | ||
| 11 | R | 73.4 | Confident | 73.9 | Confident | 173 Ų | 173 | 135.2 Ų | 135.2 | 65% | 0.653 | 68% | 0.683 | S | S | * | * | trans | -84.1 | 146.7 | 167.7 | -170.3 | 177.7 | -158.9 | 169.7 | 7.3 | 109.2 | L9 S13 E19 L24 | L9-R11 VanDerWaalsContact C-N 3.35Å; L9-R11 PolarHBondContact O-N 2.97Å; L9-R11 VanDerWaalsContact O-N 3.09Å; R11-S13 PolarHBondContact O-N 3.26Å; R11-E19 WeakPolarHBondContact CB-OE1 3.48Å; R11-E19 WeakPolarHBondContact CB-OE2 3.38Å; R11-L24 HydrophobicContact CB-CD2 3.85Å | ||
| 12 | G | 68.9 | Low | 75.4 | Confident | 67 Ų | 67 | 132.5 Ų | 132.5 | 69% | 0.691 | 66% | 0.659 | S | S | * | * | trans | -66.8 | 99.8 | 178.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | R14 | G12-R14 PolarHBondContact O-N 3.16Š| ||
| 13 | S | 67.5 | Low | 76.5 | Confident | 70 Ų | 70 | 131.8 Ų | 131.8 | 49% | 0.49 | 65% | 0.646 | S | S | . | * | trans | -59.1 | 103.1 | 172.6 | 172.3 | 0 | 0 | 0 | 0 | 109.4 | R11 K15 K17 | R11-S13 PolarHBondContact O-N 3.26Å; S13-K15 PolarHBondContact O-N 3.02Å; S13-K17 PolarHBondContact OG-O 2.63Å | ||
| 14 | R | 72.7 | Confident | 77.4 | Confident | 226 Ų | 226 | 127.5 Ų | 127.5 | 85% | 0.853 | 62% | 0.618 | S | S | * | * | trans | -60.7 | 126.1 | 169.6 | -76.2 | -172.8 | -88.8 | 179.7 | -5.6 | 108 | G12 G16 K17 | G12-R14 PolarHBondContact O-N 3.16Å; R14-G16 PolarHBondContact O-N 3.2Å; R14-G16 VanDerWaalsContact O-N 3.16Å; R14-K17 PolarHBondContact O-N 3.03Å | ||
| 15 | K | 65.3 | Low | 77.9 | Confident | 220 Ų | 220 | 120.2 Ų | 120.2 | 96% | 0.957 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -35 | 112.9 | -170.3 | -161.6 | 168.1 | -178.5 | 175.6 | 0 | 112.3 | S13 | S13-K15 PolarHBondContact O-N 3.02Š|
| 16 | G | 72.1 | Confident | 78.4 | Confident | 85 Ų | 85 | 118.2 Ų | 118.2 | 88% | 0.876 | 58% | 0.579 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 108.7 | -12.1 | 170.2 | 0 | 0 | 0 | 0 | 0 | 117.3 | R14 | R14-G16 PolarHBondContact O-N 3.2Å; R14-G16 VanDerWaalsContact O-N 3.16Å |
| 17 | K | 74.4 | Confident | 78.8 | Confident | 166 Ų | 166 | 120.9 Ų | 120.9 | 72% | 0.722 | 60% | 0.599 | S | S | * | * | trans | -120.2 | 105.4 | 179.8 | -162.1 | 172.4 | -179 | 179.8 | 0 | 111.7 | S13 R14 E19 | S13-K17 PolarHBondContact OG-O 2.63Å; R14-K17 PolarHBondContact O-N 3.03Å; K17-E19 PolarHBondContact O-N 3.31Å; K17-E19 VanDerWaalsContact O-N 3.08Å | ||
| 18 | K | 75.8 | Confident | 79.4 | Confident | 191 Ų | 191 | 120.2 Ų | 120.2 | 83% | 0.83 | 60% | 0.597 | S | S | * | * | trans | -61.9 | 108.8 | 166.4 | 53.4 | -178.8 | 177.5 | 178.5 | 0 | 108.6 | K20 | K18-K20 PolarHBondContact O-N 3.06Š| ||
| 19 | E | 77.6 | Confident | 80.2 | Confident | 61 Ų | 61 | 116.7 Ų | 116.7 | 29% | 0.285 | 59% | 0.588 | S | S | . | * | trans | -65.6 | 126.8 | 170 | 54.3 | -169.9 | 177.3 | 0 | 0 | 108.5 | R11 K17 L24 | R11-E19 WeakPolarHBondContact CB-OE1 3.48Å; R11-E19 WeakPolarHBondContact CB-OE2 3.38Å; K17-E19 PolarHBondContact O-N 3.31Å; K17-E19 VanDerWaalsContact O-N 3.08Å; E19-L24 HydrophobicContact CB-CD1 4.43Å; E19-L24 HydrophobicContact CB-CG 4.23Å; E19-L24 VanDerWaalsContact CD-CD2 3.47Å; E19-L24 HydrophobicContact CG-CD1 3.68Å; E19-L24 HydrophobicContact CG-CD2 4.19Å; E19-L24 HydrophobicContact CG-CG 3.96Å; E19-L24 WeakPolarHBondContact OE2-CD2 3.49Å | ||
| 20 | K | 83.9 | Confident | 80.6 | Confident | 106 Ų | 106 | 120.2 Ų | 120.2 | 46% | 0.461 | 61% | 0.606 | S | S | . | * | trans | -75.8 | 144.2 | 177.6 | -64 | 177.5 | -179.9 | 173.2 | 0 | 107.1 | K18 R22 D23 L24 | K18-K20 PolarHBondContact O-N 3.06Å; K20-R22 HydrophobicContact CB-CG 3.86Å; K20-R22 PolarHBondContact O-N 3.3Å; K20-R22 VanDerWaalsContact O-N 3.08Å; K20-D23 WeakPolarHBondContact O-CA 3.01Å; K20-D23 WeakPolarHBondContact O-CB 3.41Å; K20-D23 PolarHBondContact O-N 2.72Å; K20-L24 PolarHBondContact O-N 3.14Å | ||
| 21 | L | 84.7 | Confident | 81.5 | Confident | 111 Ų | 111 | 115.6 Ų | 115.6 | 58% | 0.581 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -53.6 | -33.5 | 176.8 | -71.5 | 174.2 | 0 | 0 | 0 | 112.5 | D23 L24 L25 | L21-D23 PolarHBondContact O-N 2.76Å; L21-L24 HydrophobicContact CD2-CD1 4.43Å; L21-L24 PolarHBondContact O-N 3.21Å; L21-L24 VanDerWaalsContact O-N 3.09Å; L21-L25 WeakPolarHBondContact O-CB 3.19Å; L21-L25 PolarHBondContact O-N 2.97Å |
| 22 | R | 86.6 | Confident | 82.5 | Confident | 184 Ų | 184 | 112.2 Ų | 112.2 | 69% | 0.694 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -61.2 | -27.5 | 174.5 | 77.6 | -178.8 | 85.3 | 161.3 | -3.9 | 114.4 | K20 | K20-R22 HydrophobicContact CB-CG 3.86Å; K20-R22 PolarHBondContact O-N 3.3Å; K20-R22 VanDerWaalsContact O-N 3.08Å |
| 23 | D | 85.3 | Confident | 83.7 | Confident | 106 Ų | 106 | 115 Ų | 115 | 57% | 0.567 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -88 | -16 | 178.9 | -56.1 | -22.9 | 0 | 0 | 0 | 110.9 | K20 L21 | K20-D23 WeakPolarHBondContact O-CA 3.01Å; K20-D23 WeakPolarHBondContact O-CB 3.41Å; K20-D23 PolarHBondContact O-N 2.72Å; L21-D23 PolarHBondContact O-N 2.76Å |
| 24 | L | 86.1 | Confident | 84.8 | Confident | 32 Ų | 32 | 117.9 Ų | 117.9 | 17% | 0.168 | 61% | 0.611 | C | S | . | * | H | α-helix | trans | -96.8 | -37.8 | 179.1 | -76.6 | 179.4 | 0 | 0 | 0 | 113 | R11 E19 K20 L21 M29 | R11-L24 HydrophobicContact CB-CD2 3.85Å; E19-L24 HydrophobicContact CB-CD1 4.43Å; E19-L24 HydrophobicContact CB-CG 4.23Å; E19-L24 VanDerWaalsContact CD-CD2 3.47Å; E19-L24 HydrophobicContact CG-CD1 3.68Å; E19-L24 HydrophobicContact CG-CD2 4.19Å; E19-L24 HydrophobicContact CG-CG 3.96Å; E19-L24 WeakPolarHBondContact OE2-CD2 3.49Å; K20-L24 PolarHBondContact O-N 3.14Å; L21-L24 HydrophobicContact CD2-CD1 4.43Å; L21-L24 PolarHBondContact O-N 3.21Å; L21-L24 VanDerWaalsContact O-N 3.09Å; L24-M29 WeakPolarHBondContact O-CE 3.4Å |
| 25 | L | 88.1 | Confident | 85.8 | Confident | 54 Ų | 54 | 109.5 Ų | 109.5 | 28% | 0.283 | 59% | 0.594 | S | S | . | * | trans | -101.6 | 108.2 | -178.7 | -73.5 | 175.2 | 0 | 0 | 0 | 109.7 | L9 L21 M29 | L9-L25 HydrophobicContact CD2-CD1 4.09Å; L9-L25 HydrophobicContact CD2-CD2 3.46Å; L9-L25 VanDerWaalsContact CD2-CD2 3.46Å; L9-L25 HydrophobicContact CD2-CG 3.68Å; L21-L25 WeakPolarHBondContact O-CB 3.19Å; L21-L25 PolarHBondContact O-N 2.97Å; L25-M29 HydrophobicContact CD2-CE 4.09Å | ||
| 26 | S | 89.6 | Confident | 87.2 | Confident | 52 Ų | 52 | 104.2 Ų | 104.2 | 36% | 0.364 | 58% | 0.577 | S | S | . | * | trans | -80 | 154.8 | 167.6 | 55 | 0 | 0 | 0 | 0 | 110.6 | D28 M29 | S26-D28 VanDerWaalsContact C-N 3.27Å; S26-D28 WeakPolarHBondContact CB-OD1 3.47Å; S26-D28 PolarHBondContact O-N 3.28Å; S26-D28 PolarHBondContact OG-OD1 3.05Å; S26-M29 PolarHBondContact O-N 2.83Å; S26-M29 VanDerWaalsContact O-N 3.11Å; S26-M29 WeakPolarHBondContact OG-CE 3.21Å; S26-M29 WeakPolarHBondContact OG-CG 3.43Å | ||
| 27 | S | 89.5 | Confident | 88.1 | Confident | 106 Ų | 106 | 108.5 Ų | 108.5 | 74% | 0.741 | 57% | 0.572 | S | S | * | * | G | 310 helix | trans | -63.4 | -29.6 | -174.3 | -55 | 0 | 0 | 0 | 0 | 113.7 | M29 I30 | S27-M29 VanDerWaalsContact C-N 3.28Å; S27-M29 PolarHBondContact O-N 3.32Å; S27-I30 PolarHBondContact O-N 3.18Å; S27-I30 VanDerWaalsContact O-N 3.15Å; S27-I30 VanDerWaalsContact O-O 3.14Å |
| 28 | D | 92.6 | Very high | 88.9 | Confident | 136 Ų | 136 | 109.8 Ų | 109.8 | 73% | 0.727 | 57% | 0.572 | S | S | * | * | G | 310 helix | trans | -69.8 | -23 | 176.1 | 63.7 | -44.6 | 0 | 0 | 0 | 113.3 | S26 I30 | S26-D28 VanDerWaalsContact C-N 3.27Å; S26-D28 WeakPolarHBondContact CB-OD1 3.47Å; S26-D28 PolarHBondContact O-N 3.28Å; S26-D28 PolarHBondContact OG-OD1 3.05Å; D28-I30 VanDerWaalsContact C-N 3.27Å |
| 29 | M | 93.1 | Very high | 89.6 | Confident | 107 Ų | 107 | 108.8 Ų | 108.8 | 53% | 0.527 | 57% | 0.57 | S | S | . | * | G | 310 helix | trans | -81.9 | -7.1 | 172.2 | -63.8 | -164.2 | -65.6 | 0 | 0 | 112.9 | L24 L25 S26 S27 | L24-M29 WeakPolarHBondContact O-CE 3.4Å; L25-M29 HydrophobicContact CD2-CE 4.09Å; S26-M29 PolarHBondContact O-N 2.83Å; S26-M29 VanDerWaalsContact O-N 3.11Å; S26-M29 WeakPolarHBondContact OG-CE 3.21Å; S26-M29 WeakPolarHBondContact OG-CG 3.43Å; S27-M29 VanDerWaalsContact C-N 3.28Å; S27-M29 PolarHBondContact O-N 3.32Å |
| 30 | I | 91 | Very high | 90.3 | Very high | 103 Ų | 103 | 109.6 Ų | 109.6 | 53% | 0.528 | 58% | 0.579 | S | S | . | * | S | Bend | trans | -101.1 | 112.3 | 176.8 | -57 | 173.4 | 0 | 0 | 0 | 107.2 | S27 D28 | S27-I30 PolarHBondContact O-N 3.18Å; S27-I30 VanDerWaalsContact O-N 3.15Å; S27-I30 VanDerWaalsContact O-O 3.14Å; D28-I30 VanDerWaalsContact C-N 3.27Å |
| 31 | S | 92.7 | Very high | 90.6 | Very high | 72 Ų | 72 | 107.4 Ų | 107.4 | 50% | 0.503 | 57% | 0.571 | S | S | . | * | P | Polyproline II helix | trans | -62.5 | 156.2 | 176.7 | 60.7 | 0 | 0 | 0 | 0 | 111.4 | ||
| 32 | P | 94.9 | Very high | 90.9 | Very high | 101 Ų | 101 | 104.5 Ų | 104.5 | 66% | 0.656 | 56% | 0.555 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 158.8 | 163.8 | -23.6 | 34.1 | 0 | 0 | 0 | 111.6 | L34 | P32-L34 WeakPolarHBondContact O-CD2 3.49Å; P32-L34 PolarHBondContact O-N 3.15Å |
| 33 | P | 93.5 | Very high | 91 | Very high | 126 Ų | 126 | 98.4 Ų | 98.4 | 82% | 0.818 | 54% | 0.536 | S | S | * | . | P | Polyproline II helix | trans | -57.3 | 124.2 | 176.3 | 24.8 | -33.7 | 0 | 0 | 0 | 110 | G35 | P33-G35 PolarHBondContact O-N 3.11Š|
| 34 | L | 92.3 | Very high | 90.8 | Very high | 131 Ų | 131 | 94.1 Ų | 94.1 | 69% | 0.686 | 52% | 0.516 | S | S | * | . | trans | -84.6 | 4 | -171.6 | -60.9 | -179.3 | 0 | 0 | 0 | 113.4 | P32 D36 | P32-L34 WeakPolarHBondContact O-CD2 3.49Å; P32-L34 PolarHBondContact O-N 3.15Å; L34-D36 PolarHBondContact O-N 3.47Å | ||
| 35 | G | 93.1 | Very high | 90.5 | Very high | 49 Ų | 49 | 96.2 Ų | 96.2 | 51% | 0.505 | 53% | 0.534 | S | S | . | . | S | Bend | trans | 70.9 | 11.7 | -174.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | P33 F37 | P33-G35 PolarHBondContact O-N 3.11Å; G35-F37 WeakPolarHBondContact O-CD2 3.45Å; G35-F37 PolarHBondContact O-N 3.3Å |
| 36 | D | 93.4 | Very high | 89.8 | Confident | 110 Ų | 110 | 95.8 Ų | 95.8 | 59% | 0.588 | 54% | 0.542 | S | S | * | . | trans | -77.3 | 59 | 172.2 | 68.7 | -39.3 | 0 | 0 | 0 | 110.7 | L34 R38 | L34-D36 PolarHBondContact O-N 3.47Å; D36-R38 WeakPolarHBondContact O-CG 3.46Å; D36-R38 PolarHBondContact O-N 2.52Å; D36-R38 VanDerWaalsContact O-N 3.1Å | ||
| 37 | F | 92.3 | Very high | 89 | Confident | 175 Ų | 175 | 94.3 Ų | 94.3 | 77% | 0.768 | 54% | 0.535 | S | S | * | . | trans | -63.3 | 117 | 179.6 | -72.7 | -81.5 | 0 | 0 | 0 | 110.3 | G35 | G35-F37 WeakPolarHBondContact O-CD2 3.45Å; G35-F37 PolarHBondContact O-N 3.3Å | ||
| 38 | R | 91.9 | Very high | 88.2 | Confident | 193 Ų | 193 | 92.5 Ų | 92.5 | 73% | 0.728 | 53% | 0.533 | S | S | * | . | trans | -112.5 | 114.6 | 178.1 | -66.4 | 176.5 | 70 | -114 | -4.7 | 108.8 | D36 T40 | D36-R38 WeakPolarHBondContact O-CG 3.46Å; D36-R38 PolarHBondContact O-N 2.52Å; D36-R38 VanDerWaalsContact O-N 3.1Å; R38-T40 HydrophobicContact CB-CG2 4.47Å; R38-T40 PolarHBondContact O-N 2.98Å; R38-T40 VanDerWaalsContact O-N 3.08Å | ||
| 39 | H | 90 | Very high | 87.3 | Confident | 170 Ų | 170 | 91.6 Ų | 91.6 | 79% | 0.787 | 54% | 0.537 | S | S | * | . | trans | -73.7 | 97 | 171.8 | -64.9 | -90.1 | 0 | 0 | 0 | 109.1 | ||||
| 40 | T | 91.8 | Very high | 86.9 | Confident | 78 Ų | 78 | 89.7 Ų | 89.7 | 48% | 0.479 | 53% | 0.53 | S | S | . | . | trans | -95.6 | -28.6 | 179.2 | 52.5 | 0 | 0 | 0 | 0 | 113 | R38 G53 | R38-T40 HydrophobicContact CB-CG2 4.47Å; R38-T40 PolarHBondContact O-N 2.98Å; R38-T40 VanDerWaalsContact O-N 3.08Å; T40-G53 WeakPolarHBondContact O-CA 3.33Å | ||
| 41 | I | 90.8 | Very high | 86.7 | Confident | 59 Ų | 59 | 86.7 Ų | 86.7 | 30% | 0.303 | 51% | 0.514 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -138 | 142.8 | -175.5 | -63.9 | 144.6 | 0 | 0 | 0 | 108.3 | I43 F52 D54 I55 F57 | I41-I43 HydrophobicContact CG2-CG1 4.16Å; I41-F52 CarbonylContact C-O 3.58Å; I41-F52 WeakPolarHBondContact CA-O 3.42Å; I41-D54 WeakPolarHBondContact CD1-O 3.49Å; I41-D54 WeakPolarHBondContact CG1-O 3.43Å; I41-I55 HydrophobicContact CG2-CG2 3.7Å; I41-F57 HydrophobicContact CD1-CD1 4.27Å; I41-F57 HydrophobicContact CD1-CE1 3.52Å; I41-F57 HydrophobicContact CD1-CZ 4.22Å; I41-F57 HydrophobicContact CG1-CE1 4.41Å |
| 42 | H | 89.7 | Confident | 86.5 | Confident | 50 Ų | 50 | 90.3 Ų | 90.3 | 23% | 0.231 | 52% | 0.521 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.4 | 133 | 170 | 176.8 | 49.2 | 0 | 0 | 0 | 109.1 | D50 M51 F52 R87 | H42-D50 IonicContact NE2-OD1 3.83Å; H42-M51 CarbonylContact O-C 3.53Å; H42-M51 WeakPolarHBondContact O-CA 3.15Å; H42-F52 HydrophobicContact CB-CB 4.24Å; H42-F52 PolarHBondContact N-O 3.46Å; H42-F52 PolarHBondContact O-N 3.09Å; H42-R87 PolarHBondContact CE1-NH1 2.78Å; H42-R87 PolarHBondContact NE2-NH1 2.66Å |
| 43 | I | 89 | Confident | 86.3 | Confident | 57 Ų | 57 | 87.2 Ų | 87.2 | 29% | 0.292 | 51% | 0.507 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.3 | 107.5 | 171.3 | -55.4 | 176.1 | 0 | 0 | 0 | 104.6 | I41 M51 L58 L65 | I41-I43 HydrophobicContact CG2-CG1 4.16Å; I43-M51 HydrophobicContact CB-CE 4.48Å; I43-M51 HydrophobicContact CD1-CE 4.04Å; I43-M51 HydrophobicContact CG1-CE 3.82Å; I43-M51 HydrophobicContact CG2-CE 4.07Å; I43-M51 HydrophobicContact CG2-CG 4.32Å; I43-L58 HydrophobicContact CD1-CD1 3.66Å; I43-L65 HydrophobicContact CD1-CD1 4.06Å; I43-L65 HydrophobicContact CD1-CD2 3.59Å; I43-L65 HydrophobicContact CD1-CG 4.48Å; I43-L65 HydrophobicContact CG2-CD1 4.16Å |
| 44 | G | 82.3 | Confident | 86.2 | Confident | 15 Ų | 15 | 86.3 Ų | 86.3 | 16% | 0.155 | 50% | 0.496 | C | S | . | . | trans | -91 | 176.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | G46 D50 | G44-G46 VanDerWaalsContact C-N 3.3Å; G44-G46 PolarHBondContact O-N 2.96Å; G44-D50 WeakPolarHBondContact CA-O 3.2Å; G44-D50 WeakPolarHBondContact CA-OD2 3.13Å; G44-D50 PolarHBondContact N-O 2.98Å | ||
| 45 | S | 78.9 | Confident | 86 | Confident | 77 Ų | 77 | 82.2 Ų | 82.2 | 54% | 0.538 | 47% | 0.474 | S | S | . | . | S | Bend | trans | -80.2 | -13.7 | -172.9 | -163.5 | 0 | 0 | 0 | 0 | 112.6 | G47 D50 | S45-G47 PolarHBondContact O-N 2.93Å; S45-D50 PolarHBondContact N-OD2 2.86Å |
| 46 | G | 73.3 | Confident | 85.7 | Confident | 45 Ų | 45 | 82.9 Ų | 82.9 | 46% | 0.464 | 47% | 0.47 | S | S | . | . | S | Bend | trans | -75 | 24.9 | 179.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | G44 S49 D50 | G44-G46 VanDerWaalsContact C-N 3.3Å; G44-G46 PolarHBondContact O-N 2.96Å; G46-S49 PolarHBondContact O-OG 3.08Å; G46-D50 PolarHBondContact N-OD2 3Å |
| 47 | G | 72.7 | Confident | 85.5 | Confident | 20 Ų | 20 | 83.5 Ų | 83.5 | 21% | 0.206 | 47% | 0.468 | C | S | . | . | G | 310 helix | trans | 58.8 | -145.8 | -177.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | S45 S49 D50 | S45-G47 PolarHBondContact O-N 2.93Å; G47-S49 PolarHBondContact O-N 3.17Å; G47-D50 PolarHBondContact O-N 3.26Å; G47-D50 VanDerWaalsContact O-N 3.11Å |
| 48 | G | 72.1 | Confident | 85.1 | Confident | 69 Ų | 69 | 75.9 Ų | 75.9 | 71% | 0.711 | 44% | 0.435 | S | S | * | . | G | 310 helix | trans | -61.6 | -15.4 | -174.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||
| 49 | S | 75.3 | Confident | 84.7 | Confident | 116 Ų | 116 | 73.3 Ų | 73.3 | 81% | 0.811 | 43% | 0.432 | S | S | * | . | G | 310 helix | trans | -85 | -16.5 | 179.1 | 71.5 | 0 | 0 | 0 | 0 | 113.9 | G46 G47 | G46-S49 PolarHBondContact O-OG 3.08Å; G47-S49 PolarHBondContact O-N 3.17Å |
| 50 | D | 83.4 | Confident | 84.3 | Confident | 68 Ų | 68 | 68.4 Ų | 68.4 | 36% | 0.364 | 43% | 0.427 | S | S | . | . | S | Bend | trans | -113.4 | 41.4 | -175.1 | -167.5 | 16.8 | 0 | 0 | 0 | 110.6 | H42 G44 S45 G46 G47 | H42-D50 IonicContact NE2-OD1 3.83Å; G44-D50 WeakPolarHBondContact CA-O 3.2Å; G44-D50 WeakPolarHBondContact CA-OD2 3.13Å; G44-D50 PolarHBondContact N-O 2.98Å; S45-D50 PolarHBondContact N-OD2 2.86Å; G46-D50 PolarHBondContact N-OD2 3Å; G47-D50 PolarHBondContact O-N 3.26Å; G47-D50 VanDerWaalsContact O-N 3.11Å |
| 51 | M | 86.9 | Confident | 83.9 | Confident | 40 Ų | 40 | 70.1 Ų | 70.1 | 20% | 0.197 | 43% | 0.428 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.3 | 137.4 | -179.1 | -59.3 | -179.7 | 80.2 | 0 | 0 | 110.6 | H42 I43 I55 L58 F62 L65 | H42-M51 CarbonylContact O-C 3.53Å; H42-M51 WeakPolarHBondContact O-CA 3.15Å; I43-M51 HydrophobicContact CB-CE 4.48Å; I43-M51 HydrophobicContact CD1-CE 4.04Å; I43-M51 HydrophobicContact CG1-CE 3.82Å; I43-M51 HydrophobicContact CG2-CE 4.07Å; I43-M51 HydrophobicContact CG2-CG 4.32Å; M51-I55 HydrophobicContact CB-CD1 4.42Å; M51-I55 HydrophobicContact CE-CB 4.43Å; M51-I55 HydrophobicContact CE-CD1 3.68Å; M51-I55 HydrophobicContact CE-CG2 4.06Å; M51-I55 HydrophobicContact SD-CD1 4.11Å; M51-L58 HydrophobicContact CE-CD1 4.45Å; M51-F62 HydrophobicContact CE-CE1 4.27Å; M51-L65 HydrophobicContact CE-CD1 3.76Å |
| 52 | F | 89 | Confident | 83.4 | Confident | 148 Ų | 148 | 70.6 Ų | 70.6 | 65% | 0.649 | 43% | 0.428 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -138 | 149 | 177.2 | 169.5 | -98 | 0 | 0 | 0 | 111.2 | I41 H42 | I41-F52 CarbonylContact C-O 3.58Å; I41-F52 WeakPolarHBondContact CA-O 3.42Å; H42-F52 HydrophobicContact CB-CB 4.24Å; H42-F52 PolarHBondContact N-O 3.46Å; H42-F52 PolarHBondContact O-N 3.09Å |
| 53 | G | 91.4 | Very high | 83 | Confident | 36 Ų | 36 | 74.8 Ų | 74.8 | 37% | 0.371 | 45% | 0.447 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 94 | -174.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | T40 I55 | T40-G53 WeakPolarHBondContact O-CA 3.33Å; G53-I55 PolarHBondContact O-N 3.18Å; G53-I55 VanDerWaalsContact O-N 3.09Å |
| 54 | D | 90.8 | Very high | 82.7 | Confident | 107 Ų | 107 | 77.6 Ų | 77.6 | 57% | 0.572 | 46% | 0.462 | S | S | * | . | trans | -79.8 | 92.5 | -177.1 | -174.9 | 9.6 | 0 | 0 | 0 | 111.7 | I41 S56 F57 | I41-D54 WeakPolarHBondContact CD1-O 3.49Å; I41-D54 WeakPolarHBondContact CG1-O 3.43Å; D54-S56 VanDerWaalsContact C-N 3.33Å; D54-S56 WeakPolarHBondContact OD1-CB 3.34Å; D54-S56 PolarHBondContact OD1-N 2.89Å; D54-S56 VanDerWaalsContact OD1-N 3.11Å; D54-S56 PolarHBondContact OD1-OG 3.09Å; D54-F57 WeakPolarHBondContact O-CD1 3.33Å; D54-F57 WeakPolarHBondContact O-CE1 3.18Å | ||
| 55 | I | 88.4 | Confident | 82.5 | Confident | 45 Ų | 45 | 78 Ų | 78 | 23% | 0.231 | 46% | 0.461 | C | S | . | . | trans | -93.5 | 13.6 | 177.4 | 59.2 | 170.1 | 0 | 0 | 0 | 113 | I41 M51 G53 F57 L58 F62 | I41-I55 HydrophobicContact CG2-CG2 3.7Å; M51-I55 HydrophobicContact CB-CD1 4.42Å; M51-I55 HydrophobicContact CE-CB 4.43Å; M51-I55 HydrophobicContact CE-CD1 3.68Å; M51-I55 HydrophobicContact CE-CG2 4.06Å; M51-I55 HydrophobicContact SD-CD1 4.11Å; G53-I55 PolarHBondContact O-N 3.18Å; G53-I55 VanDerWaalsContact O-N 3.09Å; I55-F57 PolarHBondContact O-N 3.15Å; I55-F57 VanDerWaalsContact O-N 3.1Å; I55-L58 HydrophobicContact CB-CD1 4.25Å; I55-L58 HydrophobicContact CG2-CD1 4.38Å; I55-L58 WeakPolarHBondContact O-CB 3.4Å; I55-L58 PolarHBondContact O-N 3.47Å; I55-F62 HydrophobicContact CD1-CE1 4.25Å | ||
| 56 | S | 87.4 | Confident | 81.9 | Confident | 62 Ų | 62 | 78.2 Ų | 78.2 | 43% | 0.434 | 46% | 0.46 | S | S | . | . | G | 310 helix | trans | -59.4 | -27.9 | -177 | -56.6 | 0 | 0 | 0 | 0 | 113 | D54 L58 Q59 | D54-S56 VanDerWaalsContact C-N 3.33Å; D54-S56 WeakPolarHBondContact OD1-CB 3.34Å; D54-S56 PolarHBondContact OD1-N 2.89Å; D54-S56 VanDerWaalsContact OD1-N 3.11Å; D54-S56 PolarHBondContact OD1-OG 3.09Å; S56-L58 PolarHBondContact O-N 3.34Å; S56-Q59 VanDerWaalsContact CB-NE2 3.32Å; S56-Q59 WeakPolarHBondContact O-CB 3.14Å; S56-Q59 WeakPolarHBondContact O-CG 3.47Å; S56-Q59 PolarHBondContact O-N 3.1Å; S56-Q59 PolarHBondContact O-NE2 2.8Å |
| 57 | F | 87.4 | Confident | 81.4 | Confident | 123 Ų | 123 | 79.3 Ų | 79.3 | 54% | 0.539 | 47% | 0.471 | S | S | . | . | G | 310 helix | trans | -65.5 | -18.8 | 176.1 | 73.7 | -82.2 | 0 | 0 | 0 | 113.9 | I41 D54 I55 | I41-F57 HydrophobicContact CD1-CD1 4.27Å; I41-F57 HydrophobicContact CD1-CE1 3.52Å; I41-F57 HydrophobicContact CD1-CZ 4.22Å; I41-F57 HydrophobicContact CG1-CE1 4.41Å; D54-F57 WeakPolarHBondContact O-CD1 3.33Å; D54-F57 WeakPolarHBondContact O-CE1 3.18Å; I55-F57 PolarHBondContact O-N 3.15Å; I55-F57 VanDerWaalsContact O-N 3.1Å |
| 58 | L | 85.6 | Confident | 80.7 | Confident | 15 Ų | 15 | 79.9 Ų | 79.9 | 8% | 0.079 | 47% | 0.471 | C | S | . | . | G | 310 helix | trans | -91.6 | -2.4 | 178.5 | -65.1 | 169.2 | 0 | 0 | 0 | 113.2 | I43 M51 I55 S56 G60 K61 F62 L65 | I43-L58 HydrophobicContact CD1-CD1 3.66Å; M51-L58 HydrophobicContact CE-CD1 4.45Å; I55-L58 HydrophobicContact CB-CD1 4.25Å; I55-L58 HydrophobicContact CG2-CD1 4.38Å; I55-L58 WeakPolarHBondContact O-CB 3.4Å; I55-L58 PolarHBondContact O-N 3.47Å; S56-L58 PolarHBondContact O-N 3.34Å; L58-G60 PolarHBondContact O-N 3.09Å; L58-K61 CarbonylContact O-C 3.54Å; L58-K61 WeakPolarHBondContact O-CA 3.49Å; L58-K61 PolarHBondContact O-N 3.34Å; L58-F62 HydrophobicContact CB-CD1 4.29Å; L58-F62 HydrophobicContact CB-CE1 4Å; L58-F62 HydrophobicContact CB-CZ 4.36Å; L58-F62 PolarHBondContact O-N 3.3Å; L58-L65 HydrophobicContact CD1-CD1 4.09Å; L58-L65 HydrophobicContact CD1-CD2 4Å; L58-L65 HydrophobicContact CD1-CG 4.45Å; L58-L65 HydrophobicContact CD2-CD2 4.23Å |
| 59 | Q | 81.7 | Confident | 79.9 | Confident | 139 Ų | 139 | 82.8 Ų | 82.8 | 65% | 0.65 | 47% | 0.474 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.9 | 116.4 | 179 | -71.3 | 171.4 | 27.2 | 0 | 0 | 110.4 | S56 K61 | S56-Q59 VanDerWaalsContact CB-NE2 3.32Å; S56-Q59 WeakPolarHBondContact O-CB 3.14Å; S56-Q59 WeakPolarHBondContact O-CG 3.47Å; S56-Q59 PolarHBondContact O-N 3.1Å; S56-Q59 PolarHBondContact O-NE2 2.8Å; Q59-K61 VanDerWaalsContact C-N 3.32Å; Q59-K61 PolarHBondContact O-N 2.83Å |
| 60 | G | 81.9 | Confident | 79 | Confident | 67 Ų | 67 | 82.3 Ų | 82.3 | 69% | 0.691 | 47% | 0.466 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 81.8 | -1.4 | -176.3 | 0 | 0 | 0 | 0 | 0 | 116 | L58 | L58-G60 PolarHBondContact O-N 3.09Š|
| 61 | K | 84.4 | Confident | 77.3 | Confident | 115 Ų | 115 | 87.4 Ų | 87.4 | 50% | 0.5 | 49% | 0.488 | S | S | . | . | trans | -120.8 | 18.2 | -178.7 | -61 | 179.3 | -177.1 | 177.1 | 0 | 113.2 | L58 Q59 H63 L64 | L58-K61 CarbonylContact O-C 3.54Å; L58-K61 WeakPolarHBondContact O-CA 3.49Å; L58-K61 PolarHBondContact O-N 3.34Å; Q59-K61 VanDerWaalsContact C-N 3.32Å; Q59-K61 PolarHBondContact O-N 2.83Å; K61-H63 PolarHBondContact O-N 3.08Å; K61-L64 HydrophobicContact CB-CD1 4.04Å; K61-L64 HydrophobicContact CB-CG 4.42Å; K61-L64 HydrophobicContact CD-CD1 4.41Å; K61-L64 WeakPolarHBondContact O-CB 3.3Å; K61-L64 PolarHBondContact O-N 3.22Å | ||
| 62 | F | 79.4 | Confident | 75.2 | Confident | 69 Ų | 69 | 93.4 Ų | 93.4 | 30% | 0.303 | 52% | 0.516 | S | S | . | . | G | 310 helix | trans | -57.9 | -31.2 | 177 | -65.4 | -75.9 | 0 | 0 | 0 | 111.8 | M51 I55 L58 L64 L65 T68 | M51-F62 HydrophobicContact CE-CE1 4.27Å; I55-F62 HydrophobicContact CD1-CE1 4.25Å; L58-F62 HydrophobicContact CB-CD1 4.29Å; L58-F62 HydrophobicContact CB-CE1 4Å; L58-F62 HydrophobicContact CB-CZ 4.36Å; L58-F62 PolarHBondContact O-N 3.3Å; F62-L64 PolarHBondContact O-N 3.08Å; F62-L65 HydrophobicContact CD1-CD1 4Å; F62-L65 VanDerWaalsContact O-CB 3.25Å; F62-L65 WeakPolarHBondContact O-CB 3.42Å; F62-L65 WeakPolarHBondContact O-CG 3.23Å; F62-L65 PolarHBondContact O-N 3.16Å; F62-T68 PolarHBondContact O-OG1 2.77Å |
| 63 | H | 81.5 | Confident | 73.2 | Confident | 137 Ų | 137 | 91.4 Ų | 91.4 | 63% | 0.634 | 52% | 0.518 | S | S | * | . | G | 310 helix | trans | -56.4 | -17.7 | 173.7 | 67.9 | -91.6 | 0 | 0 | 0 | 115.3 | K61 L65 | K61-H63 PolarHBondContact O-N 3.08Å; H63-L65 VanDerWaalsContact C-N 3.29Å |
| 64 | L | 82.6 | Confident | 70.8 | Confident | 116 Ų | 116 | 97.7 Ų | 97.7 | 61% | 0.607 | 54% | 0.537 | S | S | * | . | G | 310 helix | trans | -81.7 | -11 | 174.8 | -58.6 | 179.6 | 0 | 0 | 0 | 112.7 | K61 F62 | K61-L64 HydrophobicContact CB-CD1 4.04Å; K61-L64 HydrophobicContact CB-CG 4.42Å; K61-L64 HydrophobicContact CD-CD1 4.41Å; K61-L64 WeakPolarHBondContact O-CB 3.3Å; K61-L64 PolarHBondContact O-N 3.22Å; F62-L64 PolarHBondContact O-N 3.08Å |
| 65 | L | 78.8 | Confident | 68.8 | Low | 25 Ų | 25 | 100.5 Ų | 100.5 | 13% | 0.131 | 55% | 0.547 | C | S | . | . | S | Bend | trans | -83 | 131.8 | 177.1 | -57.7 | -179.4 | 0 | 0 | 0 | 109.6 | I43 M51 L58 F62 H63 G67 T68 | I43-L65 HydrophobicContact CD1-CD1 4.06Å; I43-L65 HydrophobicContact CD1-CD2 3.59Å; I43-L65 HydrophobicContact CD1-CG 4.48Å; I43-L65 HydrophobicContact CG2-CD1 4.16Å; M51-L65 HydrophobicContact CE-CD1 3.76Å; L58-L65 HydrophobicContact CD1-CD1 4.09Å; L58-L65 HydrophobicContact CD1-CD2 4Å; L58-L65 HydrophobicContact CD1-CG 4.45Å; L58-L65 HydrophobicContact CD2-CD2 4.23Å; F62-L65 HydrophobicContact CD1-CD1 4Å; F62-L65 VanDerWaalsContact O-CB 3.25Å; F62-L65 WeakPolarHBondContact O-CB 3.42Å; F62-L65 WeakPolarHBondContact O-CG 3.23Å; F62-L65 PolarHBondContact O-N 3.16Å; H63-L65 VanDerWaalsContact C-N 3.29Å; L65-G67 PolarHBondContact O-N 3.14Å; L65-T68 HydrophobicContact CB-CG2 3.95Å; L65-T68 HydrophobicContact CD1-CG2 4.14Å; L65-T68 PolarHBondContact O-OG1 3.37Å |
| 66 | P | 66 | Low | 66.7 | Low | 81 Ų | 81 | 105.9 Ų | 105.9 | 53% | 0.526 | 58% | 0.576 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -59.8 | 129.6 | 170.6 | -23 | 35.1 | 0 | 0 | 0 | 110.4 | F85 | P66-F85 HydrophobicContact CB-CE2 4.03Å; P66-F85 HydrophobicContact CG-CE2 3.94Å |
| 67 | G | 61.8 | Low | 64.4 | Low | 67 Ų | 67 | 106.3 Ų | 106.3 | 69% | 0.691 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 87.6 | -1.6 | 172.8 | 0 | 0 | 0 | 0 | 0 | 116.5 | L65 V69 | L65-G67 PolarHBondContact O-N 3.14Å; G67-V69 VanDerWaalsContact C-N 3.32Å; G67-V69 PolarHBondContact O-N 3.05Å |
| 68 | T | 59.1 | Low | 62.5 | Low | 32 Ų | 32 | 106.9 Ų | 106.9 | 20% | 0.196 | 60% | 0.604 | C | S | . | * | trans | -90.2 | 71.9 | 169.4 | 65.6 | 0 | 0 | 0 | 0 | 109.9 | F62 L65 V70 | F62-T68 PolarHBondContact O-OG1 2.77Å; L65-T68 HydrophobicContact CB-CG2 3.95Å; L65-T68 HydrophobicContact CD1-CG2 4.14Å; L65-T68 PolarHBondContact O-OG1 3.37Å; T68-V70 VanDerWaalsContact C-N 3.26Å; T68-V70 PolarHBondContact O-N 3.08Å; T68-V70 VanDerWaalsContact O-N 3.07Å | ||
| 69 | V | 55.4 | Low | 60.4 | Low | 130 Ų | 130 | 115.5 Ų | 115.5 | 79% | 0.788 | 64% | 0.641 | S | S | * | * | trans | -72.7 | 94.5 | 157.9 | -176.9 | 0 | 0 | 0 | 0 | 105.2 | G67 E71 | G67-V69 VanDerWaalsContact C-N 3.32Å; G67-V69 PolarHBondContact O-N 3.05Å; V69-E71 PolarHBondContact O-N 2.89Å | ||
| 70 | V | 55.3 | Low | 58.7 | Low | 106 Ų | 106 | 116.6 Ų | 116.6 | 64% | 0.642 | 65% | 0.652 | S | S | * | * | trans | -68.9 | 117 | 158.5 | 176.1 | 0 | 0 | 0 | 0 | 104.2 | T68 E72 | T68-V70 VanDerWaalsContact C-N 3.26Å; T68-V70 PolarHBondContact O-N 3.08Å; T68-V70 VanDerWaalsContact O-N 3.07Å; V70-E72 PolarHBondContact O-N 3.42Å | ||
| 71 | E | 49.2 | Very low | 56.9 | Low | 176 Ų | 176 | 120.4 Ų | 120.4 | 82% | 0.822 | 66% | 0.656 | S | S | * | * | trans | -51.4 | 108.6 | 177.2 | -60 | -167.7 | 158.9 | 0 | 0 | 110.1 | V69 | V69-E71 PolarHBondContact O-N 2.89Š| ||
| 72 | E | 42.9 | Very low | 55.1 | Low | 166 Ų | 166 | 119.9 Ų | 119.9 | 78% | 0.776 | 66% | 0.664 | S | S | * | * | trans | -107.8 | 124.4 | 152 | -69.8 | -73 | 142.8 | 0 | 0 | 104.7 | V70 E74 | V70-E72 PolarHBondContact O-N 3.42Å; E72-E74 PolarHBondContact O-N 2.97Å; E72-E74 VanDerWaalsContact O-N 3.14Å | ||
| 73 | P | 46.7 | Very low | 53.6 | Low | 106 Ų | 106 | 124.4 Ų | 124.4 | 69% | 0.688 | 68% | 0.684 | S | S | * | * | trans | -89.5 | 78.6 | -166.2 | 35.4 | -33.2 | 0 | 0 | 0 | 110.6 | ||||
| 74 | E | 40.8 | Very low | 52 | Low | 167 Ų | 167 | 124.9 Ų | 124.9 | 78% | 0.78 | 69% | 0.686 | S | S | * | * | trans | -141.4 | 109.2 | 171.1 | -61.9 | -64.7 | 149.4 | 0 | 0 | 112.4 | E72 | E72-E74 PolarHBondContact O-N 2.97Å; E72-E74 VanDerWaalsContact O-N 3.14Å | ||
| 75 | E | 48.9 | Very low | 50.3 | Low | 166 Ų | 166 | 125.2 Ų | 125.2 | 78% | 0.776 | 68% | 0.683 | S | S | * | * | trans | 22.2 | 129.1 | 155.8 | -55.5 | -163.2 | 153 | 0 | 0 | 122.5 | ||||
| 76 | D | 43.4 | Very low | 48.7 | Very low | 159 Ų | 159 | 129.5 Ų | 129.5 | 85% | 0.85 | 71% | 0.71 | S | S | * | * | trans | 61.1 | 96.4 | 142.4 | -62.3 | -15.4 | 0 | 0 | 0 | 119.4 | ||||
| 77 | G | 38.5 | Very low | 47.8 | Very low | 71 Ų | 71 | 132.8 Ų | 132.8 | 73% | 0.732 | 71% | 0.712 | S | S | * | * | trans | -179.7 | 74.9 | 167.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | F79 | G77-F79 PolarHBondContact O-N 3.25Š| ||
| 78 | T | 48.7 | Very low | 47 | Very low | 134 Ų | 134 | 135.5 Ų | 135.5 | 82% | 0.822 | 72% | 0.715 | S | S | * | * | trans | -39 | 94.4 | 168.8 | -54.3 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 79 | F | 41.3 | Very low | 46.2 | Very low | 196 Ų | 196 | 136.6 Ų | 136.6 | 86% | 0.86 | 73% | 0.728 | S | S | * | * | trans | -151.9 | 63.2 | 152.5 | -71.2 | -69.6 | 0 | 0 | 0 | 109.8 | G77 L81 | G77-F79 PolarHBondContact O-N 3.25Å; F79-L81 VanDerWaalsContact C-N 3.29Å; F79-L81 PolarHBondContact O-N 2.99Å | ||
| 80 | D | 44.9 | Very low | 45.7 | Very low | 163 Ų | 163 | 137 Ų | 137 | 87% | 0.872 | 73% | 0.731 | S | S | * | * | trans | -75.7 | 83.1 | 169.6 | -123 | -12.8 | 0 | 0 | 0 | 109 | ||||
| 81 | L | 44.9 | Very low | 44.8 | Very low | 147 Ų | 147 | 138.4 Ų | 138.4 | 77% | 0.77 | 74% | 0.739 | S | S | * | * | trans | -103.1 | 107.9 | 162.7 | -73.2 | 169.6 | 0 | 0 | 0 | 107 | F79 F83 | F79-L81 VanDerWaalsContact C-N 3.29Å; F79-L81 PolarHBondContact O-N 2.99Å; L81-F83 VanDerWaalsContact C-N 3.32Å; L81-F83 PolarHBondContact O-N 3.03Å | ||
| 82 | P | 46 | Very low | 44.6 | Very low | 104 Ų | 104 | 136.3 Ų | 136.3 | 68% | 0.675 | 74% | 0.743 | S | S | * | * | trans | -66.7 | 97 | 172.8 | 27.3 | -32 | 0 | 0 | 0 | 107.6 | Q84 | P82-Q84 PolarHBondContact O-N 3.44Š| ||
| 83 | F | 49.2 | Very low | 44.7 | Very low | 163 Ų | 163 | 131.7 Ų | 131.7 | 72% | 0.715 | 74% | 0.739 | S | S | * | * | trans | -70.9 | 86.2 | 171.2 | -168.4 | -94.1 | 0 | 0 | 0 | 107.7 | L81 F85 | L81-F83 VanDerWaalsContact C-N 3.32Å; L81-F83 PolarHBondContact O-N 3.03Å; F83-F85 PolarHBondContact O-N 2.79Å | ||
| 84 | Q | 47.5 | Very low | 44.5 | Very low | 148 Ų | 148 | 137.4 Ų | 137.4 | 69% | 0.692 | 75% | 0.747 | S | S | * | * | trans | -68.4 | 118.8 | 175.6 | -65 | -162.7 | 36.8 | 0 | 0 | 108.5 | P82 T86 | P82-Q84 PolarHBondContact O-N 3.44Å; Q84-T86 VanDerWaalsContact C-N 3.29Å; Q84-T86 PolarHBondContact O-N 3.46Å | ||
| 85 | F | 46 | Very low | 44.8 | Very low | 122 Ų | 122 | 137.2 Ų | 137.2 | 54% | 0.535 | 75% | 0.746 | S | S | . | * | trans | -61.9 | 96.5 | 161.3 | -108 | -92.2 | 0 | 0 | 0 | 107.3 | P66 F83 R87 | P66-F85 HydrophobicContact CB-CE2 4.03Å; P66-F85 HydrophobicContact CG-CE2 3.94Å; F83-F85 PolarHBondContact O-N 2.79Å; F85-R87 PolarHBondContact O-N 3.01Å | ||
| 86 | T | 45.7 | Very low | 44.6 | Very low | 115 Ų | 115 | 136.5 Ų | 136.5 | 71% | 0.706 | 75% | 0.747 | S | S | * | * | trans | -66.2 | 76 | 163 | 24.1 | 0 | 0 | 0 | 0 | 108.3 | Q84 T88 | Q84-T86 VanDerWaalsContact C-N 3.29Å; Q84-T86 PolarHBondContact O-N 3.46Å; T86-T88 PolarHBondContact O-N 2.87Å | ||
| 87 | R | 48.1 | Very low | 44.6 | Very low | 150 Ų | 150 | 134.3 Ų | 134.3 | 57% | 0.566 | 74% | 0.741 | S | S | * | * | trans | -74.5 | 117.9 | 163.2 | -171.6 | -178.2 | 178 | -167.7 | 4.7 | 105.9 | H42 F85 A89 | H42-R87 PolarHBondContact CE1-NH1 2.78Å; H42-R87 PolarHBondContact NE2-NH1 2.66Å; F85-R87 PolarHBondContact O-N 3.01Å; R87-A89 HydrophobicContact CG-CB 3.95Å; R87-A89 PolarHBondContact O-N 3.01Å | ||
| 88 | T | 45.1 | Very low | 44.9 | Very low | 124 Ų | 124 | 138.7 Ų | 138.7 | 76% | 0.761 | 75% | 0.748 | S | S | * | * | trans | -67.7 | 67.8 | 160.4 | 45.6 | 0 | 0 | 0 | 0 | 108.6 | T86 T90 | T86-T88 PolarHBondContact O-N 2.87Å; T88-T90 PolarHBondContact O-N 3.38Å | ||
| 89 | A | 41.3 | Very low | 45.1 | Very low | 55 Ų | 55 | 134.9 Ų | 134.9 | 46% | 0.455 | 74% | 0.735 | S | S | . | * | trans | -81.5 | 114.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 108.6 | R87 V91 | R87-A89 HydrophobicContact CG-CB 3.95Å; R87-A89 PolarHBondContact O-N 3.01Å; A89-V91 PolarHBondContact O-N 3.28Å | ||
| 90 | T | 45.3 | Very low | 45.3 | Very low | 140 Ų | 140 | 132 Ų | 132 | 86% | 0.859 | 74% | 0.736 | S | S | * | * | trans | -65.3 | 92.7 | 164.4 | 51 | 0 | 0 | 0 | 0 | 109.5 | T88 | T88-T90 PolarHBondContact O-N 3.38Š| ||
| 91 | V | 36.2 | Very low | 45.4 | Very low | 134 Ų | 134 | 127.9 Ų | 127.9 | 81% | 0.812 | 72% | 0.72 | S | S | * | * | trans | -131.8 | 124.8 | 155.3 | 166.9 | 0 | 0 | 0 | 0 | 108.5 | A89 | A89-V91 PolarHBondContact O-N 3.28Š| ||
| 92 | C | 44.5 | Very low | 45.6 | Very low | 133 Ų | 133 | 126.1 Ų | 126.1 | 90% | 0.899 | 72% | 0.717 | S | S | * | * | trans | -59.6 | 133 | 179.4 | -171.6 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 93 | G | 46 | Very low | 46 | Very low | 68 Ų | 68 | 126.9 Ų | 126.9 | 70% | 0.701 | 72% | 0.715 | S | S | * | * | trans | 113.8 | 110 | 153.7 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 94 | R | 42.7 | Very low | 46.4 | Very low | 227 Ų | 227 | 125.9 Ų | 125.9 | 86% | 0.857 | 72% | 0.717 | S | S | * | * | S | Bend | trans | 89.8 | 114.7 | 151.9 | -162.1 | 155.8 | 167.6 | -90.5 | -4.5 | 116.5 | ||
| 95 | E | 46.3 | Very low | 47.2 | Very low | 162 Ų | 162 | 128.6 Ų | 128.6 | 76% | 0.757 | 73% | 0.726 | S | S | * | * | trans | 57.5 | 101.3 | 169.7 | -38.5 | -50.3 | 94.9 | 0 | 0 | 118.5 | ||||
| 96 | L | 45.9 | Very low | 47.7 | Very low | 152 Ų | 152 | 130.3 Ų | 130.3 | 80% | 0.796 | 74% | 0.741 | S | S | * | * | trans | -78.6 | 126 | 169 | 178.7 | 74.6 | 0 | 0 | 0 | 110.1 | ||||
| 97 | P | 42.4 | Very low | 48.4 | Very low | 112 Ų | 112 | 127.8 Ų | 127.8 | 73% | 0.727 | 73% | 0.732 | S | S | * | * | trans | -80.1 | 130.1 | 158.6 | 28.7 | -27.8 | 0 | 0 | 0 | 110.5 | G99 | P97-G99 PolarHBondContact O-N 3.09Š| ||
| 98 | D | 45.5 | Very low | 49.1 | Very low | 164 Ų | 164 | 128.6 Ų | 128.6 | 88% | 0.877 | 75% | 0.746 | S | S | * | * | trans | -61.1 | 106.4 | 178.1 | -72.8 | -52 | 0 | 0 | 0 | 112 | ||||
| 99 | G | 51.3 | Low | 49.3 | Very low | 53 Ų | 53 | 127.4 Ų | 127.4 | 55% | 0.546 | 74% | 0.742 | S | S | . | * | trans | -163.7 | 137.1 | 170.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | P97 S101 | P97-G99 PolarHBondContact O-N 3.09Å; G99-S101 PolarHBondContact O-N 3.16Å; G99-S101 VanDerWaalsContact O-N 3.16Å | ||
| 100 | P | 46.5 | Very low | 50.2 | Low | 135 Ų | 135 | 132.1 Ų | 132.1 | 88% | 0.877 | 76% | 0.759 | S | S | * | * | trans | -67.3 | 115.6 | -178.9 | 27.7 | -33.2 | 0 | 0 | 0 | 109.9 | ||||
| 101 | S | 46.1 | Very low | 50.7 | Low | 77 Ų | 77 | 131 Ų | 131 | 54% | 0.538 | 75% | 0.754 | S | S | . | * | trans | -63.8 | 138.7 | 175.9 | -30.2 | 0 | 0 | 0 | 0 | 109.8 | G99 L103 | G99-S101 PolarHBondContact O-N 3.16Å; G99-S101 VanDerWaalsContact O-N 3.16Å; S101-L103 PolarHBondContact O-N 2.77Å | ||
| 102 | P | 49.5 | Very low | 51.6 | Low | 110 Ų | 110 | 131.2 Ų | 131.2 | 71% | 0.714 | 76% | 0.756 | S | S | * | * | trans | -74.1 | 77.7 | 177.1 | 30.4 | -33.6 | 0 | 0 | 0 | 109.7 | L104 | P102-L104 PolarHBondContact O-N 3.45Š| ||
| 103 | L | 55.4 | Low | 52.4 | Low | 120 Ų | 120 | 132 Ų | 132 | 63% | 0.628 | 75% | 0.749 | S | S | * | * | trans | -72.7 | 124.1 | 176.1 | -73.9 | 163.4 | 0 | 0 | 0 | 108.6 | S101 K105 | S101-L103 PolarHBondContact O-N 2.77Å; L103-K105 PolarHBondContact O-N 2.74Å | ||
| 104 | L | 57.3 | Low | 52.5 | Low | 143 Ų | 143 | 132.3 Ų | 132.3 | 75% | 0.749 | 75% | 0.752 | S | S | * | * | trans | -49.5 | 116 | 166.5 | -66.7 | 166.1 | 0 | 0 | 0 | 108 | P102 N106 A107 | P102-L104 PolarHBondContact O-N 3.45Å; L104-N106 PolarHBondContact O-N 3.2Å; L104-A107 PolarHBondContact O-N 2.94Å | ||
| 105 | K | 63.3 | Low | 53.2 | Low | 205 Ų | 205 | 123.8 Ų | 123.8 | 89% | 0.891 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.1 | -0.8 | -178.6 | 46.8 | 175.6 | 169.9 | -179 | 0 | 117 | L103 | L103-K105 PolarHBondContact O-N 2.74Š|
| 106 | N | 57.1 | Low | 53.4 | Low | 157 Ų | 157 | 122.8 Ų | 122.8 | 84% | 0.84 | 74% | 0.742 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.5 | 4.3 | 175.2 | -69.9 | -43.2 | 0 | 0 | 0 | 113.8 | L104 | L104-N106 PolarHBondContact O-N 3.2Š|
| 107 | A | 60.6 | Low | 53.6 | Low | 62 Ų | 62 | 124 Ų | 124 | 51% | 0.512 | 74% | 0.744 | S | S | . | * | P | Polyproline II helix | trans | -96.8 | 123 | 179.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | L104 | L104-A107 PolarHBondContact O-N 2.94Š|
| 108 | I | 63.2 | Low | 53.8 | Low | 168 Ų | 168 | 122.6 Ų | 122.6 | 86% | 0.862 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -91 | 126.2 | 166.4 | 35.5 | 170.5 | 0 | 0 | 0 | 108.8 | ||
| 109 | S | 50.1 | Low | 53.9 | Low | 99 Ų | 99 | 122 Ų | 122 | 69% | 0.692 | 74% | 0.738 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 131.7 | 175.9 | -45.5 | 0 | 0 | 0 | 0 | 110 | ||
| 110 | L | 58.8 | Low | 53.9 | Low | 153 Ų | 153 | 125.9 Ų | 125.9 | 80% | 0.801 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 145.7 | 165.1 | -63.8 | 177.2 | 0 | 0 | 0 | 109.1 | V112 | L110-V112 PolarHBondContact O-N 2.85Å; L110-V112 VanDerWaalsContact O-N 3.15Å |
| 111 | P | 56.7 | Low | 54.3 | Low | 116 Ų | 116 | 125.7 Ų | 125.7 | 75% | 0.753 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 121.9 | 173.6 | 23.1 | -31.5 | 0 | 0 | 0 | 109.9 | I113 | P111-I113 PolarHBondContact O-N 3.11Š|
| 112 | V | 55.4 | Low | 54.6 | Low | 140 Ų | 140 | 127.4 Ų | 127.4 | 85% | 0.848 | 75% | 0.751 | S | S | * | * | trans | -72.9 | 105.2 | 172 | 170.4 | 0 | 0 | 0 | 0 | 107.6 | L110 G114 | L110-V112 PolarHBondContact O-N 2.85Å; L110-V112 VanDerWaalsContact O-N 3.15Å; V112-G114 PolarHBondContact O-N 3.09Å; V112-G114 VanDerWaalsContact O-N 3.09Å | ||
| 113 | I | 59.6 | Low | 55 | Low | 150 Ų | 150 | 129 Ų | 129 | 77% | 0.769 | 76% | 0.759 | S | S | * | * | trans | -75.1 | 94.6 | 166.7 | -96.1 | 155.7 | 0 | 0 | 0 | 107.8 | P111 G115 | P111-I113 PolarHBondContact O-N 3.11Å; I113-G115 PolarHBondContact O-N 2.92Å | ||
| 114 | G | 49.1 | Very low | 55.1 | Low | 74 Ų | 74 | 127.5 Ų | 127.5 | 76% | 0.763 | 77% | 0.765 | S | S | * | * | trans | -82.4 | 102.9 | 170 | 0 | 0 | 0 | 0 | 0 | 110.4 | V112 | V112-G114 PolarHBondContact O-N 3.09Å; V112-G114 VanDerWaalsContact O-N 3.09Å | ||
| 115 | G | 56.6 | Low | 55.5 | Low | 47 Ų | 47 | 129.3 Ų | 129.3 | 49% | 0.485 | 77% | 0.769 | S | S | . | * | S | Bend | trans | 121.3 | 154.2 | 163.5 | 0 | 0 | 0 | 0 | 0 | 115.1 | I113 Q117 | I113-G115 PolarHBondContact O-N 2.92Å; G115-Q117 PolarHBondContact O-N 3.1Å |
| 116 | P | 51.2 | Low | 55.6 | Low | 142 Ų | 142 | 123.3 Ų | 123.3 | 92% | 0.922 | 76% | 0.758 | S | S | * | * | trans | -77.4 | 64.4 | 179.1 | 35.2 | -36.1 | 0 | 0 | 0 | 110.5 | ||||
| 117 | Q | 50.9 | Low | 56.2 | Low | 177 Ų | 177 | 121.4 Ų | 121.4 | 83% | 0.827 | 75% | 0.754 | S | S | * | * | trans | -101 | 82 | 157.5 | -68.6 | -176.6 | 52.6 | 0 | 0 | 105.5 | G115 L119 | G115-Q117 PolarHBondContact O-N 3.1Å; Q117-L119 PolarHBondContact O-N 3.22Å; Q117-L119 VanDerWaalsContact O-N 3.14Å | ||
| 118 | A | 45.1 | Very low | 56.9 | Low | 83 Ų | 83 | 124.3 Ų | 124.3 | 69% | 0.686 | 77% | 0.768 | S | S | * | * | trans | -45.9 | 125.4 | 159.5 | 0 | 0 | 0 | 0 | 0 | 106.4 | T120 | A118-T120 VanDerWaalsContact C-N 3.32Å; A118-T120 PolarHBondContact O-N 3.24Å | ||
| 119 | L | 48.8 | Very low | 57.2 | Low | 151 Ų | 151 | 125.8 Ų | 125.8 | 79% | 0.791 | 77% | 0.768 | S | S | * | * | trans | -39.3 | 107.6 | 163.7 | -72.3 | 161.3 | 0 | 0 | 0 | 105.8 | Q117 L121 | Q117-L119 PolarHBondContact O-N 3.22Å; Q117-L119 VanDerWaalsContact O-N 3.14Å; L119-L121 HydrophobicContact CB-CG 4.32Å; L119-L121 PolarHBondContact O-N 3.5Å | ||
| 120 | T | 49.9 | Very low | 58.2 | Low | 135 Ų | 135 | 126.3 Ų | 126.3 | 83% | 0.828 | 77% | 0.769 | S | S | * | * | trans | -72.4 | 78.3 | 168.1 | -58.9 | 0 | 0 | 0 | 0 | 103.4 | A118 | A118-T120 VanDerWaalsContact C-N 3.32Å; A118-T120 PolarHBondContact O-N 3.24Å | ||
| 121 | L | 55.5 | Low | 58.9 | Low | 130 Ų | 130 | 125 Ų | 125 | 68% | 0.681 | 77% | 0.769 | S | S | * | * | trans | -52.3 | 132.3 | 159.4 | -66.8 | 168.9 | 0 | 0 | 0 | 104.2 | L119 T123 | L119-L121 HydrophobicContact CB-CG 4.32Å; L119-L121 PolarHBondContact O-N 3.5Å; L121-T123 PolarHBondContact O-N 3.35Å | ||
| 122 | P | 52.5 | Low | 59.4 | Low | 113 Ų | 113 | 130.8 Ų | 130.8 | 73% | 0.734 | 78% | 0.776 | S | S | * | * | trans | -47.7 | 134.9 | 170.8 | 20.7 | -30.8 | 0 | 0 | 0 | 107.3 | A124 | P122-A124 PolarHBondContact O-N 3.29Š| ||
| 123 | T | 58.9 | Low | 59.3 | Low | 143 Ų | 143 | 131.7 Ų | 131.7 | 88% | 0.877 | 78% | 0.776 | S | S | * | * | trans | -58.4 | 86.1 | -179.8 | -61.2 | 0 | 0 | 0 | 0 | 109.1 | L121 Q125 | L121-T123 PolarHBondContact O-N 3.35Å; T123-Q125 PolarHBondContact O-N 3Å | ||
| 124 | A | 56.6 | Low | 59 | Low | 90 Ų | 90 | 132.6 Ų | 132.6 | 74% | 0.744 | 78% | 0.776 | S | S | * | * | trans | -77.4 | 109.4 | 170.8 | 0 | 0 | 0 | 0 | 0 | 105.3 | P122 A126 | P122-A124 PolarHBondContact O-N 3.29Å; A124-A126 PolarHBondContact O-N 3.41Å; A124-A126 VanDerWaalsContact O-N 3.16Å | ||
| 125 | Q | 66.3 | Low | 59.3 | Low | 181 Ų | 181 | 136.4 Ų | 136.4 | 85% | 0.846 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -46.5 | 121.6 | 171.9 | 178.8 | 173.5 | -14.4 | 0 | 0 | 109.1 | T123 | T123-Q125 PolarHBondContact O-N 3Š|
| 126 | A | 63.9 | Low | 58.8 | Low | 79 Ų | 79 | 141.8 Ų | 141.8 | 65% | 0.653 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 133.7 | -179.9 | 0 | 0 | 0 | 0 | 0 | 109.5 | A124 | A124-A126 PolarHBondContact O-N 3.41Å; A124-A126 VanDerWaalsContact O-N 3.16Å |
| 127 | P | 69.7 | Low | 58.6 | Low | 116 Ų | 116 | 141.1 Ų | 141.1 | 75% | 0.753 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -54 | 138.2 | 177.1 | -23.4 | 32.3 | 0 | 0 | 0 | 110.3 | K129 | P127-K129 PolarHBondContact O-N 2.85Š|
| 128 | P | 76.6 | Confident | 58.2 | Low | 124 Ų | 124 | 137.8 Ų | 137.8 | 81% | 0.805 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 141.2 | -178.6 | 23.4 | -32.7 | 0 | 0 | 0 | 110.8 | ||
| 129 | K | 68.3 | Low | 57.7 | Low | 199 Ų | 199 | 142.7 Ų | 142.7 | 87% | 0.865 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 128.9 | -174.7 | -141.2 | 161 | -170.4 | 163.3 | 0 | 109.6 | P127 | P127-K129 PolarHBondContact O-N 2.85Š|
| 130 | P | 72.1 | Confident | 57.3 | Low | 109 Ų | 109 | 140.2 Ų | 140.2 | 71% | 0.708 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 145.1 | 178.5 | 25.5 | -33.2 | 0 | 0 | 0 | 110.2 | R132 | P130-R132 PolarHBondContact O-N 2.89Š|
| 131 | P | 73.3 | Confident | 56.3 | Low | 126 Ų | 126 | 139.1 Ų | 139.1 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 130.6 | 177.9 | 24.5 | -32.6 | 0 | 0 | 0 | 109.9 | L133 | P131-L133 PolarHBondContact O-N 3.36Å; P131-L133 VanDerWaalsContact O-N 3.12Å |
| 132 | R | 67.6 | Low | 55.8 | Low | 237 Ų | 237 | 138 Ų | 138 | 89% | 0.894 | 78% | 0.778 | S | S | * | * | trans | -64.8 | 112.8 | 177.3 | -84.6 | 178.8 | 136.9 | 148 | -5.2 | 109 | P130 H134 | P130-R132 PolarHBondContact O-N 2.89Å; R132-H134 PolarHBondContact O-N 3.19Å | ||
| 133 | L | 53.2 | Low | 54.8 | Low | 160 Ų | 160 | 141.1 Ų | 141.1 | 84% | 0.838 | 78% | 0.783 | S | S | * | * | trans | -66.6 | 104.4 | 170.4 | -144.5 | 177.4 | 0 | 0 | 0 | 107.5 | P131 L135 | P131-L133 PolarHBondContact O-N 3.36Å; P131-L133 VanDerWaalsContact O-N 3.12Å; L133-L135 PolarHBondContact O-N 3.03Å; L133-L135 VanDerWaalsContact O-N 3.13Å | ||
| 134 | H | 53.3 | Low | 53.4 | Low | 168 Ų | 168 | 143.2 Ų | 143.2 | 78% | 0.778 | 78% | 0.783 | S | S | * | * | trans | -70.2 | 101.3 | 172.3 | -115.6 | -113.1 | 0 | 0 | 0 | 107.5 | R132 E136 | R132-H134 PolarHBondContact O-N 3.19Å; H134-E136 PolarHBondContact O-N 3.18Å | ||
| 135 | L | 54.9 | Low | 52.1 | Low | 155 Ų | 155 | 142.6 Ų | 142.6 | 81% | 0.812 | 79% | 0.785 | S | S | * | * | trans | -81.9 | 96.7 | 169.3 | -168.2 | 62.8 | 0 | 0 | 0 | 107.6 | L133 T137 | L133-L135 PolarHBondContact O-N 3.03Å; L133-L135 VanDerWaalsContact O-N 3.13Å; L135-T137 PolarHBondContact O-N 3.43Å | ||
| 136 | E | 46 | Very low | 50.3 | Low | 159 Ų | 159 | 137.8 Ų | 137.8 | 74% | 0.743 | 78% | 0.784 | S | S | * | * | trans | -58.5 | 119.3 | 173.4 | -171.4 | 131.5 | 121.7 | 0 | 0 | 109.4 | H134 P138 | H134-E136 PolarHBondContact O-N 3.18Å; E136-P138 HydrophobicContact CG-CG 4.22Å; E136-P138 WeakPolarHBondContact O-CD 3.36Å | ||
| 137 | T | 47.2 | Very low | 48.8 | Very low | 128 Ų | 128 | 139.4 Ų | 139.4 | 79% | 0.785 | 79% | 0.791 | S | S | * | * | trans | -101.3 | 108.5 | 165.8 | -55 | 0 | 0 | 0 | 0 | 107.6 | L135 | L135-T137 PolarHBondContact O-N 3.43Š| ||
| 138 | P | 41.7 | Very low | 47.1 | Very low | 107 Ų | 107 | 139.3 Ų | 139.3 | 70% | 0.695 | 79% | 0.788 | S | S | * | * | trans | -85.8 | 132.3 | 158.4 | -12.2 | 29.3 | 0 | 0 | 0 | 110.5 | E136 | E136-P138 HydrophobicContact CG-CG 4.22Å; E136-P138 WeakPolarHBondContact O-CD 3.36Å | ||
| 139 | Q | 35 | Very low | 45.1 | Very low | 186 Ų | 186 | 140 Ų | 140 | 87% | 0.869 | 78% | 0.784 | S | S | * | * | trans | -51.5 | 176.3 | 169.7 | -118 | -164.6 | -128.9 | 0 | 0 | 114.4 | ||||
| 140 | P | 40.4 | Very low | 43.5 | Very low | 99 Ų | 99 | 137.1 Ų | 137.1 | 64% | 0.643 | 78% | 0.777 | S | S | * | * | trans | -99.4 | 150.7 | -140.6 | 26.8 | -6.7 | 0 | 0 | 0 | 116 | ||||
| 141 | S | 29.8 | Very low | 42 | Very low | 113 Ų | 113 | 143.4 Ų | 143.4 | 79% | 0.79 | 79% | 0.787 | S | S | * | * | trans | 62.7 | 168.2 | 149.5 | 83.3 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 142 | P | 43.8 | Very low | 40 | Very low | 105 Ų | 105 | 147.7 Ų | 147.7 | 68% | 0.682 | 79% | 0.787 | S | S | * | * | cis | -126 | 155.3 | -30.1 | 33.4 | -18.6 | 0 | 0 | 0 | 111.8 | ||||
| 143 | Q | 31.7 | Very low | 38.8 | Very low | 180 Ų | 180 | 142.2 Ų | 142.2 | 84% | 0.841 | 77% | 0.774 | S | S | * | * | trans | 178.6 | 133.5 | 143.7 | -101.4 | 163.3 | -16 | 0 | 0 | 114.3 | ||||
| 144 | E | 29.1 | Very low | 38.4 | Very low | 187 Ų | 187 | 140.4 Ų | 140.4 | 87% | 0.874 | 77% | 0.771 | S | S | * | * | trans | 32.6 | 133.6 | 150.3 | -73.7 | -175.4 | 101.7 | 0 | 0 | 123.3 | ||||
| 145 | G | 29.9 | Very low | 37.4 | Very low | 77 Ų | 77 | 140.2 Ų | 140.2 | 79% | 0.794 | 77% | 0.771 | S | S | * | * | 110.5 | 94.2 | 123.9 | 0 | 0 | 0 | 0 | 0 | 118.1 | |||||
| 146 | G | 29.2 | Very low | 36.6 | Very low | 80 Ų | 80 | 139.8 Ų | 139.8 | 83% | 0.825 | 78% | 0.775 | S | S | * | * | 80.3 | 136.8 | 129.1 | 0 | 0 | 0 | 0 | 0 | 121.3 | |||||
| 147 | S | 31.9 | Very low | 35.9 | Very low | 113 Ų | 113 | 135.4 Ų | 135.4 | 79% | 0.79 | 77% | 0.773 | S | S | * | * | trans | 96.5 | 97.5 | 135.3 | -152.2 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 148 | V | 33.1 | Very low | 35.4 | Very low | 114 Ų | 114 | 134.9 Ų | 134.9 | 69% | 0.691 | 77% | 0.774 | S | S | * | * | trans | 31.2 | 134.5 | 135.3 | -72.4 | 0 | 0 | 0 | 0 | 123.8 | ||||
| 149 | D | 34.9 | Very low | 35.8 | Very low | 137 Ų | 137 | 135.2 Ų | 135.2 | 73% | 0.733 | 78% | 0.776 | S | S | * | * | trans | 59.8 | 136.9 | 137.4 | -65.5 | -56.6 | 0 | 0 | 0 | 121.2 | ||||
| 150 | I | 36.3 | Very low | 35.8 | Very low | 139 Ų | 139 | 134.7 Ų | 134.7 | 71% | 0.713 | 77% | 0.773 | S | S | * | * | 161.1 | 117.1 | 111.2 | -78.8 | 163.3 | 0 | 0 | 0 | 109.5 | |||||
| 151 | W | 38.7 | Very low | 35.8 | Very low | 241 Ų | 241 | 136.1 Ų | 136.1 | 91% | 0.913 | 79% | 0.786 | S | S | * | * | trans | -54.9 | 131.2 | 159.5 | -77.7 | 81.8 | 0 | 0 | 0 | 110.9 | ||||
| 152 | R | 31.9 | Very low | 35.8 | Very low | 217 Ų | 217 | 133.9 Ų | 133.9 | 82% | 0.819 | 78% | 0.781 | S | S | * | * | trans | -134.5 | 98.4 | 168 | -165.7 | 174 | -67.2 | -173.1 | 0.7 | 112.2 | ||||
| 153 | I | 43.6 | Very low | 35.6 | Very low | 121 Ų | 121 | 136.8 Ų | 136.8 | 62% | 0.621 | 79% | 0.79 | S | S | * | * | trans | -71.5 | 148.5 | 154.3 | -51.2 | 163.5 | 0 | 0 | 0 | 107.5 | E155 | I153-E155 HydrophobicContact CG2-CG 4.02Š| ||
| 154 | P | 43.3 | Very low | 35.8 | Very low | 122 Ų | 122 | 134.8 Ų | 134.8 | 79% | 0.792 | 79% | 0.79 | S | S | * | * | trans | -112.1 | 107 | 149.1 | 31.1 | -20.9 | 0 | 0 | 0 | 110.5 | ||||
| 155 | E | 33.6 | Very low | 36.7 | Very low | 165 Ų | 165 | 131.6 Ų | 131.6 | 77% | 0.771 | 79% | 0.786 | S | S | * | * | trans | -85 | 131.4 | 158.3 | -73 | -80.8 | 129.1 | 0 | 0 | 107.8 | I153 | I153-E155 HydrophobicContact CG2-CG 4.02Š| ||
| 156 | T | 37.2 | Very low | 36.8 | Very low | 145 Ų | 145 | 136.8 Ų | 136.8 | 89% | 0.89 | 79% | 0.789 | S | S | * | * | trans | -136.2 | 120.9 | 152.4 | 35.7 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 157 | G | 32.3 | Very low | 37.4 | Very low | 68 Ų | 68 | 138.2 Ų | 138.2 | 70% | 0.701 | 79% | 0.786 | S | S | * | * | trans | -83.4 | 154 | -162.6 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 158 | S | 36.8 | Very low | 37.5 | Very low | 116 Ų | 116 | 136.2 Ų | 136.2 | 81% | 0.811 | 78% | 0.784 | S | S | * | * | 53.2 | 155.7 | 109.9 | -164.9 | 0 | 0 | 0 | 0 | 120 | |||||
| 159 | P | 49.5 | Very low | 37.7 | Very low | 114 Ų | 114 | 135.3 Ų | 135.3 | 74% | 0.74 | 79% | 0.788 | S | S | * | * | cis | -132.2 | 162.5 | -29.8 | 29.3 | -10.8 | 0 | 0 | 0 | 112.9 | ||||
| 160 | H | 34.3 | Very low | 38.5 | Very low | 175 Ų | 175 | 138.4 Ų | 138.4 | 81% | 0.81 | 80% | 0.798 | S | S | * | * | trans | -152.4 | 117.2 | 135.6 | 102.3 | -79 | 0 | 0 | 0 | 110.3 | ||||
| 161 | S | 41.9 | Very low | 38.9 | Very low | 129 Ų | 129 | 139.6 Ų | 139.6 | 90% | 0.902 | 80% | 0.801 | S | S | * | * | trans | -101.6 | 131.5 | 160.7 | -71.6 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 162 | G | 29.7 | Very low | 39.4 | Very low | 66 Ų | 66 | 132 Ų | 132 | 68% | 0.68 | 78% | 0.783 | S | S | * | * | trans | -166.8 | 107.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 163 | L | 38.1 | Very low | 40 | Very low | 167 Ų | 167 | 131 Ų | 131 | 87% | 0.874 | 78% | 0.784 | S | S | * | * | trans | -82.3 | 169.1 | 173 | -64.9 | 167.4 | 0 | 0 | 0 | 110.6 | ||||
| 164 | T | 37 | Very low | 40.3 | Very low | 137 Ų | 137 | 132.2 Ų | 132.2 | 84% | 0.84 | 79% | 0.792 | S | S | * | * | trans | 93.2 | 154.3 | 156.7 | 10.6 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 165 | P | 46.5 | Very low | 40.5 | Very low | 121 Ų | 121 | 129.7 Ų | 129.7 | 79% | 0.786 | 78% | 0.777 | S | S | * | * | -119.3 | 162.2 | -100 | 39.4 | -23.9 | 0 | 0 | 0 | 113.3 | |||||
| 166 | E | 32.8 | Very low | 41.1 | Very low | 185 Ų | 185 | 130.9 Ų | 130.9 | 86% | 0.864 | 78% | 0.782 | S | S | * | * | trans | -132.1 | 132.1 | 168.4 | -138.8 | -81.8 | 102.5 | 0 | 0 | 108.7 | ||||
| 167 | S | 42.2 | Very low | 41.6 | Very low | 110 Ų | 110 | 127 Ų | 127 | 77% | 0.769 | 76% | 0.764 | S | S | * | * | trans | -121.2 | 123.3 | -165.1 | 169.8 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 168 | G | 34.7 | Very low | 42.5 | Very low | 72 Ų | 72 | 128 Ų | 128 | 74% | 0.742 | 76% | 0.761 | S | S | * | * | trans | 130.4 | 76.8 | 157.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 169 | A | 36.6 | Very low | 43 | Very low | 94 Ų | 94 | 126.9 Ų | 126.9 | 78% | 0.777 | 75% | 0.753 | S | S | * | * | trans | -170.5 | 103.1 | 132 | 0 | 0 | 0 | 0 | 0 | 107.2 | E171 | A169-E171 PolarHBondContact O-N 2.87Š| ||
| 170 | E | 51.4 | Low | 43.1 | Very low | 202 Ų | 202 | 128.7 Ų | 128.7 | 94% | 0.944 | 76% | 0.756 | S | S | * | * | trans | -57.2 | 98.6 | 169.6 | -59.8 | -78.9 | 132.1 | 0 | 0 | 108.8 | ||||
| 171 | E | 45.6 | Very low | 43.8 | Very low | 165 Ų | 165 | 128 Ų | 128 | 77% | 0.771 | 76% | 0.757 | S | S | * | * | trans | -126.3 | 137.2 | 162.4 | -120.4 | -153.9 | 111.8 | 0 | 0 | 108.6 | A169 F173 | A169-E171 PolarHBondContact O-N 2.87Å; E171-F173 PolarHBondContact O-N 3.36Å | ||
| 172 | P | 48.1 | Very low | 44.3 | Very low | 82 Ų | 82 | 126.2 Ų | 126.2 | 53% | 0.532 | 75% | 0.745 | S | S | . | * | trans | -71.5 | 109.5 | -147 | 29.1 | -34.2 | 0 | 0 | 0 | 110.3 | L174 S175 | P172-L174 PolarHBondContact O-N 3.29Å; P172-S175 WeakPolarHBondContact CB-OG 3.4Å; P172-S175 VanDerWaalsContact CG-OG 3.23Å; P172-S175 WeakPolarHBondContact CG-OG 3.47Å | ||
| 173 | F | 44.9 | Very low | 45.3 | Very low | 194 Ų | 194 | 129.9 Ų | 129.9 | 85% | 0.851 | 75% | 0.748 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -45.8 | 116 | 151 | -64.6 | -90 | 0 | 0 | 0 | 107.3 | E171 | E171-F173 PolarHBondContact O-N 3.36Š|
| 174 | L | 50.8 | Low | 46.4 | Very low | 148 Ų | 148 | 129.5 Ų | 129.5 | 78% | 0.775 | 74% | 0.741 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 86.5 | 25.9 | 165.4 | -42.8 | 174.1 | 0 | 0 | 0 | 119.6 | P172 H176 A177 | P172-L174 PolarHBondContact O-N 3.29Å; L174-H176 VanDerWaalsContact C-N 3.31Å; L174-H176 PolarHBondContact O-N 3.49Å; L174-A177 PolarHBondContact O-N 3.25Å |
| 175 | S | 46.2 | Very low | 47.8 | Very low | 69 Ų | 69 | 127.2 Ų | 127.2 | 48% | 0.483 | 73% | 0.727 | S | S | . | * | G | 310 helix | trans | -71.8 | -12.6 | 175.4 | -72 | 0 | 0 | 0 | 0 | 116.3 | P172 S178 | P172-S175 WeakPolarHBondContact CB-OG 3.4Å; P172-S175 VanDerWaalsContact CG-OG 3.23Å; P172-S175 WeakPolarHBondContact CG-OG 3.47Å; S175-S178 PolarHBondContact O-OG 2.74Å; S175-S178 VanDerWaalsContact O-OG 3.06Å |
| 176 | H | 47 | Very low | 48.7 | Very low | 190 Ų | 190 | 127.7 Ų | 127.7 | 88% | 0.88 | 72% | 0.723 | S | S | * | * | G | 310 helix | trans | -91.4 | 4.6 | 172.9 | -77.9 | -60.5 | 0 | 0 | 0 | 114.4 | L174 | L174-H176 VanDerWaalsContact C-N 3.31Å; L174-H176 PolarHBondContact O-N 3.49Å |
| 177 | A | 47.9 | Very low | 50.4 | Low | 62 Ų | 62 | 122.3 Ų | 122.3 | 51% | 0.512 | 70% | 0.699 | S | S | . | * | G | 310 helix | trans | -89 | -4.3 | 169.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | L174 | L174-A177 PolarHBondContact O-N 3.25Š|
| 178 | S | 50.8 | Low | 52.2 | Low | 90 Ų | 90 | 118.3 Ų | 118.3 | 63% | 0.629 | 68% | 0.676 | S | S | * | * | G | 310 helix | trans | -87.9 | -3.4 | -179.2 | 59.1 | 0 | 0 | 0 | 0 | 114.7 | S175 | S175-S178 PolarHBondContact O-OG 2.74Å; S175-S178 VanDerWaalsContact O-OG 3.06Å |
| 179 | S | 46.6 | Very low | 54.2 | Low | 93 Ų | 93 | 120.2 Ų | 120.2 | 65% | 0.65 | 68% | 0.675 | S | S | * | * | G | 310 helix | trans | -96.3 | 11.6 | 177.1 | -142 | 0 | 0 | 0 | 0 | 114.2 | ||
| 180 | L | 51 | Low | 55.8 | Low | 152 Ų | 152 | 120.3 Ų | 120.3 | 80% | 0.796 | 67% | 0.67 | S | S | * | * | G | 310 helix | trans | -93.3 | -5.5 | 171.6 | -65 | 180 | 0 | 0 | 0 | 113.5 | ||
| 181 | L | 50.2 | Low | 57.4 | Low | 160 Ų | 160 | 114.6 Ų | 114.6 | 84% | 0.838 | 65% | 0.645 | S | S | * | * | S | Bend | trans | -120 | -1.6 | 178.1 | -61.3 | 178.8 | 0 | 0 | 0 | 113.5 | L183 | L181-L183 PolarHBondContact O-N 3.11Š|
| 182 | S | 51.2 | Low | 59.3 | Low | 92 Ų | 92 | 110.6 Ų | 110.6 | 64% | 0.643 | 63% | 0.628 | S | S | * | * | trans | -76.8 | 61 | 167 | 176.1 | 0 | 0 | 0 | 0 | 109.5 | H184 | S182-H184 VanDerWaalsContact C-N 3.32Å; S182-H184 PolarHBondContact O-N 3.03Å | ||
| 183 | L | 51.5 | Low | 61 | Low | 143 Ų | 143 | 111.5 Ų | 111.5 | 75% | 0.749 | 63% | 0.629 | S | S | * | * | trans | -72.4 | 92.6 | 166.9 | -172.4 | 83.6 | 0 | 0 | 0 | 106.5 | L181 V185 | L181-L183 PolarHBondContact O-N 3.11Å; L183-V185 VanDerWaalsContact C-N 3.29Å; L183-V185 HydrophobicContact CB-CG2 4.46Å; L183-V185 HydrophobicContact CD2-CG2 3.36Å; L183-V185 HydrophobicContact CG-CG2 3.69Å; L183-V185 PolarHBondContact O-N 3.49Å | ||
| 184 | H | 62 | Low | 63 | Low | 159 Ų | 159 | 106.7 Ų | 106.7 | 74% | 0.736 | 61% | 0.612 | S | S | * | * | trans | -71.7 | 92.9 | 167.3 | -173.8 | -82.2 | 0 | 0 | 0 | 107.3 | S182 D186 | S182-H184 VanDerWaalsContact C-N 3.32Å; S182-H184 PolarHBondContact O-N 3.03Å; H184-D186 VanDerWaalsContact C-N 3.35Å; H184-D186 PolarHBondContact O-N 3.44Å | ||
| 185 | V | 65.9 | Low | 64.8 | Low | 89 Ų | 89 | 102.6 Ų | 102.6 | 54% | 0.539 | 59% | 0.593 | S | S | . | * | trans | -74.9 | 92.2 | 178 | -170.5 | 0 | 0 | 0 | 0 | 107.7 | L183 L187 | L183-V185 VanDerWaalsContact C-N 3.29Å; L183-V185 HydrophobicContact CB-CG2 4.46Å; L183-V185 HydrophobicContact CD2-CG2 3.36Å; L183-V185 HydrophobicContact CG-CG2 3.69Å; L183-V185 PolarHBondContact O-N 3.49Å; V185-L187 VanDerWaalsContact C-N 3.35Å; V185-L187 HydrophobicContact CG1-CD2 3.52Å; V185-L187 HydrophobicContact CG1-CG 3.71Å; V185-L187 PolarHBondContact O-N 2.75Å; V185-L187 VanDerWaalsContact O-N 3.14Å | ||
| 186 | D | 65.9 | Low | 66.6 | Low | 130 Ų | 130 | 103.9 Ų | 103.9 | 70% | 0.695 | 59% | 0.594 | S | S | * | * | trans | -82.1 | 87.4 | 170.8 | -168.4 | 21.1 | 0 | 0 | 0 | 108.8 | H184 G188 | H184-D186 VanDerWaalsContact C-N 3.35Å; H184-D186 PolarHBondContact O-N 3.44Å; D186-G188 VanDerWaalsContact C-N 3.29Å; D186-G188 PolarHBondContact O-N 3.03Å | ||
| 187 | L | 68.6 | Low | 68.4 | Low | 72 Ų | 72 | 99.8 Ų | 99.8 | 38% | 0.377 | 58% | 0.575 | S | S | . | * | trans | -72.9 | 90.5 | 168.5 | -62.9 | -177 | 0 | 0 | 0 | 106.1 | V185 I191 L192 | V185-L187 VanDerWaalsContact C-N 3.35Å; V185-L187 HydrophobicContact CG1-CD2 3.52Å; V185-L187 HydrophobicContact CG1-CG 3.71Å; V185-L187 PolarHBondContact O-N 2.75Å; V185-L187 VanDerWaalsContact O-N 3.14Å; L187-I191 VanDerWaalsContact C-CG2 3.44Å; L187-I191 VanDerWaalsContact CA-CG2 3.47Å; L187-I191 HydrophobicContact CB-CG2 3.58Å; L187-I191 HydrophobicContact CD2-CD1 4.44Å; L187-I191 HydrophobicContact CD2-CG2 4.15Å; L187-I191 HydrophobicContact CG-CG2 4.42Å; L187-L192 HydrophobicContact CB-CD2 3.96Å; L187-L192 HydrophobicContact CB-CG 4.04Å; L187-L192 HydrophobicContact CD1-CD2 4.34Å; L187-L192 WeakPolarHBondContact O-CD1 3.36Å; L187-L192 WeakPolarHBondContact O-CG 3.35Å | ||
| 188 | G | 79.3 | Confident | 70.3 | Confident | 26 Ų | 26 | 101.3 Ų | 101.3 | 27% | 0.268 | 57% | 0.574 | S | S | . | * | trans | -52.5 | 164.7 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | D186 S190 I191 L192 | D186-G188 VanDerWaalsContact C-N 3.29Å; D186-G188 PolarHBondContact O-N 3.03Å; G188-S190 PolarHBondContact O-N 3.03Å; G188-I191 WeakPolarHBondContact O-CG2 3.41Å; G188-I191 PolarHBondContact O-N 3.45Å; G188-L192 PolarHBondContact O-N 3.16Å | ||
| 189 | P | 76.4 | Confident | 71.7 | Confident | 113 Ų | 113 | 102.4 Ų | 102.4 | 73% | 0.734 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -55.1 | -31 | -168.1 | 18.1 | -30.7 | 0 | 0 | 0 | 114.4 | D193 | P189-D193 WeakPolarHBondContact O-CB 3.14Å; P189-D193 PolarHBondContact O-N 3.38Å |
| 190 | S | 71.3 | Confident | 73.3 | Confident | 96 Ų | 96 | 102.3 Ų | 102.3 | 67% | 0.671 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -68.3 | -37.6 | 177.8 | -57.8 | 0 | 0 | 0 | 0 | 114.2 | G188 D194 | G188-S190 PolarHBondContact O-N 3.03Å; S190-D194 PolarHBondContact O-N 3.35Å |
| 191 | I | 84.4 | Confident | 74.5 | Confident | 81 Ų | 81 | 100.2 Ų | 100.2 | 42% | 0.415 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -82.2 | -25.8 | 178.8 | -173.8 | 151.2 | 0 | 0 | 0 | 111.8 | L187 G188 V195 | L187-I191 VanDerWaalsContact C-CG2 3.44Å; L187-I191 VanDerWaalsContact CA-CG2 3.47Å; L187-I191 HydrophobicContact CB-CG2 3.58Å; L187-I191 HydrophobicContact CD2-CD1 4.44Å; L187-I191 HydrophobicContact CD2-CG2 4.15Å; L187-I191 HydrophobicContact CG-CG2 4.42Å; G188-I191 WeakPolarHBondContact O-CG2 3.41Å; G188-I191 PolarHBondContact O-N 3.45Å; I191-V195 WeakPolarHBondContact O-CB 3.39Å; I191-V195 VanDerWaalsContact O-CG2 3.23Å; I191-V195 WeakPolarHBondContact O-CG2 3.39Å; I191-V195 PolarHBondContact O-N 3.48Å; I191-V195 VanDerWaalsContact O-N 3.09Å |
| 192 | L | 85.1 | Confident | 75.3 | Confident | 81 Ų | 81 | 97.6 Ų | 97.6 | 42% | 0.424 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -67.8 | -38.8 | 169 | -71.7 | 173.4 | 0 | 0 | 0 | 111.4 | L187 G188 V195 L196 | L187-L192 HydrophobicContact CB-CD2 3.96Å; L187-L192 HydrophobicContact CB-CG 4.04Å; L187-L192 HydrophobicContact CD1-CD2 4.34Å; L187-L192 WeakPolarHBondContact O-CD1 3.36Å; L187-L192 WeakPolarHBondContact O-CG 3.35Å; G188-L192 PolarHBondContact O-N 3.16Å; L192-V195 PolarHBondContact O-N 2.99Å; L192-L196 VanDerWaalsContact O-CB 3.3Å; L192-L196 WeakPolarHBondContact O-CB 3.48Å; L192-L196 WeakPolarHBondContact O-CD1 3.17Å; L192-L196 WeakPolarHBondContact O-CG 3.41Å; L192-L196 PolarHBondContact O-N 3.23Å |
| 193 | D | 83.8 | Confident | 75.9 | Confident | 102 Ų | 102 | 99.3 Ų | 99.3 | 55% | 0.545 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -59.1 | -49 | 174.9 | -160.5 | 66.9 | 0 | 0 | 0 | 111.1 | P189 V195 L196 Q197 | P189-D193 WeakPolarHBondContact O-CB 3.14Å; P189-D193 PolarHBondContact O-N 3.38Å; D193-V195 PolarHBondContact O-N 2.93Å; D193-L196 PolarHBondContact O-N 2.84Å; D193-Q197 VanDerWaalsContact O-CB 3.3Å; D193-Q197 WeakPolarHBondContact O-CB 3.24Å; D193-Q197 PolarHBondContact O-N 3.4Å |
| 194 | D | 87.2 | Confident | 76.4 | Confident | 93 Ų | 93 | 97.9 Ų | 97.9 | 50% | 0.497 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -60.5 | -44.1 | 176.8 | -69.2 | -12.4 | 0 | 0 | 0 | 112.4 | S190 Q197 I198 | S190-D194 PolarHBondContact O-N 3.35Å; D194-Q197 PolarHBondContact O-N 3.01Å; D194-I198 WeakPolarHBondContact O-CD1 3.17Å; D194-I198 VanDerWaalsContact O-CG1 3.24Å; D194-I198 WeakPolarHBondContact O-CG1 3.3Å; D194-I198 PolarHBondContact O-N 2.76Å |
| 195 | V | 88.3 | Confident | 76.2 | Confident | 62 Ų | 62 | 94.5 Ų | 94.5 | 38% | 0.376 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -66.7 | -43.5 | 179.2 | 169.8 | 0 | 0 | 0 | 0 | 111.4 | I191 L192 D193 Q197 I198 M199 | I191-V195 WeakPolarHBondContact O-CB 3.39Å; I191-V195 VanDerWaalsContact O-CG2 3.23Å; I191-V195 WeakPolarHBondContact O-CG2 3.39Å; I191-V195 PolarHBondContact O-N 3.48Å; I191-V195 VanDerWaalsContact O-N 3.09Å; L192-V195 PolarHBondContact O-N 2.99Å; D193-V195 PolarHBondContact O-N 2.93Å; V195-Q197 VanDerWaalsContact C-N 3.34Å; V195-I198 PolarHBondContact O-N 2.84Å; V195-M199 HydrophobicContact CG1-SD 4.18Å; V195-M199 WeakPolarHBondContact O-CG 3.43Å; V195-M199 PolarHBondContact O-N 3.09Å |
| 196 | L | 83.8 | Confident | 75.9 | Confident | 95 Ų | 95 | 97.5 Ų | 97.5 | 50% | 0.497 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -62.4 | -42.9 | 175.4 | -72.8 | 167.4 | 0 | 0 | 0 | 110.6 | L192 D193 I198 M199 D200 | L192-L196 VanDerWaalsContact O-CB 3.3Å; L192-L196 WeakPolarHBondContact O-CB 3.48Å; L192-L196 WeakPolarHBondContact O-CD1 3.17Å; L192-L196 WeakPolarHBondContact O-CG 3.41Å; L192-L196 PolarHBondContact O-N 3.23Å; D193-L196 PolarHBondContact O-N 2.84Å; L196-I198 VanDerWaalsContact C-N 3.29Å; L196-I198 PolarHBondContact O-N 3.21Å; L196-M199 PolarHBondContact O-N 2.83Å; L196-D200 WeakPolarHBondContact O-CB 3.25Å; L196-D200 PolarHBondContact O-N 3.34Å |
| 197 | Q | 84.8 | Confident | 75.5 | Confident | 105 Ų | 105 | 98.9 Ų | 98.9 | 49% | 0.491 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.3 | -35.7 | 177 | -166.9 | -173.8 | -19.1 | 0 | 0 | 112.1 | D193 D194 V195 Q201 | D193-Q197 VanDerWaalsContact O-CB 3.3Å; D193-Q197 WeakPolarHBondContact O-CB 3.24Å; D193-Q197 PolarHBondContact O-N 3.4Å; D194-Q197 PolarHBondContact O-N 3.01Å; V195-Q197 VanDerWaalsContact C-N 3.34Å; Q197-Q201 WeakPolarHBondContact O-CB 3.41Å; Q197-Q201 WeakPolarHBondContact O-CG 3.41Å; Q197-Q201 PolarHBondContact O-N 3.34Å; Q197-Q201 PolarHBondContact O-NE2 3.21Å |
| 198 | I | 87.4 | Confident | 75.1 | Confident | 94 Ų | 94 | 102.4 Ų | 102.4 | 48% | 0.482 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -68.1 | -45.4 | 175 | -70.8 | 159.8 | 0 | 0 | 0 | 110.8 | D194 V195 L196 D200 Q201 D202 | D194-I198 WeakPolarHBondContact O-CD1 3.17Å; D194-I198 VanDerWaalsContact O-CG1 3.24Å; D194-I198 WeakPolarHBondContact O-CG1 3.3Å; D194-I198 PolarHBondContact O-N 2.76Å; V195-I198 PolarHBondContact O-N 2.84Å; L196-I198 VanDerWaalsContact C-N 3.29Å; L196-I198 PolarHBondContact O-N 3.21Å; I198-D200 VanDerWaalsContact C-N 3.27Å; I198-D200 PolarHBondContact O-N 2.98Å; I198-Q201 PolarHBondContact O-N 3.49Å; I198-D202 PolarHBondContact O-N 3Å; I198-D202 VanDerWaalsContact O-N 3.09Å |
| 199 | M | 80.6 | Confident | 74.1 | Confident | 112 Ų | 112 | 107 Ų | 107 | 55% | 0.552 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -62 | -36.3 | 177.3 | -69 | 175.7 | 61.2 | 0 | 0 | 112.2 | V195 L196 L203 | V195-M199 HydrophobicContact CG1-SD 4.18Å; V195-M199 WeakPolarHBondContact O-CG 3.43Å; V195-M199 PolarHBondContact O-N 3.09Å; L196-M199 PolarHBondContact O-N 2.83Å; M199-L203 PolarHBondContact O-N 3.07Å |
| 200 | D | 80.6 | Confident | 73 | Confident | 91 Ų | 91 | 111.6 Ų | 111.6 | 49% | 0.487 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -73.4 | -34.9 | 176.5 | -71.2 | -20.3 | 0 | 0 | 0 | 112.3 | L196 I198 D202 L203 D204 | L196-D200 WeakPolarHBondContact O-CB 3.25Å; L196-D200 PolarHBondContact O-N 3.34Å; I198-D200 VanDerWaalsContact C-N 3.27Å; I198-D200 PolarHBondContact O-N 2.98Å; D200-D202 VanDerWaalsContact C-N 3.32Å; D200-D202 PolarHBondContact O-N 3.04Å; D200-L203 WeakPolarHBondContact O-CB 3.4Å; D200-L203 PolarHBondContact O-N 2.9Å; D200-L203 VanDerWaalsContact O-N 3.16Å; D200-D204 PolarHBondContact O-N 3.36Å |
| 201 | Q | 76.1 | Confident | 73.1 | Confident | 109 Ų | 109 | 112.4 Ų | 112.4 | 51% | 0.509 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -63.7 | -36.9 | 173.5 | -79.2 | 170.9 | 87.5 | 0 | 0 | 112.4 | Q197 I198 L203 D204 S205 | Q197-Q201 WeakPolarHBondContact O-CB 3.41Å; Q197-Q201 WeakPolarHBondContact O-CG 3.41Å; Q197-Q201 PolarHBondContact O-N 3.34Å; Q197-Q201 PolarHBondContact O-NE2 3.21Å; I198-Q201 PolarHBondContact O-N 3.49Å; Q201-L203 VanDerWaalsContact C-N 3.28Å; Q201-L203 PolarHBondContact O-N 3.34Å; Q201-D204 PolarHBondContact O-N 2.92Å; Q201-S205 WeakPolarHBondContact O-CB 3.45Å; Q201-S205 PolarHBondContact O-N 3.43Å |
| 202 | D | 67.7 | Low | 72.5 | Confident | 105 Ų | 105 | 114.1 Ų | 114.1 | 56% | 0.561 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -67.3 | -32 | 175.1 | -74.2 | -26.3 | 0 | 0 | 0 | 111.5 | I198 D200 S205 | I198-D202 PolarHBondContact O-N 3Å; I198-D202 VanDerWaalsContact O-N 3.09Å; D200-D202 VanDerWaalsContact C-N 3.32Å; D200-D202 PolarHBondContact O-N 3.04Å; D202-S205 PolarHBondContact O-N 3.02Å; D202-S205 PolarHBondContact O-OG 2.78Å |
| 203 | L | 63.9 | Low | 71.8 | Confident | 128 Ų | 128 | 115.9 Ų | 115.9 | 67% | 0.67 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -69.9 | -38.1 | 173.8 | -77 | 163.3 | 0 | 0 | 0 | 112.6 | M199 D200 Q201 S205 | M199-L203 PolarHBondContact O-N 3.07Å; D200-L203 WeakPolarHBondContact O-CB 3.4Å; D200-L203 PolarHBondContact O-N 2.9Å; D200-L203 VanDerWaalsContact O-N 3.16Å; Q201-L203 VanDerWaalsContact C-N 3.28Å; Q201-L203 PolarHBondContact O-N 3.34Å; L203-S205 VanDerWaalsContact C-N 3.34Å |
| 204 | D | 60.6 | Low | 71.1 | Confident | 113 Ų | 113 | 116.7 Ų | 116.7 | 60% | 0.604 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -74.6 | -23.7 | 175.5 | -83.9 | -35.1 | 0 | 0 | 0 | 113.2 | D200 Q201 M206 Q207 | D200-D204 PolarHBondContact O-N 3.36Å; Q201-D204 PolarHBondContact O-N 2.92Å; D204-M206 PolarHBondContact O-N 2.99Å; D204-Q207 PolarHBondContact O-N 3.13Å |
| 205 | S | 59.5 | Low | 70.1 | Confident | 87 Ų | 87 | 118.2 Ų | 118.2 | 61% | 0.608 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.1 | -13.1 | 177 | 80.9 | 0 | 0 | 0 | 0 | 113.9 | Q201 D202 L203 | Q201-S205 WeakPolarHBondContact O-CB 3.45Å; Q201-S205 PolarHBondContact O-N 3.43Å; D202-S205 PolarHBondContact O-N 3.02Å; D202-S205 PolarHBondContact O-OG 2.78Å; L203-S205 VanDerWaalsContact C-N 3.34Å |
| 206 | M | 59.3 | Low | 68.9 | Low | 153 Ų | 153 | 121.9 Ų | 121.9 | 75% | 0.754 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.2 | 35.4 | 172.7 | -70.2 | -164.6 | 78.5 | 0 | 0 | 113.1 | D204 I208 | D204-M206 PolarHBondContact O-N 2.99Å; M206-I208 PolarHBondContact O-N 2.93Å |
| 207 | Q | 56 | Low | 67.9 | Low | 158 Ų | 158 | 123.9 Ų | 123.9 | 74% | 0.738 | 66% | 0.664 | S | S | * | * | trans | -65.5 | 98.4 | 161.5 | -81 | -174.4 | 51.8 | 0 | 0 | 109.7 | D204 | D204-Q207 PolarHBondContact O-N 3.13Š| ||
| 208 | I | 60.2 | Low | 66.6 | Low | 147 Ų | 147 | 125.3 Ų | 125.3 | 75% | 0.754 | 68% | 0.677 | S | S | * | * | trans | -56.1 | 123.7 | 170.1 | -57.4 | 164.3 | 0 | 0 | 0 | 107.6 | M206 T210 | M206-I208 PolarHBondContact O-N 2.93Å; I208-T210 PolarHBondContact O-N 3.14Å; I208-T210 VanDerWaalsContact O-N 3.13Å | ||
| 209 | P | 59.1 | Low | 64.8 | Low | 121 Ų | 121 | 127.9 Ų | 127.9 | 79% | 0.786 | 69% | 0.693 | S | S | * | * | trans | -66.2 | 116 | 170.6 | 26.8 | -30.4 | 0 | 0 | 0 | 108.3 | ||||
| 210 | T | 54.6 | Low | 63.4 | Low | 211 Ų | 211 | 129.4 Ų | 129.4 | 100% | 1.294 | 71% | 0.706 | S | S | * | * | trans | -62.3 | 0 | 165.5 | 40.7 | 0 | 0 | 0 | 0 | 112 | I208 | I208-T210 PolarHBondContact O-N 3.14Å; I208-T210 VanDerWaalsContact O-N 3.13Å |
Retrieved 210 of 210 residues in 25.5 ms
(Link to these results)