| 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 | 57.4 | Low | 58.8 | Low | 155 Ų | 155 | 99 Ų | 99 | 76% | 0.764 | 56% | 0.555 | S | S | * | * | 0 | 119.4 | 0 | -71.8 | 171.8 | 148.5 | 0 | 0 | 107.3 | M3 L12 Q14 | M1-M3 PolarHBondContact O-N 3.2Å; M1-L12 HydrophobicContact CB-CD1 3.92Å; M1-L12 HydrophobicContact SD-CD1 4.25Å; M1-Q14 HydrophobicContact CE-CG 4.07Å | |||
| 2 | P | 56.9 | Low | 60.3 | Low | 68 Ų | 68 | 95.3 Ų | 95.3 | 44% | 0.442 | 53% | 0.532 | S | S | . | . | trans | -70.1 | 125.6 | 176.9 | 25.7 | -27 | 0 | 0 | 0 | 109.5 | W13 | P2-W13 HydrophobicContact CG-CB 4.19Å; P2-W13 PolarHBondContact O-N 3.38Å | ||
| 3 | M | 52.3 | Low | 61.5 | Low | 121 Ų | 121 | 94.8 Ų | 94.8 | 60% | 0.596 | 52% | 0.517 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -109.6 | 127 | 170.7 | -84.5 | -171.8 | -73.9 | 0 | 0 | 108.2 | M1 M10 F11 L12 | M1-M3 PolarHBondContact O-N 3.2Å; M3-M10 HydrophobicContact SD-CE 4.06Å; M3-M10 HydrophobicContact SD-CG 4.43Å; M3-M10 HydrophobicContact SD-SD 4.17Å; M3-F11 WeakPolarHBondContact CA-O 3.3Å; M3-L12 HydrophobicContact CG-CD1 3.63Å; M3-L12 HydrophobicContact SD-CD1 4.42Å |
| 4 | I | 56.3 | Low | 62.7 | Low | 89 Ų | 89 | 94.2 Ų | 94.2 | 46% | 0.456 | 51% | 0.509 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120 | 131 | 178.1 | -57.4 | 172.2 | 0 | 0 | 0 | 107.3 | V6 F11 | I4-V6 HydrophobicContact CG2-CG2 3.96Å; I4-F11 PolarHBondContact N-O 2.9Å; I4-F11 VanDerWaalsContact N-O 3.1Å; I4-F11 PolarHBondContact O-N 3.49Å |
| 5 | S | 49.8 | Very low | 63.4 | Low | 87 Ų | 87 | 96.1 Ų | 96.1 | 61% | 0.608 | 51% | 0.506 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -101.8 | 121.1 | 174.5 | -175.8 | 0 | 0 | 0 | 0 | 108.8 | K9 | S5-K9 WeakPolarHBondContact CA-O 3.48Å |
| 6 | V | 54.9 | Low | 64.1 | Low | 76 Ų | 76 | 99.5 Ų | 99.5 | 46% | 0.461 | 52% | 0.518 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.2 | 119.5 | 174.3 | -174 | 0 | 0 | 0 | 0 | 107.6 | I4 G8 K9 F11 | I4-V6 HydrophobicContact CG2-CG2 3.96Å; V6-G8 VanDerWaalsContact C-N 3.28Å; V6-G8 PolarHBondContact O-N 3.1Å; V6-K9 PolarHBondContact N-O 3.49Å; V6-K9 PolarHBondContact O-N 3.04Å; V6-F11 HydrophobicContact CB-CD2 4.32Å; V6-F11 HydrophobicContact CB-CE2 3.86Å; V6-F11 HydrophobicContact CG2-CD2 4.31Å; V6-F11 HydrophobicContact CG2-CE2 4.28Å |
| 7 | L | 57.8 | Low | 64.7 | Low | 163 Ų | 163 | 96 Ų | 96 | 85% | 0.853 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.7 | 42.3 | 179.9 | -59.8 | 170.6 | 0 | 0 | 0 | 113.6 | K9 | L7-K9 PolarHBondContact O-N 3.4Š|
| 8 | G | 65.3 | Low | 64.4 | Low | 75 Ų | 75 | 98.5 Ų | 98.5 | 77% | 0.773 | 53% | 0.534 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 75.7 | 1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 115 | V6 | V6-G8 VanDerWaalsContact C-N 3.28Å; V6-G8 PolarHBondContact O-N 3.1Å |
| 9 | K | 57.1 | Low | 64.8 | Low | 141 Ų | 141 | 96.7 Ų | 96.7 | 61% | 0.613 | 54% | 0.542 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -98.9 | 132 | 174.1 | -64.8 | 177.3 | -178.7 | 171.6 | 0 | 109.7 | S5 V6 L7 F11 | S5-K9 WeakPolarHBondContact CA-O 3.48Å; V6-K9 PolarHBondContact N-O 3.49Å; V6-K9 PolarHBondContact O-N 3.04Å; L7-K9 PolarHBondContact O-N 3.4Å; K9-F11 HydrophobicContact CB-CE2 3.74Å; K9-F11 HydrophobicContact CB-CZ 4.07Å; K9-F11 VanDerWaalsContact O-CD2 3.26Å; K9-F11 WeakPolarHBondContact O-CD2 3.43Å; K9-F11 VanDerWaalsContact O-CE2 3.31Å; K9-F11 WeakPolarHBondContact O-CE2 3.23Å |
| 10 | M | 67 | Low | 64.9 | Low | 64 Ų | 64 | 93.1 Ų | 93.1 | 32% | 0.315 | 53% | 0.526 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.8 | 121.4 | -175.8 | -150.7 | 162.4 | 70.9 | 0 | 0 | 109.7 | M3 S27 | M3-M10 HydrophobicContact SD-CE 4.06Å; M3-M10 HydrophobicContact SD-CG 4.43Å; M3-M10 HydrophobicContact SD-SD 4.17Å; M10-S27 PolarHBondContact O-N 3.38Å |
| 11 | F | 71.7 | Confident | 64.9 | Low | 50 Ų | 50 | 98.3 Ų | 98.3 | 22% | 0.219 | 54% | 0.538 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.5 | 118 | 179.9 | -62.1 | -94.2 | 0 | 0 | 0 | 108.7 | M3 I4 V6 K9 T26 | M3-F11 WeakPolarHBondContact CA-O 3.3Å; I4-F11 PolarHBondContact N-O 2.9Å; I4-F11 VanDerWaalsContact N-O 3.1Å; I4-F11 PolarHBondContact O-N 3.49Å; V6-F11 HydrophobicContact CB-CD2 4.32Å; V6-F11 HydrophobicContact CB-CE2 3.86Å; V6-F11 HydrophobicContact CG2-CD2 4.31Å; V6-F11 HydrophobicContact CG2-CE2 4.28Å; K9-F11 HydrophobicContact CB-CE2 3.74Å; K9-F11 HydrophobicContact CB-CZ 4.07Å; K9-F11 VanDerWaalsContact O-CD2 3.26Å; K9-F11 WeakPolarHBondContact O-CD2 3.43Å; K9-F11 VanDerWaalsContact O-CE2 3.31Å; K9-F11 WeakPolarHBondContact O-CE2 3.23Å; F11-T26 HydrophobicContact CD1-CG2 3.69Å; F11-T26 HydrophobicContact CE1-CG2 3.49Å; F11-T26 VanDerWaalsContact CE1-CG2 3.49Å; F11-T26 HydrophobicContact CZ-CG2 4.5Å |
| 12 | L | 77.9 | Confident | 65.9 | Low | 54 Ų | 54 | 97.2 Ų | 97.2 | 28% | 0.283 | 53% | 0.525 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.9 | 121.3 | 174.4 | -176 | 65.3 | 0 | 0 | 0 | 108.6 | M1 M3 Q25 | M1-L12 HydrophobicContact CB-CD1 3.92Å; M1-L12 HydrophobicContact SD-CD1 4.25Å; M3-L12 HydrophobicContact CG-CD1 3.63Å; M3-L12 HydrophobicContact SD-CD1 4.42Å; L12-Q25 PolarHBondContact N-O 3.11Å; L12-Q25 PolarHBondContact O-N 3.01Å |
| 13 | W | 75.9 | Confident | 66.6 | Low | 90 Ų | 90 | 96.5 Ų | 96.5 | 34% | 0.341 | 52% | 0.52 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.1 | 122.8 | 177.1 | -69.9 | 88.8 | 0 | 0 | 0 | 109.9 | P2 W22 T23 C24 | P2-W13 HydrophobicContact CG-CB 4.19Å; P2-W13 PolarHBondContact O-N 3.38Å; W13-W22 HydrophobicContact CB-CE3 4.34Å; W13-W22 HydrophobicContact CE3-CB 4.23Å; W13-W22 HydrophobicContact CZ3-CB 4.41Å; W13-T23 WeakPolarHBondContact CA-O 3.34Å; W13-C24 HydrophobicContact CD2-CB 3.79Å; W13-C24 HydrophobicContact CE3-CB 3.73Å; W13-C24 HydrophobicContact CH2-CB 3.65Å; W13-C24 HydrophobicContact CZ2-CB 3.68Å; W13-C24 HydrophobicContact CZ3-CB 3.66Å |
| 14 | Q | 77.1 | Confident | 67.5 | Low | 86 Ų | 86 | 94 Ų | 94 | 40% | 0.402 | 51% | 0.514 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.4 | 132.6 | 178.4 | -170.7 | 173.3 | 25.9 | 0 | 0 | 110 | M1 T23 | M1-Q14 HydrophobicContact CE-CG 4.07Å; Q14-T23 PolarHBondContact N-O 3.44Å; Q14-T23 PolarHBondContact O-N 2.84Å; Q14-T23 PolarHBondContact O-OG1 2.95Å |
| 15 | R | 73.5 | Confident | 68.2 | Low | 122 Ų | 122 | 95.1 Ų | 95.1 | 46% | 0.46 | 52% | 0.517 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97 | 129.2 | 174.3 | -163.7 | -178.8 | -178.4 | 176.7 | -1.2 | 109.5 | G17 W22 | R15-G17 VanDerWaalsContact C-N 3.26Å; R15-G17 PolarHBondContact O-N 2.96Å; R15-W22 HydrophobicContact CB-CD2 4.03Å; R15-W22 HydrophobicContact CB-CE3 3.76Å; R15-W22 HydrophobicContact CB-CH2 3.89Å; R15-W22 HydrophobicContact CB-CZ2 4.14Å; R15-W22 HydrophobicContact CB-CZ3 3.69Å; R15-W22 HydrophobicContact CG-CD2 4.12Å; R15-W22 HydrophobicContact CG-CE3 4.36Å; R15-W22 HydrophobicContact CG-CH2 4.42Å; R15-W22 HydrophobicContact CG-CZ2 4.16Å |
| 16 | E | 74.6 | Confident | 68.9 | Low | 151 Ų | 151 | 95 Ų | 95 | 71% | 0.706 | 51% | 0.513 | S | S | * | . | trans | -80 | 71.5 | 178.7 | -161 | 178.3 | -175.2 | 0 | 0 | 111.1 | G20 R21 | E16-G20 VanDerWaalsContact O-CA 3.25Å; E16-G20 WeakPolarHBondContact O-CA 3.44Å; E16-R21 PolarHBondContact N-O 3.02Å | ||
| 17 | G | 74 | Confident | 68.9 | Low | 40 Ų | 40 | 94.5 Ų | 94.5 | 41% | 0.412 | 51% | 0.512 | S | S | . | . | S | Bend | trans | 77.4 | 176.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | R15 G19 G20 | R15-G17 VanDerWaalsContact C-N 3.26Å; R15-G17 PolarHBondContact O-N 2.96Å; G17-G19 PolarHBondContact O-N 3.47Å; G17-G19 VanDerWaalsContact O-N 3.13Å; G17-G20 PolarHBondContact O-N 3.36Å; G17-G20 VanDerWaalsContact O-N 3.11Å |
| 18 | P | 60.1 | Low | 68.6 | Low | 141 Ų | 141 | 97.2 Ų | 97.2 | 92% | 0.916 | 51% | 0.511 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.8 | 108.4 | -178.8 | 26.1 | -30.3 | 0 | 0 | 0 | 110.2 | ||
| 19 | G | 72 | Confident | 67.7 | Low | 65 Ų | 65 | 103.5 Ų | 103.5 | 67% | 0.67 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 99.3 | -4.5 | -175 | 0 | 0 | 0 | 0 | 0 | 115.1 | G17 | G17-G19 PolarHBondContact O-N 3.47Å; G17-G19 VanDerWaalsContact O-N 3.13Å |
| 20 | G | 67.4 | Low | 66.9 | Low | 23 Ų | 23 | 101.3 Ų | 101.3 | 24% | 0.237 | 51% | 0.51 | C | S | . | . | P | Polyproline II helix | trans | -78.4 | 165.4 | -177.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | E16 G17 | E16-G20 VanDerWaalsContact O-CA 3.25Å; E16-G20 WeakPolarHBondContact O-CA 3.44Å; G17-G20 PolarHBondContact O-N 3.36Å; G17-G20 VanDerWaalsContact O-N 3.11Å |
| 21 | R | 64.8 | Low | 65.4 | Low | 203 Ų | 203 | 103.7 Ų | 103.7 | 77% | 0.766 | 53% | 0.533 | S | S | * | . | P | Polyproline II helix | trans | -63.1 | 141.6 | 176.7 | -178.7 | -176 | -73.5 | -105.8 | 1.9 | 110.5 | E16 | E16-R21 PolarHBondContact N-O 3.02Š|
| 22 | W | 77.7 | Confident | 63.7 | Low | 133 Ų | 133 | 106.5 Ų | 106.5 | 50% | 0.504 | 56% | 0.558 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -79.3 | 130 | 169.1 | -70.4 | 101.1 | 0 | 0 | 0 | 110.2 | W13 R15 | W13-W22 HydrophobicContact CB-CE3 4.34Å; W13-W22 HydrophobicContact CE3-CB 4.23Å; W13-W22 HydrophobicContact CZ3-CB 4.41Å; R15-W22 HydrophobicContact CB-CD2 4.03Å; R15-W22 HydrophobicContact CB-CE3 3.76Å; R15-W22 HydrophobicContact CB-CH2 3.89Å; R15-W22 HydrophobicContact CB-CZ2 4.14Å; R15-W22 HydrophobicContact CB-CZ3 3.69Å; R15-W22 HydrophobicContact CG-CD2 4.12Å; R15-W22 HydrophobicContact CG-CE3 4.36Å; R15-W22 HydrophobicContact CG-CH2 4.42Å; R15-W22 HydrophobicContact CG-CZ2 4.16Å |
| 23 | T | 70.8 | Confident | 61.5 | Low | 53 Ų | 53 | 110.9 Ų | 110.9 | 33% | 0.325 | 58% | 0.582 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -116.9 | 137.8 | 173.9 | 60.3 | 0 | 0 | 0 | 0 | 109.4 | W13 Q14 | W13-T23 WeakPolarHBondContact CA-O 3.34Å; Q14-T23 PolarHBondContact N-O 3.44Å; Q14-T23 PolarHBondContact O-N 2.84Å; Q14-T23 PolarHBondContact O-OG1 2.95Å |
| 24 | C | 72.5 | Confident | 60.1 | Low | 69 Ų | 69 | 112.1 Ų | 112.1 | 47% | 0.466 | 60% | 0.602 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -105 | 127.9 | 174.9 | 63.6 | 0 | 0 | 0 | 0 | 109.9 | W13 | W13-C24 HydrophobicContact CD2-CB 3.79Å; W13-C24 HydrophobicContact CE3-CB 3.73Å; W13-C24 HydrophobicContact CH2-CB 3.65Å; W13-C24 HydrophobicContact CZ2-CB 3.68Å; W13-C24 HydrophobicContact CZ3-CB 3.66Å |
| 25 | Q | 70.8 | Confident | 58.2 | Low | 112 Ų | 112 | 112.2 Ų | 112.2 | 52% | 0.523 | 62% | 0.618 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -113 | 127.7 | 170.5 | -66.6 | -177.2 | 29.5 | 0 | 0 | 108.8 | L12 | L12-Q25 PolarHBondContact N-O 3.11Å; L12-Q25 PolarHBondContact O-N 3.01Å |
| 26 | T | 65.1 | Low | 56.2 | Low | 85 Ų | 85 | 115.7 Ų | 115.7 | 52% | 0.521 | 63% | 0.631 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -90.8 | 112 | 175.9 | 69.4 | 0 | 0 | 0 | 0 | 108.5 | F11 R28 | F11-T26 HydrophobicContact CD1-CG2 3.69Å; F11-T26 HydrophobicContact CE1-CG2 3.49Å; F11-T26 VanDerWaalsContact CE1-CG2 3.49Å; F11-T26 HydrophobicContact CZ-CG2 4.5Å; T26-R28 PolarHBondContact O-N 3.26Å; T26-R28 VanDerWaalsContact O-N 3.15Å |
| 27 | S | 54.8 | Low | 54.1 | Low | 65 Ų | 65 | 113.5 Ų | 113.5 | 46% | 0.455 | 64% | 0.638 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -78.5 | 102 | 171.7 | -171.4 | 0 | 0 | 0 | 0 | 108 | M10 R29 | M10-S27 PolarHBondContact O-N 3.38Å; S27-R29 VanDerWaalsContact C-N 3.29Å; S27-R29 PolarHBondContact O-N 3.05Å |
| 28 | R | 51.1 | Low | 52.1 | Low | 219 Ų | 219 | 115.1 Ų | 115.1 | 83% | 0.826 | 64% | 0.64 | S | S | * | * | trans | -75 | 88.2 | 171.4 | -145.7 | -172.8 | -60.9 | -131.5 | 4 | 106.5 | T26 V30 | T26-R28 PolarHBondContact O-N 3.26Å; T26-R28 VanDerWaalsContact O-N 3.15Å; R28-V30 PolarHBondContact O-N 3.32Å | ||
| 29 | R | 46.6 | Very low | 50.6 | Low | 208 Ų | 208 | 116 Ų | 116 | 79% | 0.785 | 63% | 0.632 | S | S | * | * | trans | -66.3 | 94.6 | 160.4 | -86.3 | -154.5 | -87.5 | -167.2 | -5.6 | 106.5 | S27 S31 | S27-R29 VanDerWaalsContact C-N 3.29Å; S27-R29 PolarHBondContact O-N 3.05Å; R29-S31 PolarHBondContact O-N 3.06Å | ||
| 30 | V | 39.3 | Very low | 48.6 | Very low | 94 Ų | 94 | 124 Ų | 124 | 57% | 0.57 | 64% | 0.642 | S | S | * | * | trans | -56.5 | 117 | 157.6 | 173.5 | 0 | 0 | 0 | 0 | 104.8 | R28 S32 | R28-V30 PolarHBondContact O-N 3.32Å; V30-S32 VanDerWaalsContact C-N 3.26Å; V30-S32 PolarHBondContact O-N 2.87Å | ||
| 31 | S | 36.8 | Very low | 46.8 | Very low | 115 Ų | 115 | 128.7 Ų | 128.7 | 80% | 0.804 | 66% | 0.661 | S | S | * | * | trans | -64.8 | 97.9 | 164.7 | 59.2 | 0 | 0 | 0 | 0 | 106.1 | R29 D33 | R29-S31 PolarHBondContact O-N 3.06Å; S31-D33 PolarHBondContact O-N 3.47Å | ||
| 32 | S | 36.2 | Very low | 45.5 | Very low | 108 Ų | 108 | 128.1 Ų | 128.1 | 76% | 0.755 | 67% | 0.667 | S | S | * | * | trans | -67.4 | 109.2 | 174.7 | -48.7 | 0 | 0 | 0 | 0 | 108.5 | V30 | V30-S32 VanDerWaalsContact C-N 3.26Å; V30-S32 PolarHBondContact O-N 2.87Å | ||
| 33 | D | 30.7 | Very low | 43.3 | Very low | 146 Ų | 146 | 129.2 Ų | 129.2 | 78% | 0.781 | 68% | 0.682 | S | S | * | * | trans | -86.7 | 135.5 | 147.2 | -151.3 | 10.4 | 0 | 0 | 0 | 106.4 | S31 A35 | S31-D33 PolarHBondContact O-N 3.47Å; D33-A35 PolarHBondContact O-N 3.46Å; D33-A35 VanDerWaalsContact O-N 3.1Å | ||
| 34 | P | 46.1 | Very low | 41.7 | Very low | 117 Ų | 117 | 132.6 Ų | 132.6 | 76% | 0.76 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -89.4 | 86.7 | -158.5 | 34.8 | -30.5 | 0 | 0 | 0 | 110.8 | ||
| 35 | A | 36.6 | Very low | 40.1 | Very low | 88 Ų | 88 | 141.5 Ų | 141.5 | 73% | 0.727 | 73% | 0.728 | S | S | * | * | trans | -157 | 49 | 171.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | D33 | D33-A35 PolarHBondContact O-N 3.46Å; D33-A35 VanDerWaalsContact O-N 3.1Å | ||
| 36 | W | 32.8 | Very low | 38.5 | Very low | 194 Ų | 194 | 139.4 Ų | 139.4 | 74% | 0.735 | 74% | 0.736 | S | S | * | * | trans | -165.3 | 112.8 | 152.7 | 47.9 | -82.9 | 0 | 0 | 0 | 109.9 | V38 | W36-V38 HydrophobicContact CE3-CB 3.87Å; W36-V38 HydrophobicContact CE3-CG2 3.32Å; W36-V38 HydrophobicContact CZ3-CB 3.73Å; W36-V38 HydrophobicContact CZ3-CG2 3.37Å; W36-V38 PolarHBondContact O-N 3.17Å | ||
| 37 | A | 30.6 | Very low | 37 | Very low | 105 Ų | 105 | 143.9 Ų | 143.9 | 87% | 0.868 | 76% | 0.756 | S | S | * | * | trans | -69.5 | 117.4 | 161.7 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 38 | V | 31.3 | Very low | 36.2 | Very low | 75 Ų | 75 | 145.6 Ų | 145.6 | 46% | 0.455 | 77% | 0.769 | S | S | . | * | trans | -100 | 102.7 | 157.5 | 160 | 0 | 0 | 0 | 0 | 106.6 | W36 W40 | W36-V38 HydrophobicContact CE3-CB 3.87Å; W36-V38 HydrophobicContact CE3-CG2 3.32Å; W36-V38 HydrophobicContact CZ3-CB 3.73Å; W36-V38 HydrophobicContact CZ3-CG2 3.37Å; W36-V38 PolarHBondContact O-N 3.17Å; V38-W40 HydrophobicContact CG1-CD2 4.23Å; V38-W40 HydrophobicContact CG1-CG 4.49Å; V38-W40 HydrophobicContact CG1-CZ2 4.18Å | ||
| 39 | E | 28 | Very low | 35.4 | Very low | 158 Ų | 158 | 142.9 Ų | 142.9 | 74% | 0.738 | 77% | 0.769 | S | S | * | * | trans | -74 | 119.5 | 165.3 | -168.4 | 180 | -170.2 | 0 | 0 | 107.5 | I41 | E39-I41 HydrophobicContact CG-CG1 4.17Å; E39-I41 PolarHBondContact O-N 3.34Å | ||
| 40 | W | 29.9 | Very low | 34.7 | Very low | 235 Ų | 235 | 137.5 Ų | 137.5 | 89% | 0.89 | 76% | 0.764 | S | S | * | * | trans | -85 | 101 | 174.2 | -67.1 | 93.5 | 0 | 0 | 0 | 108.4 | V38 | V38-W40 HydrophobicContact CG1-CD2 4.23Å; V38-W40 HydrophobicContact CG1-CG 4.49Å; V38-W40 HydrophobicContact CG1-CZ2 4.18Å | ||
| 41 | I | 30.6 | Very low | 34.5 | Very low | 121 Ų | 121 | 139.1 Ų | 139.1 | 62% | 0.621 | 78% | 0.779 | S | S | * | * | trans | -96.6 | 110.3 | 167.5 | -62.1 | 173.4 | 0 | 0 | 0 | 107.5 | E39 L43 | E39-I41 HydrophobicContact CG-CG1 4.17Å; E39-I41 PolarHBondContact O-N 3.34Å; I41-L43 HydrophobicContact CG2-CG 4.47Å | ||
| 42 | E | 37 | Very low | 34.4 | Very low | 190 Ų | 190 | 141.8 Ų | 141.8 | 89% | 0.888 | 78% | 0.783 | S | S | * | * | trans | -70.7 | 130.9 | 167.7 | -82.1 | -176.2 | 142 | 0 | 0 | 110.2 | ||||
| 43 | L | 31.6 | Very low | 34.1 | Very low | 157 Ų | 157 | 140.3 Ų | 140.3 | 82% | 0.822 | 79% | 0.785 | S | S | * | * | trans | -130.2 | 147.2 | 162.9 | -82 | 165.9 | 0 | 0 | 0 | 110.8 | I41 | I41-L43 HydrophobicContact CG2-CG 4.47Š| ||
| 44 | P | 36.6 | Very low | 34.1 | Very low | 123 Ų | 123 | 139 Ų | 139 | 80% | 0.799 | 79% | 0.788 | S | S | * | * | trans | -87.7 | 162.6 | -161.5 | 3 | 16.7 | 0 | 0 | 0 | 113.8 | ||||
| 45 | R | 40.6 | Very low | 33.4 | Very low | 256 Ų | 256 | 138.2 Ų | 138.2 | 97% | 0.966 | 79% | 0.791 | S | S | * | * | trans | -49.3 | 133.6 | -176.6 | -60.1 | 174.3 | 178 | 177.4 | -1.3 | 114.7 | ||||
| 46 | G | 36.9 | Very low | 33.3 | Very low | 68 Ų | 68 | 145 Ų | 145 | 70% | 0.701 | 80% | 0.798 | S | S | * | * | trans | 152.3 | 127.2 | 153.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 47 | L | 32.6 | Very low | 33.4 | Very low | 179 Ų | 179 | 142.9 Ų | 142.9 | 94% | 0.937 | 81% | 0.806 | S | S | * | * | trans | 97.6 | 126.8 | 160.4 | -50.7 | 179.3 | 0 | 0 | 0 | 119.1 | ||||
| 48 | S | 38.4 | Very low | 33.6 | Very low | 102 Ų | 102 | 145.6 Ų | 145.6 | 71% | 0.713 | 81% | 0.805 | S | S | * | * | trans | -61.5 | 157.1 | 172.4 | 54.5 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 49 | L | 33.5 | Very low | 33.8 | Very low | 161 Ų | 161 | 153.9 Ų | 153.9 | 84% | 0.843 | 83% | 0.828 | S | S | * | * | -177.2 | 125.5 | 125.8 | -95.5 | 162.4 | 0 | 0 | 0 | 113 | |||||
| 50 | S | 32.2 | Very low | 33.9 | Very low | 95 Ų | 95 | 150 Ų | 150 | 66% | 0.664 | 83% | 0.831 | S | S | * | * | trans | 40.1 | 120.3 | 144.9 | 54.3 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 51 | S | 34.8 | Very low | 33.9 | Very low | 128 Ų | 128 | 148.8 Ų | 148.8 | 90% | 0.895 | 83% | 0.826 | S | S | * | * | trans | -55 | 131.4 | 157.5 | 179.2 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 52 | L | 34.6 | Very low | 34 | Very low | 171 Ų | 171 | 148.5 Ų | 148.5 | 90% | 0.895 | 84% | 0.835 | S | S | * | * | trans | -144.3 | 124.1 | 175.3 | -138.9 | 141.9 | 0 | 0 | 0 | 108.4 | ||||
| 53 | G | 29.8 | Very low | 33.7 | Very low | 77 Ų | 77 | 149.3 Ų | 149.3 | 79% | 0.794 | 83% | 0.83 | S | S | * | * | trans | 159.5 | 55.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 54 | S | 30.7 | Very low | 33.7 | Very low | 120 Ų | 120 | 146.9 Ų | 146.9 | 84% | 0.839 | 83% | 0.826 | S | S | * | * | trans | -77.9 | 124.3 | 168 | -176.7 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 55 | A | 31.6 | Very low | 33.4 | Very low | 99 Ų | 99 | 146.7 Ų | 146.7 | 82% | 0.818 | 83% | 0.828 | S | S | * | * | trans | -107.3 | 118 | 172.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 56 | R | 35.3 | Very low | 33.2 | Very low | 232 Ų | 232 | 146 Ų | 146 | 88% | 0.875 | 83% | 0.825 | S | S | * | * | trans | -82.6 | 143.4 | 172.7 | -60.8 | 176.9 | -152.7 | -173.1 | 4.9 | 109.8 | ||||
| 57 | T | 34 | Very low | 33.3 | Very low | 148 Ų | 148 | 148.9 Ų | 148.9 | 91% | 0.908 | 83% | 0.832 | S | S | * | * | trans | -126.9 | 117.4 | 157.1 | 48.4 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 58 | L | 35.4 | Very low | 33.2 | Very low | 162 Ų | 162 | 145.6 Ų | 145.6 | 85% | 0.848 | 82% | 0.824 | S | S | * | * | trans | -103.1 | 127 | 164.8 | -80.8 | 167.2 | 0 | 0 | 0 | 106.8 | ||||
| 59 | R | 35.8 | Very low | 33.1 | Very low | 249 Ų | 249 | 146.3 Ų | 146.3 | 94% | 0.94 | 83% | 0.828 | S | S | * | * | trans | -157.6 | 115.3 | 139.3 | -85.3 | -143.7 | -89.6 | -97.2 | 3.3 | 109.3 | ||||
| 60 | G | 29.9 | Very low | 33.1 | Very low | 77 Ų | 77 | 145.6 Ų | 145.6 | 79% | 0.794 | 83% | 0.83 | S | S | * | * | trans | -81.6 | 147.1 | 166.3 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 61 | W | 31 | Very low | 33.1 | Very low | 210 Ų | 210 | 148 Ų | 148 | 80% | 0.795 | 84% | 0.836 | S | S | * | * | trans | -145.3 | 108.3 | 160.2 | -175.6 | -83.4 | 0 | 0 | 0 | 108.2 | ||||
| 62 | S | 31.2 | Very low | 33 | Very low | 115 Ų | 115 | 147.2 Ų | 147.2 | 80% | 0.804 | 83% | 0.831 | S | S | * | * | trans | -82.7 | 134.5 | 170.7 | -62.9 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 63 | R | 31 | Very low | 33.2 | Very low | 207 Ų | 207 | 147.5 Ų | 147.5 | 78% | 0.781 | 83% | 0.827 | S | S | * | * | trans | -154.2 | 126.6 | 145.6 | -136.9 | 172.8 | -84.9 | -123 | 3.9 | 112 | ||||
| 64 | S | 31.1 | Very low | 33.3 | Very low | 105 Ų | 105 | 151.4 Ų | 151.4 | 73% | 0.734 | 83% | 0.83 | S | S | * | * | trans | -78.2 | 146.3 | 174 | 166.6 | 0 | 0 | 0 | 0 | 111 | ||||
| 65 | S | 31 | Very low | 33.7 | Very low | 120 Ų | 120 | 153.2 Ų | 153.2 | 84% | 0.839 | 83% | 0.829 | S | S | * | * | trans | -162.7 | 133.5 | 148.2 | -66.7 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 66 | R | 35.7 | Very low | 34.3 | Very low | 240 Ų | 240 | 154.1 Ų | 154.1 | 91% | 0.906 | 83% | 0.827 | S | S | * | * | trans | -75.7 | 163.3 | 173.1 | -67.1 | 177.1 | -172.9 | -160.8 | 0.4 | 111.6 | ||||
| 67 | P | 39.5 | Very low | 34.4 | Very low | 130 Ų | 130 | 152.2 Ų | 152.2 | 84% | 0.844 | 83% | 0.828 | S | S | * | * | trans | -100.1 | 147.5 | 170.1 | 36.4 | -28.3 | 0 | 0 | 0 | 113.4 | ||||
| 68 | S | 31.1 | Very low | 34.6 | Very low | 110 Ų | 110 | 152 Ų | 152 | 77% | 0.769 | 83% | 0.826 | S | S | * | * | trans | -127.2 | 100.6 | 158.8 | 54.5 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 69 | S | 35 | Very low | 34.7 | Very low | 116 Ų | 116 | 150.5 Ų | 150.5 | 81% | 0.811 | 82% | 0.819 | S | S | * | * | 48.4 | 101.3 | 100.6 | -171.8 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 70 | V | 34.3 | Very low | 35.3 | Very low | 146 Ų | 146 | 145.4 Ų | 145.4 | 89% | 0.885 | 82% | 0.815 | S | S | * | * | trans | -148.3 | 134.5 | 143.4 | -125 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 71 | D | 31.4 | Very low | 36.1 | Very low | 146 Ų | 146 | 143.9 Ų | 143.9 | 78% | 0.781 | 80% | 0.8 | S | S | * | * | trans | -87.3 | 168.9 | 178.9 | -160.8 | 1.8 | 0 | 0 | 0 | 110.3 | ||||
| 72 | S | 34.5 | Very low | 36.9 | Very low | 112 Ų | 112 | 139.8 Ų | 139.8 | 78% | 0.783 | 79% | 0.794 | S | S | * | * | trans | 110.1 | 112.7 | 162.1 | -45.7 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 73 | Q | 37 | Very low | 37.7 | Very low | 177 Ų | 177 | 139.9 Ų | 139.9 | 83% | 0.827 | 79% | 0.789 | S | S | * | * | trans | -74.5 | 147 | 171.4 | -59.9 | 166.4 | -4.5 | 0 | 0 | 110.4 | ||||
| 74 | D | 32.8 | Very low | 38.6 | Very low | 158 Ų | 158 | 135 Ų | 135 | 85% | 0.845 | 78% | 0.783 | S | S | * | * | trans | -161.8 | 151.7 | 132.1 | -106.7 | -28.9 | 0 | 0 | 0 | 111.8 | ||||
| 75 | L | 38.1 | Very low | 39.6 | Very low | 158 Ų | 158 | 133.5 Ų | 133.5 | 83% | 0.827 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 154.5 | -157 | -65.2 | 139.9 | 0 | 0 | 0 | 116.4 | ||
| 76 | P | 44.6 | Very low | 40.7 | Very low | 118 Ų | 118 | 135.1 Ų | 135.1 | 77% | 0.766 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -89.7 | 130.4 | -178.5 | 34 | -32 | 0 | 0 | 0 | 114 | ||
| 77 | E | 38.5 | Very low | 41.5 | Very low | 193 Ų | 193 | 130.5 Ų | 130.5 | 90% | 0.902 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 120.5 | 163.5 | -167.4 | 171.9 | -169.8 | 0 | 0 | 109.2 | N79 | E77-N79 PolarHBondContact O-N 2.9Å; E77-N79 VanDerWaalsContact O-N 3.17Å |
| 78 | V | 37 | Very low | 41.8 | Very low | 142 Ų | 142 | 130.2 Ų | 130.2 | 86% | 0.861 | 76% | 0.763 | S | S | * | * | trans | -78 | 98.3 | -176.7 | -101.9 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 79 | N | 37.8 | Very low | 42.6 | Very low | 131 Ų | 131 | 133.5 Ų | 133.5 | 70% | 0.701 | 76% | 0.763 | S | S | * | * | trans | -83.3 | 126.1 | 171.5 | 178.9 | 6.1 | 0 | 0 | 0 | 110.7 | E77 G81 | E77-N79 PolarHBondContact O-N 2.9Å; E77-N79 VanDerWaalsContact O-N 3.17Å; N79-G81 PolarHBondContact O-N 3.46Å; N79-G81 PolarHBondContact OD1-N 3.04Å | ||
| 80 | V | 47.9 | Very low | 43.4 | Very low | 142 Ų | 142 | 133.1 Ų | 133.1 | 86% | 0.861 | 76% | 0.761 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.8 | 16.4 | -178.4 | -176.1 | 0 | 0 | 0 | 0 | 112.4 | ||
| 81 | G | 47.9 | Very low | 44.4 | Very low | 46 Ų | 46 | 136.9 Ų | 136.9 | 47% | 0.474 | 76% | 0.759 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -91.3 | 2 | -176 | 0 | 0 | 0 | 0 | 0 | 117.5 | N79 T83 | N79-G81 PolarHBondContact O-N 3.46Å; N79-G81 PolarHBondContact OD1-N 3.04Å; G81-T83 PolarHBondContact O-N 3.14Å |
| 82 | D | 46.8 | Very low | 45.9 | Very low | 124 Ų | 124 | 141 Ų | 141 | 66% | 0.663 | 76% | 0.764 | S | S | * | * | trans | -101.7 | 54.6 | -170.2 | -90.6 | -17 | 0 | 0 | 0 | 113.9 | V84 A85 | D82-V84 VanDerWaalsContact C-N 3.26Å; D82-A85 HydrophobicContact CB-CB 4.36Å | ||
| 83 | T | 49.7 | Very low | 47.7 | Very low | 117 Ų | 117 | 140.5 Ų | 140.5 | 72% | 0.718 | 77% | 0.766 | S | S | * | * | G | 310 helix | trans | -80.3 | -8.5 | 170.2 | 54.2 | 0 | 0 | 0 | 0 | 113.1 | G81 A85 | G81-T83 PolarHBondContact O-N 3.14Å; T83-A85 VanDerWaalsContact C-N 3.28Å |
| 84 | V | 48.9 | Very low | 49.5 | Very low | 105 Ų | 105 | 136.5 Ų | 136.5 | 64% | 0.636 | 75% | 0.75 | S | S | * | * | G | 310 helix | trans | -82.9 | -5.9 | 174.1 | -162.6 | 0 | 0 | 0 | 0 | 112.2 | D82 | D82-V84 VanDerWaalsContact C-N 3.26Š|
| 85 | A | 51.2 | Low | 51.8 | Low | 72 Ų | 72 | 132.5 Ų | 132.5 | 60% | 0.595 | 73% | 0.731 | S | S | * | * | G | 310 helix | trans | -89.4 | -1.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | D82 T83 L87 | D82-A85 HydrophobicContact CB-CB 4.36Å; T83-A85 VanDerWaalsContact C-N 3.28Å; A85-L87 VanDerWaalsContact C-N 3.26Å; A85-L87 PolarHBondContact O-N 3.44Å |
| 86 | M | 54 | Low | 53.7 | Low | 155 Ų | 155 | 132.1 Ų | 132.1 | 76% | 0.764 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -79.3 | -0.7 | -175.4 | -74.2 | -70.7 | -64.2 | 0 | 0 | 114.7 | ||
| 87 | L | 53.5 | Low | 55.5 | Low | 143 Ų | 143 | 134.3 Ų | 134.3 | 75% | 0.749 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -130.5 | 128.7 | 173.3 | -71.5 | 170.9 | 0 | 0 | 0 | 110.3 | A85 K89 | A85-L87 VanDerWaalsContact C-N 3.26Å; A85-L87 PolarHBondContact O-N 3.44Å; L87-K89 PolarHBondContact O-N 3.46Å |
| 88 | P | 45.5 | Very low | 57.5 | Low | 124 Ų | 124 | 129.5 Ų | 129.5 | 81% | 0.805 | 71% | 0.706 | S | S | * | * | trans | -69.4 | 102.6 | -178.8 | 26.6 | -30.7 | 0 | 0 | 0 | 109.9 | S90 | P88-S90 VanDerWaalsContact C-N 3.3Å; P88-S90 PolarHBondContact O-N 3.48Å | ||
| 89 | K | 48.1 | Very low | 59.3 | Low | 178 Ų | 178 | 127.2 Ų | 127.2 | 77% | 0.774 | 69% | 0.688 | S | S | * | * | trans | -66.2 | 91.1 | 162.4 | -78 | 165.5 | 177.9 | 161.3 | 0 | 108.2 | L87 R91 | L87-K89 PolarHBondContact O-N 3.46Å; K89-R91 PolarHBondContact O-N 3.33Å | ||
| 90 | S | 51.1 | Low | 61.1 | Low | 108 Ų | 108 | 123.2 Ų | 123.2 | 76% | 0.755 | 67% | 0.673 | S | S | * | * | trans | -69.5 | 112.8 | 177.4 | 62.8 | 0 | 0 | 0 | 0 | 110.3 | P88 | P88-S90 VanDerWaalsContact C-N 3.3Å; P88-S90 PolarHBondContact O-N 3.48Å | ||
| 91 | R | 55 | Low | 62.3 | Low | 226 Ų | 226 | 118.5 Ų | 118.5 | 85% | 0.853 | 65% | 0.649 | S | S | * | * | trans | -169.9 | 21.1 | 150.6 | -105.9 | 175.8 | -140.5 | -83.1 | 5.2 | 114.4 | K89 | K89-R91 PolarHBondContact O-N 3.33Š| ||
| 92 | R | 63.4 | Low | 63.4 | Low | 232 Ų | 232 | 120.8 Ų | 120.8 | 88% | 0.875 | 65% | 0.65 | S | S | * | * | S | Bend | trans | -121.5 | 125.6 | 164.1 | -71.6 | -173.1 | -172.9 | 87.9 | 1.9 | 109 | L94 | R92-L94 PolarHBondContact O-N 2.88Š|
| 93 | A | 72.1 | Confident | 64.3 | Low | 101 Ų | 101 | 117.9 Ų | 117.9 | 84% | 0.835 | 64% | 0.643 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 121.5 | 172.4 | 0 | 0 | 0 | 0 | 0 | 108.2 | T95 | A93-T95 PolarHBondContact O-N 2.99Š|
| 94 | L | 76 | Confident | 65.1 | Low | 94 Ų | 94 | 120.5 Ų | 120.5 | 49% | 0.492 | 64% | 0.64 | S | S | . | * | P | Polyproline II helix | trans | -64.9 | 132.6 | 177.4 | -63.6 | 173.4 | 0 | 0 | 0 | 109 | R92 E98 I99 L102 | R92-L94 PolarHBondContact O-N 2.88Å; L94-E98 HydrophobicContact CB-CB 4.27Å; L94-E98 HydrophobicContact CD2-CB 4.3Å; L94-I99 HydrophobicContact CB-CD1 4.27Å; L94-I99 HydrophobicContact CB-CG1 3.71Å; L94-I99 HydrophobicContact CD1-CG1 4.45Å; L94-L102 HydrophobicContact CD1-CD1 3.73Å |
| 95 | T | 79.8 | Confident | 65.4 | Low | 73 Ų | 73 | 119.3 Ų | 119.3 | 45% | 0.448 | 64% | 0.636 | S | S | . | * | P | Polyproline II helix | trans | -65.9 | 156.4 | 171.3 | 63.9 | 0 | 0 | 0 | 0 | 110 | A93 Q97 E98 I99 | A93-T95 PolarHBondContact O-N 2.99Å; T95-Q97 PolarHBondContact O-N 3.38Å; T95-Q97 VanDerWaalsContact O-N 3.15Å; T95-E98 WeakPolarHBondContact CB-OE2 2.97Å; T95-E98 WeakPolarHBondContact CG2-OE2 3.4Å; T95-E98 PolarHBondContact N-OE2 3.44Å; T95-E98 WeakPolarHBondContact O-CB 3.32Å; T95-E98 PolarHBondContact O-N 3.15Å; T95-E98 VanDerWaalsContact OG1-CG 3.25Å; T95-E98 WeakPolarHBondContact OG1-CG 3.45Å; T95-E98 PolarHBondContact OG1-N 2.85Å; T95-E98 PolarHBondContact OG1-OE2 3.31Å; T95-I99 WeakPolarHBondContact O-CG1 3.29Å; T95-I99 PolarHBondContact O-N 2.84Å |
| 96 | I | 79.8 | Confident | 65.7 | Low | 150 Ų | 150 | 119.1 Ų | 119.1 | 77% | 0.769 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -56.9 | -34.1 | 179.7 | -62.2 | 169.1 | 0 | 0 | 0 | 111.2 | A100 | I96-A100 VanDerWaalsContact O-CB 3.28Å; I96-A100 WeakPolarHBondContact O-CB 3.42Å; I96-A100 PolarHBondContact O-N 2.95Å |
| 97 | Q | 82.2 | Confident | 65.6 | Low | 164 Ų | 164 | 118.2 Ų | 118.2 | 77% | 0.766 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -69.7 | -36.9 | 176.4 | -71.9 | -177.7 | -63.4 | 0 | 0 | 112.6 | T95 A100 A101 | T95-Q97 PolarHBondContact O-N 3.38Å; T95-Q97 VanDerWaalsContact O-N 3.15Å; Q97-A100 PolarHBondContact O-N 2.76Å; Q97-A101 WeakPolarHBondContact O-CB 3.44Å; Q97-A101 PolarHBondContact O-N 2.98Å |
| 98 | E | 80.8 | Confident | 65.6 | Low | 93 Ų | 93 | 119.4 Ų | 119.4 | 44% | 0.435 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -69.7 | -40.2 | 174.7 | -71.4 | 162.8 | 147.8 | 0 | 0 | 111.4 | L94 T95 A100 A101 L102 | L94-E98 HydrophobicContact CB-CB 4.27Å; L94-E98 HydrophobicContact CD2-CB 4.3Å; T95-E98 WeakPolarHBondContact CB-OE2 2.97Å; T95-E98 WeakPolarHBondContact CG2-OE2 3.4Å; T95-E98 PolarHBondContact N-OE2 3.44Å; T95-E98 WeakPolarHBondContact O-CB 3.32Å; T95-E98 PolarHBondContact O-N 3.15Å; T95-E98 VanDerWaalsContact OG1-CG 3.25Å; T95-E98 WeakPolarHBondContact OG1-CG 3.45Å; T95-E98 PolarHBondContact OG1-N 2.85Å; T95-E98 PolarHBondContact OG1-OE2 3.31Å; E98-A100 VanDerWaalsContact C-N 3.34Å; E98-A100 PolarHBondContact O-N 2.93Å; E98-A101 PolarHBondContact O-N 3.38Å; E98-L102 WeakPolarHBondContact O-CB 3.06Å; E98-L102 PolarHBondContact O-N 2.92Å |
| 99 | I | 73.4 | Confident | 66 | Low | 94 Ų | 94 | 116.6 Ų | 116.6 | 48% | 0.482 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -61.8 | -43.6 | 173 | -62.8 | 168.9 | 0 | 0 | 0 | 110.2 | L94 T95 L102 A103 | L94-I99 HydrophobicContact CB-CD1 4.27Å; L94-I99 HydrophobicContact CB-CG1 3.71Å; L94-I99 HydrophobicContact CD1-CG1 4.45Å; T95-I99 WeakPolarHBondContact O-CG1 3.29Å; T95-I99 PolarHBondContact O-N 2.84Å; I99-L102 PolarHBondContact O-N 3.15Å; I99-A103 WeakPolarHBondContact O-CB 3.28Å; I99-A103 PolarHBondContact O-N 3.49Å |
| 100 | A | 76.5 | Confident | 66.2 | Low | 46 Ų | 46 | 113.6 Ų | 113.6 | 38% | 0.38 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -68 | -34.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | I96 Q97 E98 R104 | I96-A100 VanDerWaalsContact O-CB 3.28Å; I96-A100 WeakPolarHBondContact O-CB 3.42Å; I96-A100 PolarHBondContact O-N 2.95Å; Q97-A100 PolarHBondContact O-N 2.76Å; E98-A100 VanDerWaalsContact C-N 3.34Å; E98-A100 PolarHBondContact O-N 2.93Å; A100-R104 WeakPolarHBondContact O-CB 3.3Å; A100-R104 VanDerWaalsContact O-CG 3.27Å; A100-R104 WeakPolarHBondContact O-CG 3.49Å; A100-R104 PolarHBondContact O-N 3.15Å; A100-R104 VanDerWaalsContact O-N 3.14Å; A100-R104 PolarHBondContact O-NE 2.9Å |
| 101 | A | 72.1 | Confident | 66.2 | Low | 44 Ų | 44 | 110.8 Ų | 110.8 | 36% | 0.364 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -67.2 | -44.3 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | Q97 E98 R104 S105 | Q97-A101 WeakPolarHBondContact O-CB 3.44Å; Q97-A101 PolarHBondContact O-N 2.98Å; E98-A101 PolarHBondContact O-N 3.38Å; A101-R104 CarbonylContact O-C 3.58Å; A101-R104 PolarHBondContact O-N 3.2Å; A101-S105 WeakPolarHBondContact O-CB 3.19Å; A101-S105 PolarHBondContact O-N 3.31Å; A101-S105 PolarHBondContact O-OG 2.95Å |
| 102 | L | 71.3 | Confident | 66.1 | Low | 93 Ų | 93 | 107.5 Ų | 107.5 | 49% | 0.487 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -61.2 | -43.9 | 174.6 | -103.2 | 148.5 | 0 | 0 | 0 | 112.7 | L94 E98 I99 R104 S105 S106 | L94-L102 HydrophobicContact CD1-CD1 3.73Å; E98-L102 WeakPolarHBondContact O-CB 3.06Å; E98-L102 PolarHBondContact O-N 2.92Å; I99-L102 PolarHBondContact O-N 3.15Å; L102-R104 VanDerWaalsContact C-N 3.28Å; L102-R104 PolarHBondContact O-N 3.32Å; L102-S105 WeakPolarHBondContact CA-OG 3.33Å; L102-S105 PolarHBondContact O-N 3.12Å; L102-S105 PolarHBondContact O-OG 3.2Å; L102-S105 VanDerWaalsContact O-OG 3.09Å; L102-S106 VanDerWaalsContact O-CB 3.26Å; L102-S106 WeakPolarHBondContact O-CB 3.32Å; L102-S106 PolarHBondContact O-N 2.73Å |
| 103 | A | 66.4 | Low | 65.6 | Low | 63 Ų | 63 | 101.5 Ų | 101.5 | 52% | 0.521 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -62.4 | -37.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | I99 | I99-A103 WeakPolarHBondContact O-CB 3.28Å; I99-A103 PolarHBondContact O-N 3.49Å |
| 104 | R | 66.3 | Low | 64.7 | Low | 172 Ų | 172 | 100.2 Ų | 100.2 | 65% | 0.649 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -78.1 | -31.6 | 176.3 | -68.8 | -176.5 | -57 | 164.9 | 7 | 113.1 | A100 A101 L102 H108 | A100-R104 WeakPolarHBondContact O-CB 3.3Å; A100-R104 VanDerWaalsContact O-CG 3.27Å; A100-R104 WeakPolarHBondContact O-CG 3.49Å; A100-R104 PolarHBondContact O-N 3.15Å; A100-R104 VanDerWaalsContact O-N 3.14Å; A100-R104 PolarHBondContact O-NE 2.9Å; A101-R104 CarbonylContact O-C 3.58Å; A101-R104 PolarHBondContact O-N 3.2Å; L102-R104 VanDerWaalsContact C-N 3.28Å; L102-R104 PolarHBondContact O-N 3.32Å; R104-H108 PolarHBondContact O-ND1 3.43Å |
| 105 | S | 55.8 | Low | 63.8 | Low | 80 Ų | 80 | 102.8 Ų | 102.8 | 56% | 0.559 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -75.8 | -32.9 | 177 | 70.6 | 0 | 0 | 0 | 0 | 112.3 | A101 L102 L107 | A101-S105 WeakPolarHBondContact O-CB 3.19Å; A101-S105 PolarHBondContact O-N 3.31Å; A101-S105 PolarHBondContact O-OG 2.95Å; L102-S105 WeakPolarHBondContact CA-OG 3.33Å; L102-S105 PolarHBondContact O-N 3.12Å; L102-S105 PolarHBondContact O-OG 3.2Å; L102-S105 VanDerWaalsContact O-OG 3.09Å; S105-L107 VanDerWaalsContact C-N 3.28Å; S105-L107 PolarHBondContact O-N 3.41Å |
| 106 | S | 56 | Low | 62.7 | Low | 68 Ų | 68 | 105.8 Ų | 105.8 | 48% | 0.476 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -65.8 | -29.1 | 173.9 | -174.2 | 0 | 0 | 0 | 0 | 112.6 | L102 I110 | L102-S106 VanDerWaalsContact O-CB 3.26Å; L102-S106 WeakPolarHBondContact O-CB 3.32Å; L102-S106 PolarHBondContact O-N 2.73Å; S106-I110 WeakPolarHBondContact O-CD1 3.16Å; S106-I110 WeakPolarHBondContact O-CG1 3.4Å |
| 107 | L | 53 | Low | 61.7 | Low | 137 Ų | 137 | 103.6 Ų | 103.6 | 72% | 0.717 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.3 | -16.5 | -172.9 | -165.3 | 62.3 | 0 | 0 | 0 | 115 | S105 | S105-L107 VanDerWaalsContact C-N 3.28Å; S105-L107 PolarHBondContact O-N 3.41Å |
| 108 | H | 53.8 | Low | 60.5 | Low | 168 Ų | 168 | 98.8 Ų | 98.8 | 78% | 0.778 | 55% | 0.548 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.9 | -3.4 | -176.9 | -68.6 | 85.5 | 0 | 0 | 0 | 114.2 | R104 | R104-H108 PolarHBondContact O-ND1 3.43Š|
| 109 | G | 52.8 | Low | 59.5 | Low | 65 Ų | 65 | 95.7 Ų | 95.7 | 67% | 0.67 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115.9 | -8.6 | -176.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | S111 | G109-S111 PolarHBondContact O-N 3.2Š|
| 110 | I | 53.2 | Low | 58.9 | Low | 115 Ų | 115 | 100 Ų | 100 | 59% | 0.59 | 55% | 0.551 | S | S | * | * | S | Bend | trans | -86.4 | 73.5 | 179.7 | -53.3 | 166.8 | 0 | 0 | 0 | 109 | S106 | S106-I110 WeakPolarHBondContact O-CD1 3.16Å; S106-I110 WeakPolarHBondContact O-CG1 3.4Å |
| 111 | S | 51.5 | Low | 57.9 | Low | 48 Ų | 48 | 101.8 Ų | 101.8 | 34% | 0.336 | 56% | 0.558 | S | S | . | * | trans | 49.6 | 106.3 | 137 | -169.1 | 0 | 0 | 0 | 0 | 118.6 | G109 V113 V114 K115 | G109-S111 PolarHBondContact O-N 3.2Å; S111-V113 PolarHBondContact O-N 3.33Å; S111-V113 WeakPolarHBondContact OG-CA 3.42Å; S111-V113 WeakPolarHBondContact OG-CB 3.37Å; S111-V113 PolarHBondContact OG-N 3.42Å; S111-V114 PolarHBondContact O-N 3.45Å; S111-V114 PolarHBondContact OG-N 2.92Å; S111-K115 PolarHBondContact O-N 3.03Å | ||
| 112 | Q | 52.2 | Low | 57.4 | Low | 158 Ų | 158 | 103.5 Ų | 103.5 | 74% | 0.738 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -43.4 | -24.4 | 153.9 | -129.6 | 95.8 | -14.7 | 0 | 0 | 113.3 | ||
| 113 | V | 53.1 | Low | 56.9 | Low | 106 Ų | 106 | 103.3 Ų | 103.3 | 64% | 0.642 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -81.3 | -25.9 | -177.5 | -174 | 0 | 0 | 0 | 0 | 112.9 | S111 H117 | S111-V113 PolarHBondContact O-N 3.33Å; S111-V113 WeakPolarHBondContact OG-CA 3.42Å; S111-V113 WeakPolarHBondContact OG-CB 3.37Å; S111-V113 PolarHBondContact OG-N 3.42Å; V113-H117 PolarHBondContact O-CE1 2.88Å; V113-H117 VanDerWaalsContact O-CE1 3.27Å; V113-H117 PolarHBondContact O-ND1 2.85Å |
| 114 | V | 53.4 | Low | 56.4 | Low | 74 Ų | 74 | 105 Ų | 105 | 45% | 0.448 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -92.2 | -26.2 | 176 | -174.8 | 0 | 0 | 0 | 0 | 111.3 | S111 D116 H117 V118 | S111-V114 PolarHBondContact O-N 3.45Å; S111-V114 PolarHBondContact OG-N 2.92Å; V114-D116 PolarHBondContact O-N 3.27Å; V114-H117 PolarHBondContact O-N 2.83Å; V114-V118 HydrophobicContact CG1-CG2 4.4Å; V114-V118 PolarHBondContact O-N 3.17Å |
| 115 | K | 55.8 | Low | 56 | Low | 147 Ų | 147 | 101 Ų | 101 | 64% | 0.639 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -55.5 | -33.4 | 179.2 | 179.3 | 175.1 | 156.6 | -178.3 | 0 | 113.7 | S111 H117 | S111-K115 PolarHBondContact O-N 3.03Å; K115-H117 VanDerWaalsContact C-N 3.31Å |
| 116 | D | 56.8 | Low | 56.3 | Low | 137 Ų | 137 | 105 Ų | 105 | 73% | 0.733 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.4 | -11.2 | 177.5 | -74.3 | -7 | 0 | 0 | 0 | 113.9 | V114 | V114-D116 PolarHBondContact O-N 3.27Š|
| 117 | H | 58.6 | Low | 56.6 | Low | 103 Ų | 103 | 105.6 Ų | 105.6 | 48% | 0.477 | 61% | 0.605 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -104.3 | -6.1 | 178.5 | -57.6 | 85.6 | 0 | 0 | 0 | 112.5 | V113 V114 K115 T119 | V113-H117 PolarHBondContact O-CE1 2.88Å; V113-H117 VanDerWaalsContact O-CE1 3.27Å; V113-H117 PolarHBondContact O-ND1 2.85Å; V114-H117 PolarHBondContact O-N 2.83Å; K115-H117 VanDerWaalsContact C-N 3.31Å; H117-T119 PolarHBondContact O-N 2.97Å |
| 118 | V | 57.5 | Low | 57.2 | Low | 64 Ų | 64 | 106.1 Ų | 106.1 | 39% | 0.388 | 60% | 0.598 | S | S | . | * | B | Isolated β-bridge | trans | -80.3 | 106.4 | 170 | -179.7 | 0 | 0 | 0 | 0 | 106.7 | V114 | V114-V118 HydrophobicContact CG1-CG2 4.4Å; V114-V118 PolarHBondContact O-N 3.17Å |
| 119 | T | 60.3 | Low | 57.7 | Low | 28 Ų | 28 | 102.5 Ų | 102.5 | 17% | 0.172 | 59% | 0.587 | C | S | . | * | trans | -55.4 | 149.7 | 173.4 | 66.9 | 0 | 0 | 0 | 0 | 110.1 | H117 L132 E134 | H117-T119 PolarHBondContact O-N 2.97Å; T119-L132 WeakPolarHBondContact CB-O 3.38Å; T119-L132 HydrophobicContact CG2-CB 4.16Å; T119-L132 VanDerWaalsContact CG2-O 3.23Å; T119-L132 WeakPolarHBondContact CG2-O 3.36Å; T119-L132 PolarHBondContact N-O 3.49Å; T119-L132 WeakPolarHBondContact OG1-CA 3.41Å; T119-L132 WeakPolarHBondContact OG1-CB 3.31Å; T119-L132 PolarHBondContact OG1-N 3.37Å; T119-L132 PolarHBondContact OG1-O 3.18Å; T119-E134 HydrophobicContact CG2-CG 3.95Å; T119-E134 WeakPolarHBondContact CG2-OE1 3.37Å | ||
| 120 | K | 60.5 | Low | 58.3 | Low | 184 Ų | 184 | 101.4 Ų | 101.4 | 80% | 0.8 | 57% | 0.572 | S | S | * | * | trans | -50.5 | 142.1 | 173 | -66.8 | 178.1 | 179.3 | 175.6 | 0 | 109.5 | T122 | K120-T122 PolarHBondContact O-N 3.06Š| ||
| 121 | P | 56.6 | Low | 58.7 | Low | 83 Ų | 83 | 101.7 Ų | 101.7 | 54% | 0.539 | 57% | 0.57 | S | S | . | * | trans | -55.5 | 109.9 | 178.8 | 20.9 | -30.7 | 0 | 0 | 0 | 109.5 | A123 V129 | P121-A123 PolarHBondContact O-N 3.34Å; P121-A123 VanDerWaalsContact O-N 3.16Å; P121-V129 HydrophobicContact CB-CG1 3.54Å | ||
| 122 | T | 60.7 | Low | 59.4 | Low | 81 Ų | 81 | 104.8 Ų | 104.8 | 50% | 0.497 | 58% | 0.582 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -76.9 | 105.6 | 174.3 | -59.1 | 0 | 0 | 0 | 0 | 106.4 | K120 M124 A130 | K120-T122 PolarHBondContact O-N 3.06Å; T122-M124 PolarHBondContact O-N 2.94Å; T122-A130 PolarHBondContact N-O 2.9Å |
| 123 | A | 60.9 | Low | 60 | Low | 88 Ų | 88 | 102.3 Ų | 102.3 | 73% | 0.727 | 57% | 0.573 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -64.2 | 118.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | P121 | P121-A123 PolarHBondContact O-N 3.34Å; P121-A123 VanDerWaalsContact O-N 3.16Å |
| 124 | M | 56.5 | Low | 60.3 | Low | 98 Ų | 98 | 102.4 Ų | 102.4 | 48% | 0.483 | 57% | 0.567 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -95.1 | 146.4 | 169.9 | -63 | -179.4 | 60.4 | 0 | 0 | 109.5 | T122 R128 A130 | T122-M124 PolarHBondContact O-N 2.94Å; M124-R128 WeakPolarHBondContact CB-O 3.37Å; M124-R128 PolarHBondContact N-O 3.45Å; M124-A130 HydrophobicContact CG-CB 4.47Å; M124-A130 HydrophobicContact SD-CB 3.81Å |
| 125 | A | 56.7 | Low | 60.3 | Low | 89 Ų | 89 | 108.6 Ų | 108.6 | 74% | 0.736 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.7 | 141.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||
| 126 | Q | 63.4 | Low | 60.4 | Low | 164 Ų | 164 | 110.7 Ų | 110.7 | 77% | 0.766 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 84.6 | 24.5 | -170.3 | -52.4 | 174.7 | -41.8 | 0 | 0 | 116.8 | R128 | Q126-R128 VanDerWaalsContact C-N 3.27Å; Q126-R128 PolarHBondContact O-N 3.47Å |
| 127 | G | 61.7 | Low | 60.5 | Low | 81 Ų | 81 | 107.2 Ų | 107.2 | 84% | 0.835 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 71.4 | 20.5 | 170 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 128 | R | 65.7 | Low | 60.1 | Low | 148 Ų | 148 | 113.1 Ų | 113.1 | 56% | 0.558 | 61% | 0.606 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -97.9 | 122.5 | 173 | -67.1 | -171.6 | -66.9 | -128.6 | -10.6 | 108.9 | M124 Q126 | M124-R128 WeakPolarHBondContact CB-O 3.37Å; M124-R128 PolarHBondContact N-O 3.45Å; Q126-R128 VanDerWaalsContact C-N 3.27Å; Q126-R128 PolarHBondContact O-N 3.47Å |
| 129 | V | 64.9 | Low | 59.9 | Low | 91 Ų | 91 | 115.4 Ų | 115.4 | 55% | 0.552 | 63% | 0.625 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -95 | 117.1 | 171.2 | 177.4 | 0 | 0 | 0 | 0 | 107.2 | P121 | P121-V129 HydrophobicContact CB-CG1 3.54Å |
| 130 | A | 64.5 | Low | 59.8 | Low | 42 Ų | 42 | 122.9 Ų | 122.9 | 35% | 0.347 | 66% | 0.655 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -102.2 | 133.3 | 169.6 | 0 | 0 | 0 | 0 | 0 | 108.8 | T122 M124 | T122-A130 PolarHBondContact N-O 2.9Å; M124-A130 HydrophobicContact CG-CB 4.47Å; M124-A130 HydrophobicContact SD-CB 3.81Å |
| 131 | H | 62.5 | Low | 59.6 | Low | 122 Ų | 122 | 119.1 Ų | 119.1 | 57% | 0.565 | 65% | 0.649 | S | S | * | * | trans | -89.7 | 114 | 169 | -70.2 | -93.2 | 0 | 0 | 0 | 107.9 | I133 | H131-I133 PolarHBondContact O-N 3.23Š| ||
| 132 | L | 65.7 | Low | 59.6 | Low | 112 Ų | 112 | 120.9 Ų | 120.9 | 59% | 0.586 | 66% | 0.664 | S | S | * | * | trans | -78.5 | 113.1 | 170 | -158.3 | 71.4 | 0 | 0 | 0 | 106.9 | T119 | T119-L132 WeakPolarHBondContact CB-O 3.38Å; T119-L132 HydrophobicContact CG2-CB 4.16Å; T119-L132 VanDerWaalsContact CG2-O 3.23Å; T119-L132 WeakPolarHBondContact CG2-O 3.36Å; T119-L132 PolarHBondContact N-O 3.49Å; T119-L132 WeakPolarHBondContact OG1-CA 3.41Å; T119-L132 WeakPolarHBondContact OG1-CB 3.31Å; T119-L132 PolarHBondContact OG1-N 3.37Å; T119-L132 PolarHBondContact OG1-O 3.18Å | ||
| 133 | I | 63.9 | Low | 59.5 | Low | 107 Ų | 107 | 121.7 Ų | 121.7 | 55% | 0.549 | 67% | 0.665 | S | S | . | * | B | Isolated β-bridge | trans | -92.8 | 111.4 | 166.1 | -60.4 | 174.3 | 0 | 0 | 0 | 104.3 | H131 W135 | H131-I133 PolarHBondContact O-N 3.23Å; I133-W135 VanDerWaalsContact O-CD1 3.32Å; I133-W135 PolarHBondContact O-N 3.36Å |
| 134 | E | 59.8 | Low | 60 | Low | 108 Ų | 108 | 120.8 Ų | 120.8 | 51% | 0.505 | 65% | 0.653 | S | S | . | * | trans | -73.2 | 105 | 170.4 | 39.5 | -175.7 | 137.5 | 0 | 0 | 108 | T119 K136 | T119-E134 HydrophobicContact CG2-CG 3.95Å; T119-E134 WeakPolarHBondContact CG2-OE1 3.37Å; E134-K136 PolarHBondContact O-N 2.93Å | ||
| 135 | W | 54.3 | Low | 60.4 | Low | 204 Ų | 204 | 121.3 Ų | 121.3 | 77% | 0.773 | 66% | 0.664 | S | S | * | * | trans | -73.9 | 78.4 | 174 | -74.5 | 63 | 0 | 0 | 0 | 108.7 | I133 G137 | I133-W135 VanDerWaalsContact O-CD1 3.32Å; I133-W135 PolarHBondContact O-N 3.36Å; W135-G137 VanDerWaalsContact C-N 3.28Å; W135-G137 PolarHBondContact O-N 2.94Å | ||
| 136 | K | 57.3 | Low | 60.7 | Low | 190 Ų | 190 | 120.5 Ų | 120.5 | 83% | 0.826 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.3 | 81.9 | 173.5 | -153.8 | 179.3 | -173.1 | 178.8 | 0 | 108.4 | E134 | E134-K136 PolarHBondContact O-N 2.93Š|
| 137 | G | 59.3 | Low | 60.6 | Low | 65 Ų | 65 | 115 Ų | 115 | 67% | 0.67 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 173 | 10.5 | -177.5 | 0 | 0 | 0 | 0 | 0 | 118.2 | W135 S139 | W135-G137 VanDerWaalsContact C-N 3.28Å; W135-G137 PolarHBondContact O-N 2.94Å; G137-S139 PolarHBondContact O-N 2.85Å |
| 138 | W | 50.6 | Low | 60.7 | Low | 227 Ų | 227 | 114.3 Ų | 114.3 | 86% | 0.86 | 62% | 0.616 | S | S | * | * | trans | -74.3 | 108.2 | 158.9 | -76.7 | 14 | 0 | 0 | 0 | 106.4 | K140 | W138-K140 PolarHBondContact O-N 2.99Å; W138-K140 VanDerWaalsContact O-N 3.12Å | ||
| 139 | S | 53.2 | Low | 60.7 | Low | 111 Ų | 111 | 113.4 Ų | 113.4 | 78% | 0.776 | 62% | 0.619 | S | S | * | * | trans | -47.7 | 122.6 | 174.8 | 39.3 | 0 | 0 | 0 | 0 | 108 | G137 | G137-S139 PolarHBondContact O-N 2.85Š| ||
| 140 | K | 56.2 | Low | 60.8 | Low | 185 Ų | 185 | 112.8 Ų | 112.8 | 80% | 0.804 | 62% | 0.618 | S | S | * | * | trans | -54.3 | 136.3 | 159.9 | -79.9 | 174 | 175.5 | 173.2 | 0 | 106.2 | W138 S142 | W138-K140 PolarHBondContact O-N 2.99Å; W138-K140 VanDerWaalsContact O-N 3.12Å; K140-S142 PolarHBondContact O-N 2.96Å | ||
| 141 | P | 56.3 | Low | 60.8 | Low | 105 Ų | 105 | 113 Ų | 113 | 68% | 0.682 | 62% | 0.621 | S | S | * | * | trans | -48.9 | 111.3 | 167 | -22.7 | 31.7 | 0 | 0 | 0 | 107 | D143 | P141-D143 PolarHBondContact O-N 3.44Å; P141-D143 VanDerWaalsContact O-N 3.15Å | ||
| 142 | S | 57.5 | Low | 61 | Low | 120 Ų | 120 | 113.7 Ų | 113.7 | 84% | 0.839 | 62% | 0.622 | S | S | * | * | trans | -82.8 | 21.5 | -175.1 | -174.3 | 0 | 0 | 0 | 0 | 110.7 | K140 | K140-S142 PolarHBondContact O-N 2.96Š| ||
| 143 | D | 59.1 | Low | 61.2 | Low | 99 Ų | 99 | 111.7 Ų | 111.7 | 53% | 0.529 | 62% | 0.617 | S | S | . | * | trans | -85.5 | 123.4 | 177.7 | -61 | -40.9 | 0 | 0 | 0 | 107.6 | P141 L148 | P141-D143 PolarHBondContact O-N 3.44Å; P141-D143 VanDerWaalsContact O-N 3.15Å; D143-L148 HydrophobicContact CB-CD1 4.26Å; D143-L148 HydrophobicContact CB-CG 4.08Å | ||
| 144 | S | 72 | Confident | 61.4 | Low | 68 Ų | 68 | 110.5 Ų | 110.5 | 48% | 0.476 | 62% | 0.618 | S | S | . | * | trans | -53.8 | 143.8 | 171 | 72.7 | 0 | 0 | 0 | 0 | 109 | A146 A147 L148 | S144-A146 PolarHBondContact O-N 3.19Å; S144-A147 WeakPolarHBondContact O-CB 3.23Å; S144-A147 PolarHBondContact O-N 2.92Å; S144-A147 PolarHBondContact OG-N 3.19Å; S144-L148 PolarHBondContact O-N 3.32Å | ||
| 145 | P | 63.4 | Low | 61.7 | Low | 110 Ų | 110 | 111 Ų | 111 | 71% | 0.714 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -54.7 | -30.1 | -178.2 | 19.3 | -31.1 | 0 | 0 | 0 | 112.5 | L148 E149 | P145-L148 PolarHBondContact O-N 3.06Å; P145-E149 VanDerWaalsContact O-CG 3.23Å; P145-E149 WeakPolarHBondContact O-CG 3.36Å; P145-E149 PolarHBondContact O-N 2.57Å |
| 146 | A | 63.6 | Low | 62.9 | Low | 72 Ų | 72 | 105.4 Ų | 105.4 | 60% | 0.595 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -68.6 | -32.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | S144 S150 | S144-A146 PolarHBondContact O-N 3.19Å; A146-S150 WeakPolarHBondContact O-CB 3.22Å; A146-S150 PolarHBondContact O-N 3.48Å |
| 147 | A | 61.9 | Low | 64.3 | Low | 47 Ų | 47 | 103.9 Ų | 103.9 | 39% | 0.388 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -72.3 | -36.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | S144 S150 A151 | S144-A147 WeakPolarHBondContact O-CB 3.23Å; S144-A147 PolarHBondContact O-N 2.92Å; S144-A147 PolarHBondContact OG-N 3.19Å; A147-S150 PolarHBondContact O-N 3.22Å; A147-A151 PolarHBondContact O-N 3.31Å |
| 148 | L | 63.8 | Low | 65.6 | Low | 67 Ų | 67 | 102.6 Ų | 102.6 | 35% | 0.351 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -64 | -48.6 | 171.8 | -88.9 | 161.3 | 0 | 0 | 0 | 111.3 | D143 S144 P145 S150 A151 F152 | D143-L148 HydrophobicContact CB-CD1 4.26Å; D143-L148 HydrophobicContact CB-CG 4.08Å; S144-L148 PolarHBondContact O-N 3.32Å; P145-L148 PolarHBondContact O-N 3.06Å; L148-S150 VanDerWaalsContact C-N 3.27Å; L148-S150 PolarHBondContact O-N 3.37Å; L148-A151 WeakPolarHBondContact O-CB 3.36Å; L148-A151 PolarHBondContact O-N 2.9Å; L148-F152 HydrophobicContact CB-CD2 4.42Å; L148-F152 HydrophobicContact CB-CE2 4.16Å; L148-F152 HydrophobicContact CD2-CE2 3.78Å; L148-F152 HydrophobicContact CD2-CZ 4.35Å; L148-F152 WeakPolarHBondContact O-CD2 3.37Å; L148-F152 PolarHBondContact O-N 3.4Å |
| 149 | E | 65.4 | Low | 67.5 | Low | 129 Ų | 129 | 94.8 Ų | 94.8 | 60% | 0.603 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -58.1 | -38.4 | 176.6 | -70.7 | -73.6 | 152.9 | 0 | 0 | 112.4 | P145 F152 S153 | P145-E149 VanDerWaalsContact O-CG 3.23Å; P145-E149 WeakPolarHBondContact O-CG 3.36Å; P145-E149 PolarHBondContact O-N 2.57Å; E149-F152 PolarHBondContact O-N 3.35Å; E149-S153 VanDerWaalsContact O-CB 3.3Å; E149-S153 WeakPolarHBondContact O-CB 3.39Å; E149-S153 PolarHBondContact O-N 3.41Å; E149-S153 PolarHBondContact O-OG 3.48Å |
| 150 | S | 66.8 | Low | 69.3 | Low | 78 Ų | 78 | 97.5 Ų | 97.5 | 55% | 0.545 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -66.9 | -38.5 | 174 | -171.5 | 0 | 0 | 0 | 0 | 112.3 | A146 A147 L148 S154 | A146-S150 WeakPolarHBondContact O-CB 3.22Å; A146-S150 PolarHBondContact O-N 3.48Å; A147-S150 PolarHBondContact O-N 3.22Å; L148-S150 VanDerWaalsContact C-N 3.27Å; L148-S150 PolarHBondContact O-N 3.37Å; S150-S154 WeakPolarHBondContact O-CB 3.42Å; S150-S154 PolarHBondContact O-N 3.26Å |
| 151 | A | 64.3 | Low | 71 | Confident | 48 Ų | 48 | 91.1 Ų | 91.1 | 40% | 0.397 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -66.4 | -42.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | A147 L148 S154 Y155 | A147-A151 PolarHBondContact O-N 3.31Å; L148-A151 WeakPolarHBondContact O-CB 3.36Å; L148-A151 PolarHBondContact O-N 2.9Å; A151-S154 PolarHBondContact O-N 2.91Å; A151-Y155 WeakPolarHBondContact O-CD2 3.3Å; A151-Y155 WeakPolarHBondContact O-CE2 3.34Å |
| 152 | F | 65.8 | Low | 72.7 | Confident | 136 Ų | 136 | 90.3 Ų | 90.3 | 60% | 0.596 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -65.6 | -40.1 | 175.5 | -71.6 | -67.5 | 0 | 0 | 0 | 112.6 | L148 E149 S154 Y155 S156 | L148-F152 HydrophobicContact CB-CD2 4.42Å; L148-F152 HydrophobicContact CB-CE2 4.16Å; L148-F152 HydrophobicContact CD2-CE2 3.78Å; L148-F152 HydrophobicContact CD2-CZ 4.35Å; L148-F152 WeakPolarHBondContact O-CD2 3.37Å; L148-F152 PolarHBondContact O-N 3.4Å; E149-F152 PolarHBondContact O-N 3.35Å; F152-S154 VanDerWaalsContact C-N 3.31Å; F152-S154 PolarHBondContact O-N 3.13Å; F152-Y155 PolarHBondContact O-N 2.93Å; F152-S156 PolarHBondContact O-OG 2.97Å |
| 153 | S | 71.2 | Confident | 74.4 | Confident | 69 Ų | 69 | 88.3 Ų | 88.3 | 48% | 0.483 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -66.8 | -33.5 | 176.1 | -62.7 | 0 | 0 | 0 | 0 | 112 | E149 Y155 S156 | E149-S153 VanDerWaalsContact O-CB 3.3Å; E149-S153 WeakPolarHBondContact O-CB 3.39Å; E149-S153 PolarHBondContact O-N 3.41Å; E149-S153 PolarHBondContact O-OG 3.48Å; S153-Y155 PolarHBondContact O-N 2.88Å; S153-Y155 VanDerWaalsContact O-N 3.14Å; S153-S156 WeakPolarHBondContact O-CB 3.46Å; S153-S156 PolarHBondContact O-N 3.46Å; S153-S156 PolarHBondContact O-OG 2.9Å |
| 154 | S | 68.3 | Low | 76.1 | Confident | 82 Ų | 82 | 89.2 Ų | 89.2 | 57% | 0.573 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66 | -16.2 | -178.8 | -161.4 | 0 | 0 | 0 | 0 | 114.4 | S150 A151 F152 | S150-S154 WeakPolarHBondContact O-CB 3.42Å; S150-S154 PolarHBondContact O-N 3.26Å; A151-S154 PolarHBondContact O-N 2.91Å; F152-S154 VanDerWaalsContact C-N 3.31Å; F152-S154 PolarHBondContact O-N 3.13Å |
| 155 | Y | 66.2 | Low | 77.2 | Confident | 120 Ų | 120 | 88.9 Ų | 88.9 | 47% | 0.471 | 52% | 0.522 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.2 | -10.7 | 173.5 | -66.4 | -82.6 | 0 | 0 | 0 | 113.2 | A151 F152 S153 D157 L158 Q163 | A151-Y155 WeakPolarHBondContact O-CD2 3.3Å; A151-Y155 WeakPolarHBondContact O-CE2 3.34Å; F152-Y155 PolarHBondContact O-N 2.93Å; S153-Y155 PolarHBondContact O-N 2.88Å; S153-Y155 VanDerWaalsContact O-N 3.14Å; Y155-D157 VanDerWaalsContact C-N 3.29Å; Y155-D157 PolarHBondContact O-N 3.3Å; Y155-L158 HydrophobicContact CD1-CD1 3.73Å; Y155-L158 HydrophobicContact CE1-CD1 4.45Å; Y155-L158 WeakPolarHBondContact O-CB 3.26Å; Y155-L158 PolarHBondContact O-N 3.01Å; Y155-Q163 PolarHBondContact O-NE2 3.34Å |
| 156 | S | 79.1 | Confident | 78.7 | Confident | 86 Ų | 86 | 89.3 Ų | 89.3 | 60% | 0.601 | 51% | 0.509 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.7 | -25.3 | -172.8 | -63.5 | 0 | 0 | 0 | 0 | 113.4 | F152 S153 L158 | F152-S156 PolarHBondContact O-OG 2.97Å; S153-S156 WeakPolarHBondContact O-CB 3.46Å; S153-S156 PolarHBondContact O-N 3.46Å; S153-S156 PolarHBondContact O-OG 2.9Å; S156-L158 VanDerWaalsContact C-N 3.31Å |
| 157 | D | 85.4 | Confident | 80.2 | Confident | 157 Ų | 157 | 92.4 Ų | 92.4 | 84% | 0.84 | 51% | 0.509 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81 | -11.2 | 177.1 | -61.4 | -32.4 | 0 | 0 | 0 | 113.2 | Y155 | Y155-D157 VanDerWaalsContact C-N 3.29Å; Y155-D157 PolarHBondContact O-N 3.3Å |
| 158 | L | 88.3 | Confident | 81.8 | Confident | 38 Ų | 38 | 92.6 Ų | 92.6 | 20% | 0.199 | 51% | 0.51 | C | S | . | . | S | Bend | trans | -86.1 | 144.7 | -179.2 | -60.5 | 171.7 | 0 | 0 | 0 | 110.7 | Y155 S156 E162 Q163 | Y155-L158 HydrophobicContact CD1-CD1 3.73Å; Y155-L158 HydrophobicContact CE1-CD1 4.45Å; Y155-L158 WeakPolarHBondContact O-CB 3.26Å; Y155-L158 PolarHBondContact O-N 3.01Å; S156-L158 VanDerWaalsContact C-N 3.31Å; L158-E162 HydrophobicContact CB-CB 4.24Å; L158-Q163 HydrophobicContact CB-CG 3.98Å; L158-Q163 PolarHBondContact O-NE2 3.11Å |
| 159 | S | 90.7 | Very high | 83.3 | Confident | 64 Ų | 64 | 92.2 Ų | 92.2 | 45% | 0.448 | 52% | 0.517 | S | S | . | . | trans | -67 | 154.3 | 173 | 64.9 | 0 | 0 | 0 | 0 | 111.5 | G161 E162 Q163 | S159-G161 PolarHBondContact O-N 3.13Å; S159-G161 VanDerWaalsContact O-N 3.15Å; S159-E162 PolarHBondContact N-OE2 3.41Å; S159-E162 WeakPolarHBondContact O-CA 3.48Å; S159-E162 WeakPolarHBondContact O-CB 3.37Å; S159-E162 PolarHBondContact O-N 2.97Å; S159-E162 VanDerWaalsContact OG-CD 3.32Å; S159-E162 VanDerWaalsContact OG-CG 3.29Å; S159-E162 WeakPolarHBondContact OG-CG 3.47Å; S159-E162 PolarHBondContact OG-OE2 3.16Å; S159-Q163 PolarHBondContact O-N 3.34Å | ||
| 160 | E | 89.1 | Confident | 84.7 | Confident | 167 Ų | 167 | 87.5 Ų | 87.5 | 78% | 0.78 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -51 | -40.7 | 178.1 | -176.4 | -172.2 | -178.2 | 0 | 0 | 112.2 | E162 Q163 E164 | E160-E162 VanDerWaalsContact C-N 3.32Å; E160-E162 PolarHBondContact O-N 2.9Å; E160-Q163 PolarHBondContact O-N 3.43Å; E160-E164 WeakPolarHBondContact O-CB 3.25Å; E160-E164 PolarHBondContact O-N 3.46Å |
| 161 | G | 93.2 | Very high | 86.2 | Confident | 52 Ų | 52 | 87.4 Ų | 87.4 | 54% | 0.536 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66.2 | -32.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | S159 A165 | S159-G161 PolarHBondContact O-N 3.13Å; S159-G161 VanDerWaalsContact O-N 3.15Å; G161-A165 WeakPolarHBondContact O-CB 3.26Å; G161-A165 PolarHBondContact O-N 3.39Å |
| 162 | E | 92.6 | Very high | 87.7 | Confident | 87 Ų | 87 | 88 Ų | 88 | 41% | 0.407 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -78.5 | -32.3 | 176.3 | -73.4 | 172.3 | 135.4 | 0 | 0 | 112.6 | L158 S159 E160 R166 | L158-E162 HydrophobicContact CB-CB 4.24Å; S159-E162 PolarHBondContact N-OE2 3.41Å; S159-E162 WeakPolarHBondContact O-CA 3.48Å; S159-E162 WeakPolarHBondContact O-CB 3.37Å; S159-E162 PolarHBondContact O-N 2.97Å; S159-E162 VanDerWaalsContact OG-CD 3.32Å; S159-E162 VanDerWaalsContact OG-CG 3.29Å; S159-E162 WeakPolarHBondContact OG-CG 3.47Å; S159-E162 PolarHBondContact OG-OE2 3.16Å; E160-E162 VanDerWaalsContact C-N 3.32Å; E160-E162 PolarHBondContact O-N 2.9Å; E162-R166 VanDerWaalsContact O-CG 3.32Å; E162-R166 WeakPolarHBondContact O-CG 3.36Å; E162-R166 PolarHBondContact O-N 3.01Å; E162-R166 PolarHBondContact O-NH1 2.75Å |
| 163 | Q | 92.9 | Very high | 89.1 | Confident | 79 Ų | 79 | 87.3 Ų | 87.3 | 37% | 0.369 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -66.9 | -46.6 | 171.3 | -66.9 | 177.6 | 1.1 | 0 | 0 | 110.3 | Y155 L158 S159 E160 A165 R166 F167 | Y155-Q163 PolarHBondContact O-NE2 3.34Å; L158-Q163 HydrophobicContact CB-CG 3.98Å; L158-Q163 PolarHBondContact O-NE2 3.11Å; S159-Q163 PolarHBondContact O-N 3.34Å; E160-Q163 PolarHBondContact O-N 3.43Å; Q163-A165 PolarHBondContact O-N 3.43Å; Q163-R166 PolarHBondContact O-N 2.94Å; Q163-F167 PolarHBondContact O-N 2.71Å |
| 164 | E | 94.6 | Very high | 90.3 | Very high | 118 Ų | 118 | 89.8 Ų | 89.8 | 55% | 0.551 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63.1 | -41 | 178.4 | -175.7 | 61 | -157.5 | 0 | 0 | 111.8 | E160 R166 F167 A168 | E160-E164 WeakPolarHBondContact O-CB 3.25Å; E160-E164 PolarHBondContact O-N 3.46Å; E164-R166 VanDerWaalsContact C-N 3.32Å; E164-R166 PolarHBondContact O-N 3.3Å; E164-F167 PolarHBondContact O-N 3.1Å; E164-A168 WeakPolarHBondContact O-CB 3.41Å; E164-A168 PolarHBondContact O-N 2.87Å |
| 165 | A | 95.1 | Very high | 91.6 | Very high | 61 Ų | 61 | 92.8 Ų | 92.8 | 50% | 0.504 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.6 | -40.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | G161 Q163 A169 | G161-A165 WeakPolarHBondContact O-CB 3.26Å; G161-A165 PolarHBondContact O-N 3.39Å; Q163-A165 PolarHBondContact O-N 3.43Å; A165-A169 VanDerWaalsContact O-CB 3.31Å; A165-A169 WeakPolarHBondContact O-CB 3.31Å; A165-A169 PolarHBondContact O-N 3.39Å |
| 166 | R | 94.3 | Very high | 93 | Very high | 119 Ų | 119 | 89.6 Ų | 89.6 | 45% | 0.449 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -68.8 | -39.8 | 176.5 | -75.2 | -179.6 | 174.5 | 85.2 | -8.3 | 112 | E162 Q163 E164 A169 G170 | E162-R166 VanDerWaalsContact O-CG 3.32Å; E162-R166 WeakPolarHBondContact O-CG 3.36Å; E162-R166 PolarHBondContact O-N 3.01Å; E162-R166 PolarHBondContact O-NH1 2.75Å; Q163-R166 PolarHBondContact O-N 2.94Å; E164-R166 VanDerWaalsContact C-N 3.32Å; E164-R166 PolarHBondContact O-N 3.3Å; R166-A169 PolarHBondContact O-N 3.36Å; R166-G170 PolarHBondContact O-N 3.42Å |
| 167 | F | 94.4 | Very high | 93.6 | Very high | 137 Ų | 137 | 89.7 Ų | 89.7 | 60% | 0.601 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -60.9 | -50.7 | 173.4 | 174.5 | -102.1 | 0 | 0 | 0 | 111.2 | Q163 E164 A169 G170 V171 | Q163-F167 PolarHBondContact O-N 2.71Å; E164-F167 PolarHBondContact O-N 3.1Å; F167-A169 VanDerWaalsContact C-N 3.3Å; F167-A169 PolarHBondContact O-N 3.07Å; F167-G170 PolarHBondContact O-N 3.44Å; F167-V171 HydrophobicContact CD1-CG2 4.32Å; F167-V171 HydrophobicContact CD2-CG2 4.37Å; F167-V171 HydrophobicContact CE1-CG2 3.87Å; F167-V171 HydrophobicContact CE2-CG2 3.92Å; F167-V171 HydrophobicContact CZ-CG2 3.65Å; F167-V171 WeakPolarHBondContact O-CG2 3.42Å; F167-V171 PolarHBondContact O-N 3.26Å |
| 168 | A | 96.6 | Very high | 94.1 | Very high | 50 Ų | 50 | 84.4 Ų | 84.4 | 41% | 0.413 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -59.9 | -39.9 | 178 | 0 | 0 | 0 | 0 | 0 | 112.2 | E164 V171 A172 | E164-A168 WeakPolarHBondContact O-CB 3.41Å; E164-A168 PolarHBondContact O-N 2.87Å; A168-V171 PolarHBondContact O-N 3.48Å; A168-A172 WeakPolarHBondContact O-CB 3.48Å; A168-A172 PolarHBondContact O-N 3.4Å |
| 169 | A | 94.9 | Very high | 94.4 | Very high | 60 Ų | 60 | 85.7 Ų | 85.7 | 50% | 0.496 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.7 | -46.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | A165 R166 F167 V171 A172 E173 | A165-A169 VanDerWaalsContact O-CB 3.31Å; A165-A169 WeakPolarHBondContact O-CB 3.31Å; A165-A169 PolarHBondContact O-N 3.39Å; R166-A169 PolarHBondContact O-N 3.36Å; F167-A169 VanDerWaalsContact C-N 3.3Å; F167-A169 PolarHBondContact O-N 3.07Å; A169-V171 PolarHBondContact O-N 2.89Å; A169-A172 PolarHBondContact O-N 3.21Å; A169-E173 PolarHBondContact O-N 3.3Å |
| 170 | G | 95.9 | Very high | 94.5 | Very high | 30 Ų | 30 | 85.5 Ų | 85.5 | 31% | 0.309 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62.7 | -40.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | R166 F167 A172 E173 Q174 | R166-G170 PolarHBondContact O-N 3.42Å; F167-G170 PolarHBondContact O-N 3.44Å; G170-A172 PolarHBondContact O-N 3.17Å; G170-E173 PolarHBondContact O-N 2.89Å; G170-Q174 WeakPolarHBondContact O-CG 3.39Å; G170-Q174 PolarHBondContact O-N 3.43Å |
| 171 | V | 97.1 | Very high | 94.7 | Very high | 75 Ų | 75 | 83.7 Ų | 83.7 | 46% | 0.455 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62.9 | -42.3 | 174.4 | 172.2 | 0 | 0 | 0 | 0 | 111.3 | F167 A168 A169 E173 Q174 F175 | F167-V171 HydrophobicContact CD1-CG2 4.32Å; F167-V171 HydrophobicContact CD2-CG2 4.37Å; F167-V171 HydrophobicContact CE1-CG2 3.87Å; F167-V171 HydrophobicContact CE2-CG2 3.92Å; F167-V171 HydrophobicContact CZ-CG2 3.65Å; F167-V171 WeakPolarHBondContact O-CG2 3.42Å; F167-V171 PolarHBondContact O-N 3.26Å; A168-V171 PolarHBondContact O-N 3.48Å; A169-V171 PolarHBondContact O-N 2.89Å; V171-E173 VanDerWaalsContact C-N 3.35Å; V171-Q174 PolarHBondContact O-N 3.34Å; V171-F175 PolarHBondContact O-N 2.96Å |
| 172 | A | 95.9 | Very high | 94.4 | Very high | 60 Ų | 60 | 87.2 Ų | 87.2 | 50% | 0.496 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64.1 | -39.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | A168 A169 G170 F175 A176 | A168-A172 WeakPolarHBondContact O-CB 3.48Å; A168-A172 PolarHBondContact O-N 3.4Å; A169-A172 PolarHBondContact O-N 3.21Å; G170-A172 PolarHBondContact O-N 3.17Å; A172-F175 PolarHBondContact O-N 3.17Å; A172-A176 PolarHBondContact O-N 3.27Å |
| 173 | E | 95 | Very high | 94 | Very high | 122 Ų | 122 | 90 Ų | 90 | 57% | 0.57 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -61.5 | -47.5 | 174.9 | -175 | -177.2 | 177.2 | 0 | 0 | 111.4 | A169 G170 V171 F175 A176 I177 | A169-E173 PolarHBondContact O-N 3.3Å; G170-E173 PolarHBondContact O-N 2.89Å; V171-E173 VanDerWaalsContact C-N 3.35Å; E173-F175 VanDerWaalsContact C-N 3.27Å; E173-F175 PolarHBondContact O-N 2.89Å; E173-A176 PolarHBondContact O-N 2.96Å; E173-A176 VanDerWaalsContact O-N 3.13Å; E173-I177 HydrophobicContact CG-CD1 4.09Å; E173-I177 WeakPolarHBondContact O-CG1 3.38Å; E173-I177 PolarHBondContact O-N 3.05Å |
| 174 | Q | 97.4 | Very high | 93.5 | Very high | 121 Ų | 121 | 89.4 Ų | 89.4 | 57% | 0.565 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -60.8 | -38.2 | 176.6 | -67.4 | -56 | -54.2 | 0 | 0 | 112 | G170 V171 I177 A178 | G170-Q174 WeakPolarHBondContact O-CG 3.39Å; G170-Q174 PolarHBondContact O-N 3.43Å; V171-Q174 PolarHBondContact O-N 3.34Å; Q174-I177 PolarHBondContact O-N 3.24Å; Q174-A178 WeakPolarHBondContact O-CB 3.4Å; Q174-A178 PolarHBondContact O-N 3.01Å |
| 175 | F | 95.9 | Very high | 93 | Very high | 146 Ų | 146 | 92.9 Ų | 92.9 | 64% | 0.64 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -64.3 | -43.4 | 174.6 | -170.6 | -94.1 | 0 | 0 | 0 | 111.9 | V171 A172 E173 A178 E179 | V171-F175 PolarHBondContact O-N 2.96Å; A172-F175 PolarHBondContact O-N 3.17Å; E173-F175 VanDerWaalsContact C-N 3.27Å; E173-F175 PolarHBondContact O-N 2.89Å; F175-A178 PolarHBondContact O-N 3.25Å; F175-E179 WeakPolarHBondContact O-CB 3.47Å; F175-E179 PolarHBondContact O-N 3.21Å |
| 176 | A | 95.4 | Very high | 91.5 | Very high | 52 Ų | 52 | 94.3 Ų | 94.3 | 43% | 0.43 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.1 | -42.2 | 177 | 0 | 0 | 0 | 0 | 0 | 112.2 | A172 E173 E179 A180 | A172-A176 PolarHBondContact O-N 3.27Å; E173-A176 PolarHBondContact O-N 2.96Å; E173-A176 VanDerWaalsContact O-N 3.13Å; A176-E179 PolarHBondContact O-N 3.42Å; A176-A180 WeakPolarHBondContact O-CB 3.37Å; A176-A180 PolarHBondContact O-N 2.85Å |
| 177 | I | 91.8 | Very high | 89.8 | Confident | 88 Ų | 88 | 93.4 Ų | 93.4 | 45% | 0.451 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62 | -47.7 | 175.4 | -67.3 | 167.3 | 0 | 0 | 0 | 110.4 | E173 Q174 E179 A180 K181 | E173-I177 HydrophobicContact CG-CD1 4.09Å; E173-I177 WeakPolarHBondContact O-CG1 3.38Å; E173-I177 PolarHBondContact O-N 3.05Å; Q174-I177 PolarHBondContact O-N 3.24Å; I177-E179 VanDerWaalsContact C-N 3.34Å; I177-E179 PolarHBondContact O-N 3.47Å; I177-A180 PolarHBondContact O-N 3.27Å; I177-K181 VanDerWaalsContact O-CB 3.3Å; I177-K181 WeakPolarHBondContact O-CB 3.27Å; I177-K181 PolarHBondContact O-N 3.23Å |
| 178 | A | 95.4 | Very high | 88.1 | Confident | 46 Ų | 46 | 93.1 Ų | 93.1 | 38% | 0.38 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62 | -42 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q174 F175 K181 L182 | Q174-A178 WeakPolarHBondContact O-CB 3.4Å; Q174-A178 PolarHBondContact O-N 3.01Å; F175-A178 PolarHBondContact O-N 3.25Å; A178-K181 PolarHBondContact O-N 3.24Å; A178-L182 WeakPolarHBondContact O-CG 3.32Å; A178-L182 PolarHBondContact O-N 3.34Å |
| 179 | E | 93.6 | Very high | 86.2 | Confident | 65 Ų | 65 | 98.2 Ų | 98.2 | 30% | 0.304 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -64.8 | -45.5 | 177.8 | -164.7 | -169.4 | -174.8 | 0 | 0 | 111.7 | F175 A176 I177 K181 L182 R183 | F175-E179 WeakPolarHBondContact O-CB 3.47Å; F175-E179 PolarHBondContact O-N 3.21Å; A176-E179 PolarHBondContact O-N 3.42Å; I177-E179 VanDerWaalsContact C-N 3.34Å; I177-E179 PolarHBondContact O-N 3.47Å; E179-K181 VanDerWaalsContact C-N 3.3Å; E179-K181 PolarHBondContact O-N 3.26Å; E179-L182 PolarHBondContact O-N 2.97Å; E179-R183 VanDerWaalsContact CG-NH1 3.33Å; E179-R183 WeakPolarHBondContact O-CG 3.28Å; E179-R183 PolarHBondContact O-N 3.05Å; E179-R183 IonicContact OE1-CZ 3.12Å; E179-R183 IonicContact OE1-NH1 2.75Å; E179-R183 PolarHBondContact OE1-NH1 3.34Å; E179-R183 IonicContact OE1-NH2 2.71Å; E179-R183 PolarHBondContact OE1-NH2 3.45Å; E179-R183 IonicContact OE2-NH1 3.42Å; E179-R183 PolarHBondContact OE2-NH1 3.09Å |
| 180 | A | 92.7 | Very high | 84.5 | Confident | 60 Ų | 60 | 99 Ų | 99 | 50% | 0.496 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -60.5 | -41.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | A176 I177 R183 A184 | A176-A180 WeakPolarHBondContact O-CB 3.37Å; A176-A180 PolarHBondContact O-N 2.85Å; I177-A180 PolarHBondContact O-N 3.27Å; A180-R183 PolarHBondContact O-N 3.09Å; A180-A184 PolarHBondContact O-N 3.32Å |
| 181 | K | 94.1 | Very high | 82.5 | Confident | 129 Ų | 129 | 106.2 Ų | 106.2 | 56% | 0.561 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -62.6 | -46.7 | 176.2 | -171.5 | 173.2 | -179.4 | 174.7 | 0 | 111.5 | I177 A178 E179 R183 A184 W185 | I177-K181 VanDerWaalsContact O-CB 3.3Å; I177-K181 WeakPolarHBondContact O-CB 3.27Å; I177-K181 PolarHBondContact O-N 3.23Å; A178-K181 PolarHBondContact O-N 3.24Å; E179-K181 VanDerWaalsContact C-N 3.3Å; E179-K181 PolarHBondContact O-N 3.26Å; K181-R183 PolarHBondContact O-N 2.96Å; K181-A184 PolarHBondContact O-N 3.4Å; K181-W185 PolarHBondContact O-N 2.89Å |
| 182 | L | 86.4 | Confident | 80.3 | Confident | 126 Ų | 126 | 109.9 Ų | 109.9 | 66% | 0.66 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -65 | -37.2 | 177 | -71.2 | 173.5 | 0 | 0 | 0 | 112.3 | A178 E179 W185 S186 | A178-L182 WeakPolarHBondContact O-CG 3.32Å; A178-L182 PolarHBondContact O-N 3.34Å; E179-L182 PolarHBondContact O-N 2.97Å; L182-W185 PolarHBondContact O-N 2.78Å; L182-S186 PolarHBondContact O-N 3.24Å |
| 183 | R | 84.3 | Confident | 78.3 | Confident | 145 Ų | 145 | 112.3 Ų | 112.3 | 55% | 0.547 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -63.6 | -41.6 | 173.3 | -78.8 | -162 | 175.5 | 91.6 | 13.3 | 112.8 | E179 A180 K181 W185 S186 S187 | E179-R183 VanDerWaalsContact CG-NH1 3.33Å; E179-R183 WeakPolarHBondContact O-CG 3.28Å; E179-R183 PolarHBondContact O-N 3.05Å; E179-R183 IonicContact OE1-CZ 3.12Å; E179-R183 IonicContact OE1-NH1 2.75Å; E179-R183 PolarHBondContact OE1-NH1 3.34Å; E179-R183 IonicContact OE1-NH2 2.71Å; E179-R183 PolarHBondContact OE1-NH2 3.45Å; E179-R183 IonicContact OE2-NH1 3.42Å; E179-R183 PolarHBondContact OE2-NH1 3.09Å; A180-R183 PolarHBondContact O-N 3.09Å; K181-R183 PolarHBondContact O-N 2.96Å; R183-W185 PolarHBondContact O-N 3.32Å; R183-S186 PolarHBondContact O-N 3Å; R183-S186 PolarHBondContact O-OG 2.91Å; R183-S187 WeakPolarHBondContact O-CB 3.33Å; R183-S187 PolarHBondContact O-N 3.14Å; R183-S187 VanDerWaalsContact O-N 3.09Å |
| 184 | A | 83.1 | Confident | 76.1 | Confident | 67 Ų | 67 | 111.9 Ų | 111.9 | 55% | 0.554 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -62.3 | -32.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | A180 K181 | A180-A184 PolarHBondContact O-N 3.32Å; K181-A184 PolarHBondContact O-N 3.4Å |
| 185 | W | 84.3 | Confident | 73.9 | Confident | 192 Ų | 192 | 112.3 Ų | 112.3 | 73% | 0.727 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -79.6 | -28.9 | 178.7 | -70.3 | 39.9 | 0 | 0 | 0 | 112.3 | K181 L182 R183 | K181-W185 PolarHBondContact O-N 2.89Å; L182-W185 PolarHBondContact O-N 2.78Å; R183-W185 PolarHBondContact O-N 3.32Å |
| 186 | S | 63.3 | Low | 71.9 | Confident | 91 Ų | 91 | 112 Ų | 112 | 64% | 0.636 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -83 | -15.6 | 176.6 | 78.6 | 0 | 0 | 0 | 0 | 114.1 | L182 R183 V188 | L182-S186 PolarHBondContact O-N 3.24Å; R183-S186 PolarHBondContact O-N 3Å; R183-S186 PolarHBondContact O-OG 2.91Å; S186-V188 VanDerWaalsContact C-N 3.33Å; S186-V188 PolarHBondContact O-N 2.86Å |
| 187 | S | 58.9 | Low | 70.1 | Confident | 99 Ų | 99 | 113.6 Ų | 113.6 | 69% | 0.692 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.7 | -2.2 | -173.5 | -168 | 0 | 0 | 0 | 0 | 114.8 | R183 | R183-S187 WeakPolarHBondContact O-CB 3.33Å; R183-S187 PolarHBondContact O-N 3.14Å; R183-S187 VanDerWaalsContact O-N 3.09Å |
| 188 | V | 57.7 | Low | 68 | Low | 132 Ų | 132 | 118.6 Ų | 118.6 | 80% | 0.8 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.4 | 9.6 | -171.7 | 88.1 | 0 | 0 | 0 | 0 | 114.8 | S186 | S186-V188 VanDerWaalsContact C-N 3.33Å; S186-V188 PolarHBondContact O-N 2.86Å |
| 189 | D | 58.2 | Low | 65.8 | Low | 157 Ų | 157 | 124 Ų | 124 | 84% | 0.84 | 69% | 0.685 | S | S | * | * | S | Bend | trans | -129.4 | 40.1 | -172.3 | -160.4 | 29.2 | 0 | 0 | 0 | 114.1 | ||
| 190 | G | 58.5 | Low | 64.1 | Low | 75 Ų | 75 | 127.2 Ų | 127.2 | 77% | 0.773 | 70% | 0.7 | S | S | * | * | trans | -160.9 | 27.1 | -171.9 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 191 | E | 53.4 | Low | 62.2 | Low | 182 Ų | 182 | 131.7 Ų | 131.7 | 85% | 0.85 | 72% | 0.715 | S | S | * | * | trans | -126.9 | 57 | 175.7 | 63 | 178.9 | -162.5 | 0 | 0 | 114.3 | ||||
| 192 | D | 51.7 | Low | 59.7 | Low | 153 Ų | 153 | 134.5 Ų | 134.5 | 82% | 0.818 | 73% | 0.728 | S | S | * | * | trans | -113.3 | 67.9 | 158.7 | -73.1 | -21.1 | 0 | 0 | 0 | 108.6 | ||||
| 193 | S | 54.2 | Low | 57.9 | Low | 111 Ų | 111 | 132.7 Ų | 132.7 | 78% | 0.776 | 73% | 0.731 | S | S | * | * | trans | -103.6 | 95.8 | 162.9 | 63.8 | 0 | 0 | 0 | 0 | 108.7 | D195 | S193-D195 PolarHBondContact O-N 3.29Š| ||
| 194 | T | 48.6 | Very low | 55.5 | Low | 113 Ų | 113 | 129.7 Ų | 129.7 | 69% | 0.693 | 75% | 0.746 | S | S | * | * | trans | -53.3 | 100.1 | 164.3 | -58.1 | 0 | 0 | 0 | 0 | 109.4 | D196 | T194-D196 VanDerWaalsContact C-N 3.32Å; T194-D196 HydrophobicContact CG2-CB 4.46Å; T194-D196 WeakPolarHBondContact CG2-OD2 3.42Å; T194-D196 PolarHBondContact O-N 3.25Å | ||
| 195 | D | 50.9 | Low | 53.3 | Low | 129 Ų | 129 | 130 Ų | 130 | 69% | 0.69 | 76% | 0.755 | S | S | * | * | trans | -80.1 | 82.3 | 166.4 | -178.3 | 15.4 | 0 | 0 | 0 | 108.3 | S193 S197 | S193-D195 PolarHBondContact O-N 3.29Å; D195-S197 PolarHBondContact O-N 3Å; D195-S197 WeakPolarHBondContact OD1-CB 3.48Å; D195-S197 PolarHBondContact OD1-N 3.15Å; D195-S197 PolarHBondContact OD1-OG 2.93Å | ||
| 196 | D | 53.1 | Low | 51.2 | Low | 139 Ų | 139 | 128.6 Ų | 128.6 | 74% | 0.743 | 76% | 0.758 | S | S | * | * | trans | -85.5 | 64.5 | 162.7 | -71.1 | -41.3 | 0 | 0 | 0 | 108.4 | T194 Y198 | T194-D196 VanDerWaalsContact C-N 3.32Å; T194-D196 HydrophobicContact CG2-CB 4.46Å; T194-D196 WeakPolarHBondContact CG2-OD2 3.42Å; T194-D196 PolarHBondContact O-N 3.25Å; D196-Y198 VanDerWaalsContact C-N 3.29Å; D196-Y198 PolarHBondContact O-N 2.85Å; D196-Y198 VanDerWaalsContact O-N 3.07Å | ||
| 197 | S | 58.5 | Low | 50.1 | Low | 87 Ų | 87 | 130.9 Ų | 130.9 | 61% | 0.608 | 76% | 0.764 | S | S | * | * | trans | -75.7 | 90.1 | 161.7 | 50.4 | 0 | 0 | 0 | 0 | 108.7 | D195 D199 | D195-S197 PolarHBondContact O-N 3Å; D195-S197 WeakPolarHBondContact OD1-CB 3.48Å; D195-S197 PolarHBondContact OD1-N 3.15Å; D195-S197 PolarHBondContact OD1-OG 2.93Å; S197-D199 PolarHBondContact O-N 3.38Å; S197-D199 VanDerWaalsContact O-N 3.11Å | ||
| 198 | Y | 47.3 | Very low | 49.1 | Very low | 192 Ų | 192 | 133.3 Ų | 133.3 | 75% | 0.753 | 77% | 0.774 | S | S | * | * | trans | -72 | 94.4 | 174.9 | -159.8 | -106.4 | 0 | 0 | 0 | 108.7 | D196 E200 | D196-Y198 VanDerWaalsContact C-N 3.29Å; D196-Y198 PolarHBondContact O-N 2.85Å; D196-Y198 VanDerWaalsContact O-N 3.07Å; Y198-E200 HydrophobicContact CD1-CG 3.56Å; Y198-E200 HydrophobicContact CE1-CG 3.53Å; Y198-E200 WeakPolarHBondContact CE1-OE1 3.25Å; Y198-E200 PolarHBondContact O-N 3.28Å; Y198-E200 VanDerWaalsContact O-N 3.09Å | ||
| 199 | D | 49.1 | Very low | 48.1 | Very low | 161 Ų | 161 | 133.5 Ų | 133.5 | 86% | 0.861 | 77% | 0.771 | S | S | * | * | trans | -69.3 | 96.3 | 167 | -101.4 | -22.1 | 0 | 0 | 0 | 108.4 | S197 D201 | S197-D199 PolarHBondContact O-N 3.38Å; S197-D199 VanDerWaalsContact O-N 3.11Å; D199-D201 PolarHBondContact O-N 3.5Å; D199-D201 VanDerWaalsContact O-N 3.13Å | ||
| 200 | E | 57.1 | Low | 47.2 | Very low | 132 Ų | 132 | 134 Ų | 134 | 62% | 0.617 | 77% | 0.77 | S | S | * | * | trans | -74.6 | 96.8 | 163.5 | -80.5 | -96 | 121.6 | 0 | 0 | 108.5 | Y198 F202 | Y198-E200 HydrophobicContact CD1-CG 3.56Å; Y198-E200 HydrophobicContact CE1-CG 3.53Å; Y198-E200 WeakPolarHBondContact CE1-OE1 3.25Å; Y198-E200 PolarHBondContact O-N 3.28Å; Y198-E200 VanDerWaalsContact O-N 3.09Å; E200-F202 PolarHBondContact O-N 2.93Å | ||
| 201 | D | 53.5 | Low | 46 | Very low | 154 Ų | 154 | 135.5 Ų | 135.5 | 82% | 0.824 | 78% | 0.775 | S | S | * | * | trans | -59.1 | 96.1 | 168.2 | -157.2 | 7.8 | 0 | 0 | 0 | 109.9 | D199 | D199-D201 PolarHBondContact O-N 3.5Å; D199-D201 VanDerWaalsContact O-N 3.13Å | ||
| 202 | F | 41.9 | Very low | 45.2 | Very low | 187 Ų | 187 | 130.4 Ų | 130.4 | 82% | 0.82 | 77% | 0.771 | S | S | * | * | trans | -108.2 | 90.7 | 164.7 | -113.2 | -83.9 | 0 | 0 | 0 | 110.1 | E200 | E200-F202 PolarHBondContact O-N 2.93Š| ||
| 203 | A | 47.5 | Very low | 44.4 | Very low | 89 Ų | 89 | 132.7 Ų | 132.7 | 74% | 0.736 | 78% | 0.777 | S | S | * | * | trans | -51.3 | 133.7 | 161.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 204 | G | 35 | Very low | 43.4 | Very low | 82 Ų | 82 | 135.3 Ų | 135.3 | 85% | 0.845 | 78% | 0.782 | S | S | * | * | trans | 164.3 | 103.8 | 161.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 205 | G | 36.6 | Very low | 43.2 | Very low | 72 Ų | 72 | 134.9 Ų | 134.9 | 74% | 0.742 | 78% | 0.781 | S | S | * | * | trans | 122.2 | 79.9 | 139.6 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 206 | M | 39.4 | Very low | 42.6 | Very low | 164 Ų | 164 | 137.4 Ų | 137.4 | 81% | 0.808 | 79% | 0.793 | S | S | * | * | 51.1 | 111.7 | 127 | -66.8 | 159.4 | 64.3 | 0 | 0 | 120.4 | |||||
| 207 | D | 41.4 | Very low | 41.6 | Very low | 139 Ų | 139 | 134 Ų | 134 | 74% | 0.743 | 79% | 0.791 | S | S | * | * | 48.6 | 113.3 | 122.1 | -27.2 | -36.6 | 0 | 0 | 0 | 119.5 | |||||
| 208 | T | 38.3 | Very low | 40.8 | Very low | 149 Ų | 149 | 136.6 Ų | 136.6 | 91% | 0.914 | 81% | 0.806 | S | S | * | * | trans | -157.2 | 113.4 | 132 | -42.9 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 209 | D | 37 | Very low | 40.5 | Very low | 136 Ų | 136 | 135.1 Ų | 135.1 | 73% | 0.727 | 81% | 0.806 | S | S | * | * | trans | -89.7 | 149.8 | 174.6 | -110.6 | -27.1 | 0 | 0 | 0 | 111.7 | ||||
| 210 | M | 38.9 | Very low | 40.3 | Very low | 167 Ų | 167 | 134.5 Ų | 134.5 | 82% | 0.823 | 80% | 0.801 | S | S | * | * | trans | 70.7 | 108.9 | 149.4 | -60 | -66.8 | 156.1 | 0 | 0 | 121.5 | ||||
| 211 | A | 32.9 | Very low | 39.6 | Very low | 107 Ų | 107 | 137.7 Ų | 137.7 | 88% | 0.884 | 82% | 0.816 | S | S | * | * | 150.1 | 124.6 | 109 | 0 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 212 | G | 36.4 | Very low | 38.8 | Very low | 75 Ų | 75 | 137.2 Ų | 137.2 | 77% | 0.773 | 81% | 0.814 | S | S | * | * | trans | 170.3 | 68.9 | 169.3 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 213 | Q | 35.6 | Very low | 39.1 | Very low | 202 Ų | 202 | 135.4 Ų | 135.4 | 94% | 0.944 | 81% | 0.812 | S | S | * | * | trans | 57.3 | 128.2 | 146 | -54.1 | -151 | 67.8 | 0 | 0 | 123.2 | ||||
| 214 | L | 32.3 | Very low | 38.9 | Very low | 165 Ų | 165 | 140.8 Ų | 140.8 | 86% | 0.864 | 82% | 0.819 | S | S | * | * | trans | -56.3 | -177.6 | 169 | -75.3 | 154.3 | 0 | 0 | 0 | 115.9 | ||||
| 215 | P | 43.9 | Very low | 39.3 | Very low | 104 Ų | 104 | 143.3 Ų | 143.3 | 68% | 0.675 | 82% | 0.818 | S | S | * | * | cis | -132.4 | 137.8 | -47.6 | 34.7 | -17.5 | 0 | 0 | 0 | 112 | ||||
| 216 | L | 38.5 | Very low | 39.2 | Very low | 182 Ų | 182 | 143 Ų | 143 | 95% | 0.953 | 82% | 0.815 | S | S | * | * | trans | -123.6 | 132.5 | 162.8 | -90.7 | 94.7 | 0 | 0 | 0 | 110.1 | ||||
| 217 | G | 31.8 | Very low | 39 | Very low | 68 Ų | 68 | 142 Ų | 142 | 70% | 0.701 | 81% | 0.808 | S | S | * | * | trans | -68.5 | 169.7 | -156.4 | 0 | 0 | 0 | 0 | 0 | 117.5 | H219 | G217-H219 PolarHBondContact O-N 3.33Š| ||
| 218 | P | 41.7 | Very low | 38.7 | Very low | 141 Ų | 141 | 146.4 Ų | 146.4 | 92% | 0.916 | 82% | 0.815 | S | S | * | * | trans | -83.4 | 103.2 | -179.4 | 32.6 | -29.1 | 0 | 0 | 0 | 109.8 | ||||
| 219 | H | 40.9 | Very low | 38.6 | Very low | 162 Ų | 162 | 147.4 Ų | 147.4 | 75% | 0.75 | 81% | 0.806 | S | S | * | * | trans | -101.2 | 105.5 | 167 | -174.3 | -93.1 | 0 | 0 | 0 | 108.8 | G217 | G217-H219 PolarHBondContact O-N 3.33Š| ||
| 220 | L | 45 | Very low | 38.4 | Very low | 147 Ų | 147 | 146.4 Ų | 146.4 | 77% | 0.77 | 81% | 0.81 | S | S | * | * | trans | 50.1 | 75.2 | 156.6 | -58.4 | -179 | 0 | 0 | 0 | 117.3 | ||||
| 221 | Q | 42.5 | Very low | 38.1 | Very low | 199 Ų | 199 | 149.6 Ų | 149.6 | 93% | 0.93 | 81% | 0.813 | S | S | * | * | trans | -126 | 72 | 153.5 | -64.5 | -152.1 | 80.6 | 0 | 0 | 109.3 | ||||
| 222 | D | 37.9 | Very low | 38.3 | Very low | 145 Ų | 145 | 149.9 Ų | 149.9 | 78% | 0.775 | 81% | 0.806 | S | S | * | * | trans | -151.9 | 82.6 | 168.3 | -153.4 | 17.3 | 0 | 0 | 0 | 109.3 | ||||
| 223 | L | 47.7 | Very low | 38.3 | Very low | 149 Ų | 149 | 152.7 Ų | 152.7 | 78% | 0.78 | 81% | 0.808 | S | S | * | * | S | Bend | trans | -150.9 | -1.2 | 166.7 | -102.8 | 177.7 | 0 | 0 | 0 | 115.5 | ||
| 224 | F | 42.8 | Very low | 38.4 | Very low | 202 Ų | 202 | 154.8 Ų | 154.8 | 89% | 0.886 | 81% | 0.807 | S | S | * | * | trans | -143.8 | 60.1 | 176.9 | -64.4 | -71.5 | 0 | 0 | 0 | 113.3 | ||||
| 225 | T | 42.8 | Very low | 38.4 | Very low | 134 Ų | 134 | 155.6 Ų | 155.6 | 82% | 0.822 | 81% | 0.806 | S | S | * | * | S | Bend | trans | -125.3 | 112.2 | 157.6 | -42.8 | 0 | 0 | 0 | 0 | 108.7 | ||
| 226 | G | 34.9 | Very low | 37.8 | Very low | 66 Ų | 66 | 154.2 Ų | 154.2 | 68% | 0.68 | 81% | 0.811 | S | S | * | * | trans | -55.1 | 136.3 | -165.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | R228 | G226-R228 PolarHBondContact O-N 2.84Š| ||
| 227 | H | 35 | Very low | 37.5 | Very low | 144 Ų | 144 | 151.1 Ų | 151.1 | 67% | 0.667 | 81% | 0.805 | S | S | * | * | trans | -55.6 | 95.6 | 166 | -167.5 | -3.7 | 0 | 0 | 0 | 109.8 | F229 | H227-F229 HydrophobicContact CB-CE2 4.41Å; H227-F229 AromaticContact CD2-CE1 3.76Å; H227-F229 AromaticContact CD2-CE2 3.63Å; H227-F229 AromaticContact CD2-CZ 3.3Å; H227-F229 WeakPolarHBondContact CD2-CZ 3.42Å; H227-F229 AromaticContact CE1-CD1 3.67Å; H227-F229 AromaticContact CE1-CE1 3.54Å; H227-F229 AromaticContact CE1-CZ 3.88Å; H227-F229 AromaticContact CG-CE2 3.84Å; H227-F229 AromaticContact CG-CZ 3.95Å; H227-F229 AromaticContact NE2-CD1 3.83Å; H227-F229 AromaticContact NE2-CE1 3.19Å; H227-F229 WeakPolarHBondContact NE2-CE1 3.48Å; H227-F229 AromaticContact NE2-CE2 3.96Å; H227-F229 AromaticContact NE2-CZ 3.28Å; H227-F229 VanDerWaalsContact NE2-CZ 3.28Å; H227-F229 WeakPolarHBondContact NE2-CZ 3.16Å; H227-F229 PolarHBondContact O-N 3.44Å | ||
| 228 | R | 35.8 | Very low | 37.6 | Very low | 231 Ų | 231 | 154.3 Ų | 154.3 | 87% | 0.872 | 81% | 0.81 | S | S | * | * | trans | -72.6 | 100.9 | 163.4 | -71.4 | -96.6 | -80.9 | 176.5 | -5.3 | 106.8 | G226 S230 | G226-R228 PolarHBondContact O-N 2.84Å; R228-S230 PolarHBondContact O-N 2.91Å; R228-S230 VanDerWaalsContact O-N 3.15Å | ||
| 229 | F | 35.7 | Very low | 37.4 | Very low | 169 Ų | 169 | 154.9 Ų | 154.9 | 74% | 0.741 | 80% | 0.801 | S | S | * | * | trans | -66 | 110.4 | 169.5 | -75.8 | -82.9 | 0 | 0 | 0 | 109.3 | H227 R231 | H227-F229 HydrophobicContact CB-CE2 4.41Å; H227-F229 AromaticContact CD2-CE1 3.76Å; H227-F229 AromaticContact CD2-CE2 3.63Å; H227-F229 AromaticContact CD2-CZ 3.3Å; H227-F229 WeakPolarHBondContact CD2-CZ 3.42Å; H227-F229 AromaticContact CE1-CD1 3.67Å; H227-F229 AromaticContact CE1-CE1 3.54Å; H227-F229 AromaticContact CE1-CZ 3.88Å; H227-F229 AromaticContact CG-CE2 3.84Å; H227-F229 AromaticContact CG-CZ 3.95Å; H227-F229 AromaticContact NE2-CD1 3.83Å; H227-F229 AromaticContact NE2-CE1 3.19Å; H227-F229 WeakPolarHBondContact NE2-CE1 3.48Å; H227-F229 AromaticContact NE2-CE2 3.96Å; H227-F229 AromaticContact NE2-CZ 3.28Å; H227-F229 VanDerWaalsContact NE2-CZ 3.28Å; H227-F229 WeakPolarHBondContact NE2-CZ 3.16Å; H227-F229 PolarHBondContact O-N 3.44Å; F229-R231 PolarHBondContact O-N 3Å | ||
| 230 | S | 33.7 | Very low | 37.6 | Very low | 116 Ų | 116 | 153.1 Ų | 153.1 | 81% | 0.811 | 80% | 0.804 | S | S | * | * | trans | -75.3 | 114.1 | 165.7 | 40.4 | 0 | 0 | 0 | 0 | 109.1 | R228 | R228-S230 PolarHBondContact O-N 2.91Å; R228-S230 VanDerWaalsContact O-N 3.15Å | ||
| 231 | R | 32.5 | Very low | 37.3 | Very low | 233 Ų | 233 | 154.7 Ų | 154.7 | 88% | 0.879 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -72 | 129.2 | 174.7 | -175 | 174.4 | 164.5 | -178.7 | -4.1 | 109.3 | F229 V233 | F229-R231 PolarHBondContact O-N 3Å; R231-V233 PolarHBondContact O-N 3.3Å |
| 232 | P | 36.8 | Very low | 37.1 | Very low | 113 Ų | 113 | 150.6 Ų | 150.6 | 73% | 0.734 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -74 | 128 | 176 | 26.7 | -30.2 | 0 | 0 | 0 | 110.8 | R234 | P232-R234 PolarHBondContact O-N 3.23Š|
| 233 | V | 36.3 | Very low | 37.1 | Very low | 134 Ų | 134 | 151.2 Ų | 151.2 | 81% | 0.812 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -61 | 122.5 | 163.9 | 163.8 | 0 | 0 | 0 | 0 | 108.6 | R231 | R231-V233 PolarHBondContact O-N 3.3Š|
| 234 | R | 37.3 | Very low | 36.4 | Very low | 247 Ų | 247 | 149.5 Ų | 149.5 | 93% | 0.932 | 80% | 0.803 | S | S | * | * | trans | -112 | 121.4 | 162.7 | -97.7 | -76.9 | 171.9 | 131.9 | -1.7 | 108.8 | P232 | P232-R234 PolarHBondContact O-N 3.23Š| ||
| 235 | Q | 33.8 | Very low | 36.3 | Very low | 181 Ų | 181 | 146.2 Ų | 146.2 | 85% | 0.846 | 81% | 0.805 | S | S | * | * | trans | -93.3 | 136.7 | -176.1 | -165 | 173.5 | 13.2 | 0 | 0 | 109.2 | ||||
| 236 | G | 31.3 | Very low | 36.3 | Very low | 75 Ų | 75 | 147.5 Ų | 147.5 | 77% | 0.773 | 80% | 0.802 | S | S | * | * | trans | 81.8 | 115.8 | 149.2 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 237 | S | 31.3 | Very low | 36.7 | Very low | 117 Ų | 117 | 151.1 Ų | 151.1 | 82% | 0.818 | 81% | 0.811 | S | S | * | * | trans | -169.7 | 100.6 | 130.4 | -171 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 238 | V | 33.5 | Very low | 37 | Very low | 135 Ų | 135 | 149.8 Ų | 149.8 | 82% | 0.818 | 81% | 0.812 | S | S | * | * | trans | 31.6 | 116.8 | 138 | 177.6 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 239 | E | 37 | Very low | 37.1 | Very low | 153 Ų | 153 | 142.8 Ų | 142.8 | 72% | 0.715 | 80% | 0.799 | S | S | * | * | trans | -41.5 | 157.9 | 157.8 | -100.9 | 105.7 | 108.7 | 0 | 0 | 114.5 | ||||
| 240 | P | 45.9 | Very low | 37.4 | Very low | 126 Ų | 126 | 140.1 Ų | 140.1 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | -129.6 | 141.3 | 106.1 | 34.6 | -26.3 | 0 | 0 | 0 | 113.5 | |||||
| 241 | E | 38 | Very low | 37.8 | Very low | 179 Ų | 179 | 140.7 Ų | 140.7 | 84% | 0.836 | 79% | 0.793 | S | S | * | * | trans | -59.1 | 128 | 171.1 | -44.9 | 177.2 | 124.6 | 0 | 0 | 109.2 | ||||
| 242 | S | 39.3 | Very low | 38.8 | Very low | 113 Ų | 113 | 133.7 Ų | 133.7 | 79% | 0.79 | 78% | 0.776 | S | S | * | * | trans | -142.4 | 96.1 | 168.7 | -161.6 | 0 | 0 | 0 | 0 | 109.5 | C244 | S242-C244 PolarHBondContact O-N 2.98Š| ||
| 243 | D | 37 | Very low | 39.2 | Very low | 159 Ų | 159 | 135.1 Ų | 135.1 | 85% | 0.85 | 78% | 0.776 | S | S | * | * | trans | -61.2 | 119.3 | 167.6 | -73.3 | -46.7 | 0 | 0 | 0 | 110.3 | ||||
| 244 | C | 33.1 | Very low | 39.5 | Very low | 113 Ų | 113 | 133.6 Ų | 133.6 | 76% | 0.764 | 77% | 0.771 | S | S | * | * | trans | -148.1 | 106.1 | 158.2 | -95.7 | 0 | 0 | 0 | 0 | 109.6 | S242 Q246 | S242-C244 PolarHBondContact O-N 2.98Å; C244-Q246 PolarHBondContact O-N 3.18Å | ||
| 245 | S | 41.6 | Very low | 39.7 | Very low | 132 Ų | 132 | 126.5 Ų | 126.5 | 92% | 0.923 | 76% | 0.759 | S | S | * | * | trans | -64.3 | 107.1 | 161.3 | -54.3 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 246 | Q | 41.7 | Very low | 40.2 | Very low | 161 Ų | 161 | 122.7 Ų | 122.7 | 75% | 0.752 | 75% | 0.752 | S | S | * | * | trans | -147.3 | 120.2 | 164.5 | -154.6 | 147.3 | 22.7 | 0 | 0 | 110.4 | C244 V248 | C244-Q246 PolarHBondContact O-N 3.18Å; Q246-V248 PolarHBondContact O-N 3.2Å; Q246-V248 VanDerWaalsContact O-N 3.11Å | ||
| 247 | T | 44.8 | Very low | 40.6 | Very low | 143 Ų | 143 | 126.6 Ų | 126.6 | 88% | 0.877 | 76% | 0.755 | S | S | * | * | trans | -58.2 | 108 | 173 | 51.8 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 248 | V | 40.2 | Very low | 41.2 | Very low | 115 Ų | 115 | 126.5 Ų | 126.5 | 70% | 0.697 | 75% | 0.752 | S | S | * | * | trans | -100.5 | 118 | 175.9 | -96.6 | 0 | 0 | 0 | 0 | 109.9 | Q246 | Q246-V248 PolarHBondContact O-N 3.2Å; Q246-V248 VanDerWaalsContact O-N 3.11Å | ||
| 249 | S | 37.4 | Very low | 41.5 | Very low | 85 Ų | 85 | 125.4 Ų | 125.4 | 59% | 0.594 | 75% | 0.751 | S | S | * | * | trans | -52.9 | 152.5 | 166 | -75.2 | 0 | 0 | 0 | 0 | 111.7 | D251 T252 | S249-D251 PolarHBondContact O-N 2.93Å; S249-T252 PolarHBondContact O-OG1 2.9Å | ||
| 250 | P | 42.9 | Very low | 41.9 | Very low | 112 Ų | 112 | 126.1 Ų | 126.1 | 73% | 0.727 | 76% | 0.759 | S | S | * | * | G | 310 helix | trans | -66.8 | 0.3 | -173.9 | 27 | -34.8 | 0 | 0 | 0 | 115.8 | ||
| 251 | D | 42.8 | Very low | 42 | Very low | 129 Ų | 129 | 128.7 Ų | 128.7 | 69% | 0.69 | 76% | 0.76 | S | S | * | * | G | 310 helix | trans | -88.8 | -8.4 | -174.8 | -58.6 | -47.2 | 0 | 0 | 0 | 114.5 | S249 | S249-D251 PolarHBondContact O-N 2.93Š|
| 252 | T | 52.7 | Low | 42.3 | Very low | 85 Ų | 85 | 128.7 Ų | 128.7 | 52% | 0.521 | 77% | 0.766 | S | S | . | * | G | 310 helix | trans | -94 | -1.2 | -176.2 | 50.5 | 0 | 0 | 0 | 0 | 115.2 | S249 | S249-T252 PolarHBondContact O-OG1 2.9Š|
| 253 | L | 44.4 | Very low | 42.5 | Very low | 143 Ų | 143 | 126.5 Ų | 126.5 | 75% | 0.749 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -83.3 | -13.1 | 174.6 | -66.7 | 178.1 | 0 | 0 | 0 | 113.4 | ||
| 254 | C | 44.2 | Very low | 42.9 | Very low | 102 Ų | 102 | 126.9 Ų | 126.9 | 69% | 0.689 | 76% | 0.762 | S | S | * | * | S | Bend | trans | -83.3 | -10.2 | 179.3 | -66.5 | 0 | 0 | 0 | 0 | 113.9 | ||
| 255 | S | 39.9 | Very low | 43.4 | Very low | 98 Ų | 98 | 129.8 Ų | 129.8 | 69% | 0.685 | 77% | 0.769 | S | S | * | * | S | Bend | trans | -96.8 | -8.2 | -178.6 | -56.5 | 0 | 0 | 0 | 0 | 114.5 | ||
| 256 | S | 45.6 | Very low | 43.3 | Very low | 101 Ų | 101 | 126.6 Ų | 126.6 | 71% | 0.706 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -99.6 | -3.1 | -177.5 | -169.9 | 0 | 0 | 0 | 0 | 114.9 | ||
| 257 | L | 39.8 | Very low | 43.1 | Very low | 158 Ų | 158 | 122.3 Ų | 122.3 | 83% | 0.827 | 75% | 0.745 | S | S | * | * | S | Bend | trans | -106.4 | 2 | 176 | -68.2 | 175.1 | 0 | 0 | 0 | 113.7 | ||
| 258 | C | 44.3 | Very low | 43.2 | Very low | 114 Ų | 114 | 121 Ų | 121 | 77% | 0.77 | 74% | 0.738 | S | S | * | * | S | Bend | trans | -104 | 18.2 | 179.1 | -62.6 | 0 | 0 | 0 | 0 | 114.1 | ||
| 259 | S | 38.7 | Very low | 43.3 | Very low | 112 Ų | 112 | 118.8 Ų | 118.8 | 78% | 0.783 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -133.7 | 29.8 | -179.8 | -153.3 | 0 | 0 | 0 | 0 | 114 | ||
| 260 | L | 45.3 | Very low | 43.8 | Very low | 168 Ų | 168 | 124.2 Ų | 124.2 | 88% | 0.88 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -141.7 | 58.4 | 174.6 | -164.6 | 71.6 | 0 | 0 | 0 | 112.2 | ||
| 261 | E | 48.7 | Very low | 43.9 | Very low | 180 Ų | 180 | 124.7 Ų | 124.7 | 84% | 0.841 | 74% | 0.736 | S | S | * | * | S | Bend | trans | -147.1 | 1.1 | 159 | 64.4 | -172.5 | 155.1 | 0 | 0 | 115.6 | G263 | E261-G263 VanDerWaalsContact C-N 3.28Å; E261-G263 PolarHBondContact O-N 2.79Å |
| 262 | D | 44 | Very low | 44 | Very low | 180 Ų | 180 | 122 Ų | 122 | 96% | 0.963 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.6 | 36.7 | -170.3 | -135.9 | 6.3 | 0 | 0 | 0 | 114.8 | ||
| 263 | G | 42.9 | Very low | 43.6 | Very low | 67 Ų | 67 | 122.4 Ų | 122.4 | 69% | 0.691 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -143.7 | -2.7 | -173.7 | 0 | 0 | 0 | 0 | 0 | 117.9 | E261 | E261-G263 VanDerWaalsContact C-N 3.28Å; E261-G263 PolarHBondContact O-N 2.79Å |
| 264 | L | 46.9 | Very low | 43.7 | Very low | 166 Ų | 166 | 122.8 Ų | 122.8 | 87% | 0.869 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -125.9 | 16.7 | -174.8 | -75.2 | 179.2 | 0 | 0 | 0 | 115.7 | ||
| 265 | L | 43 | Very low | 43.7 | Very low | 175 Ų | 175 | 125.2 Ų | 125.2 | 92% | 0.916 | 74% | 0.741 | S | S | * | * | trans | -120.2 | 81.7 | 166.1 | -69.2 | 174.3 | 0 | 0 | 0 | 109.4 | S267 | L265-S267 PolarHBondContact O-N 2.74Š| ||
| 266 | G | 40.1 | Very low | 44 | Very low | 64 Ų | 64 | 128 Ų | 128 | 66% | 0.66 | 75% | 0.747 | S | S | * | * | trans | -54.3 | 131 | 166.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 267 | S | 37.3 | Very low | 43.8 | Very low | 72 Ų | 72 | 125.5 Ų | 125.5 | 50% | 0.503 | 74% | 0.738 | S | S | . | * | trans | -36.4 | 132.1 | 174.2 | 179.1 | 0 | 0 | 0 | 0 | 112.7 | L265 A269 R270 | L265-S267 PolarHBondContact O-N 2.74Å; S267-A269 PolarHBondContact O-N 3.24Å; S267-R270 PolarHBondContact O-N 3.35Å; S267-R270 VanDerWaalsContact O-N 3.1Å | ||
| 268 | P | 45.1 | Very low | 44 | Very low | 114 Ų | 114 | 125.2 Ų | 125.2 | 74% | 0.74 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.5 | -17.7 | -179.7 | -21.9 | 29.8 | 0 | 0 | 0 | 114.2 | R270 | P268-R270 VanDerWaalsContact C-N 3.31Å; P268-R270 PolarHBondContact O-N 2.98Å |
| 269 | A | 44.1 | Very low | 43.9 | Very low | 70 Ų | 70 | 128.7 Ų | 128.7 | 58% | 0.579 | 74% | 0.742 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.2 | -20.5 | 179 | 0 | 0 | 0 | 0 | 0 | 114.2 | S267 | S267-A269 PolarHBondContact O-N 3.24Š|
| 270 | R | 47.2 | Very low | 44.3 | Very low | 198 Ų | 198 | 130.7 Ų | 130.7 | 75% | 0.747 | 74% | 0.743 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.4 | -22 | -176.1 | -61.7 | -169.2 | 80.8 | 167.9 | 4.2 | 114.5 | S267 P268 | S267-R270 PolarHBondContact O-N 3.35Å; S267-R270 VanDerWaalsContact O-N 3.1Å; P268-R270 VanDerWaalsContact C-N 3.31Å; P268-R270 PolarHBondContact O-N 2.98Å |
| 271 | L | 44.9 | Very low | 44.4 | Very low | 123 Ų | 123 | 130.7 Ų | 130.7 | 64% | 0.644 | 74% | 0.743 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.6 | -24.5 | 178.1 | -66.5 | 177.2 | 0 | 0 | 0 | 112.7 | S273 Q274 | L271-S273 VanDerWaalsContact C-N 3.35Å; L271-Q274 PolarHBondContact O-N 3.15Å |
| 272 | A | 43.8 | Very low | 43.7 | Very low | 71 Ų | 71 | 130.6 Ų | 130.6 | 59% | 0.587 | 75% | 0.747 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70 | -29.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 273 | S | 45 | Very low | 43.4 | Very low | 94 Ų | 94 | 126.8 Ų | 126.8 | 66% | 0.657 | 74% | 0.74 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.7 | -13.8 | 179.4 | -53.8 | 0 | 0 | 0 | 0 | 114 | L271 | L271-S273 VanDerWaalsContact C-N 3.35Š|
| 274 | Q | 46.6 | Very low | 43.2 | Very low | 151 Ų | 151 | 133 Ų | 133 | 71% | 0.706 | 75% | 0.748 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96 | -19.2 | -176.7 | -147.8 | 148.1 | 53.9 | 0 | 0 | 112.8 | L271 | L271-Q274 PolarHBondContact O-N 3.15Š|
| 275 | L | 44.9 | Very low | 42.6 | Very low | 153 Ų | 153 | 133.1 Ų | 133.1 | 80% | 0.801 | 75% | 0.749 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.9 | -8.2 | 173.9 | -99.8 | 156.7 | 0 | 0 | 0 | 114.2 | ||
| 276 | L | 45 | Very low | 42.3 | Very low | 157 Ų | 157 | 130 Ų | 130 | 82% | 0.822 | 74% | 0.739 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.6 | 8.7 | 178 | -154.4 | 72.1 | 0 | 0 | 0 | 113 | ||
| 277 | G | 42.3 | Very low | 42.1 | Very low | 49 Ų | 49 | 133.1 Ų | 133.1 | 51% | 0.505 | 75% | 0.748 | S | S | . | * | S | Bend | trans | -98.2 | -17.6 | -176.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||
| 278 | D | 42.8 | Very low | 41.8 | Very low | 152 Ų | 152 | 135.6 Ų | 135.6 | 81% | 0.813 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -106.2 | 8.3 | -169 | -80.9 | -10.4 | 0 | 0 | 0 | 114.8 | L280 | D278-L280 PolarHBondContact O-N 3.13Š|
| 279 | E | 43.6 | Very low | 41.6 | Very low | 186 Ų | 186 | 140 Ų | 140 | 87% | 0.869 | 77% | 0.767 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.5 | 31 | 175.5 | -78.6 | -76.8 | 141.8 | 0 | 0 | 112.7 | ||
| 280 | L | 47.3 | Very low | 41.2 | Very low | 155 Ų | 155 | 144 Ų | 144 | 81% | 0.812 | 77% | 0.774 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -125.6 | 8 | -178.8 | -107.9 | 164.6 | 0 | 0 | 0 | 115.6 | D278 | D278-L280 PolarHBondContact O-N 3.13Š|
| 281 | L | 45.9 | Very low | 40.7 | Very low | 168 Ų | 168 | 140.4 Ų | 140.4 | 88% | 0.88 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -128.7 | 50.7 | -179.9 | -68.4 | -176.4 | 0 | 0 | 0 | 114.9 | ||
| 282 | L | 35.5 | Very low | 40.1 | Very low | 178 Ų | 178 | 138.1 Ų | 138.1 | 93% | 0.932 | 78% | 0.778 | S | S | * | * | trans | -143.7 | 66.9 | 160.1 | -147.6 | 69.5 | 0 | 0 | 0 | 113.4 | ||||
| 283 | A | 36.5 | Very low | 39.6 | Very low | 99 Ų | 99 | 144.9 Ų | 144.9 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | trans | -97.4 | 103.3 | 164 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 284 | K | 38.8 | Very low | 39.4 | Very low | 197 Ų | 197 | 152 Ų | 152 | 86% | 0.857 | 81% | 0.807 | S | S | * | * | trans | 167.3 | 111.4 | 144.3 | -104.1 | -94.3 | -178.2 | 168.2 | 0 | 112.2 | ||||
| 285 | L | 35.1 | Very low | 38.9 | Very low | 169 Ų | 169 | 149.8 Ų | 149.8 | 89% | 0.885 | 81% | 0.808 | S | S | * | * | trans | -171.4 | 150 | 137 | -94.2 | 159.7 | 0 | 0 | 0 | 108.2 | ||||
| 286 | P | 36.2 | Very low | 38.8 | Very low | 109 Ų | 109 | 150.3 Ų | 150.3 | 71% | 0.708 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -82.1 | 164.4 | -153.4 | 34.4 | -36.5 | 0 | 0 | 0 | 114.6 | S288 | P286-S288 PolarHBondContact O-N 3.09Š|
| 287 | P | 36.8 | Very low | 38.2 | Very low | 131 Ų | 131 | 146.1 Ų | 146.1 | 85% | 0.851 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -78.8 | 118.1 | -173.5 | 31.6 | -31.7 | 0 | 0 | 0 | 111.1 | ||
| 288 | S | 30.7 | Very low | 38.3 | Very low | 123 Ų | 123 | 150 Ų | 150 | 86% | 0.86 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -84.4 | 127.6 | 159.2 | -174.7 | 0 | 0 | 0 | 0 | 108.7 | P286 | P286-S288 PolarHBondContact O-N 3.09Š|
| 289 | R | 41.2 | Very low | 37.9 | Very low | 207 Ų | 207 | 150.1 Ų | 150.1 | 78% | 0.781 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 162.5 | -175.6 | 177.6 | -176 | 172.6 | -169.2 | -3.3 | 112.8 | ||
| 290 | E | 35.7 | Very low | 37.3 | Very low | 155 Ų | 155 | 149.4 Ų | 149.4 | 72% | 0.724 | 82% | 0.818 | S | S | * | * | trans | 95.3 | 83.4 | 175 | -65.9 | 117.6 | -141.2 | 0 | 0 | 114.9 | ||||
| 291 | S | 35.8 | Very low | 37 | Very low | 121 Ų | 121 | 148.4 Ų | 148.4 | 85% | 0.846 | 82% | 0.819 | S | S | * | * | 56.2 | 99.8 | 72 | 177.8 | 0 | 0 | 0 | 0 | 115.1 | |||||
| 292 | A | 33.5 | Very low | 36.3 | Very low | 75 Ų | 75 | 149.4 Ų | 149.4 | 62% | 0.62 | 82% | 0.819 | S | S | * | * | -162.4 | 131.6 | 126.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 293 | F | 33.3 | Very low | 36.2 | Very low | 213 Ų | 213 | 148.2 Ų | 148.2 | 93% | 0.934 | 81% | 0.814 | S | S | * | * | trans | 79.9 | 79.9 | 173.7 | -48.2 | -71.7 | 0 | 0 | 0 | 117.3 | ||||
| 294 | R | 39.8 | Very low | 36 | Very low | 243 Ų | 243 | 149.5 Ų | 149.5 | 92% | 0.917 | 82% | 0.817 | S | S | * | * | trans | -109.1 | 119.6 | 155.1 | -136.4 | -100.5 | -84.6 | -146.7 | -2.3 | 107.1 | ||||
| 295 | S | 35.4 | Very low | 36.1 | Very low | 105 Ų | 105 | 148 Ų | 148 | 73% | 0.734 | 82% | 0.817 | S | S | * | * | trans | 163 | 124.1 | 156.5 | -100.8 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 296 | L | 42.8 | Very low | 36 | Very low | 164 Ų | 164 | 149.9 Ų | 149.9 | 86% | 0.859 | 81% | 0.814 | S | S | * | * | cis | -149.1 | 152.2 | 2.6 | -77.3 | 166.6 | 0 | 0 | 0 | 107.2 | ||||
| 297 | G | 34.3 | Very low | 35.9 | Very low | 69 Ų | 69 | 151.2 Ų | 151.2 | 71% | 0.711 | 82% | 0.815 | S | S | * | * | trans | -76.6 | -174.5 | -176.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 298 | P | 42.6 | Very low | 35.9 | Very low | 130 Ų | 130 | 149.5 Ų | 149.5 | 84% | 0.844 | 81% | 0.806 | S | S | * | * | trans | -84.7 | 146.3 | -176.7 | 35 | -31.4 | 0 | 0 | 0 | 111 | ||||
| 299 | L | 34.7 | Very low | 36.8 | Very low | 156 Ų | 156 | 149.3 Ų | 149.3 | 82% | 0.817 | 80% | 0.802 | S | S | * | * | trans | -128.8 | 103.4 | 172.6 | -161.7 | 72.2 | 0 | 0 | 0 | 111.3 | ||||
| 300 | E | 32.4 | Very low | 36.7 | Very low | 170 Ų | 170 | 146.6 Ų | 146.6 | 79% | 0.794 | 80% | 0.802 | S | S | * | * | trans | 26 | 131.4 | 136 | -71.5 | 162.7 | 133.8 | 0 | 0 | 121.7 | ||||
| 301 | T | 39.6 | Very low | 36.8 | Very low | 134 Ų | 134 | 145.9 Ų | 145.9 | 82% | 0.822 | 81% | 0.809 | S | S | * | * | trans | -60.2 | 135.3 | 159.4 | -0.9 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 302 | Q | 31.2 | Very low | 36.7 | Very low | 189 Ų | 189 | 148.8 Ų | 148.8 | 88% | 0.883 | 81% | 0.809 | S | S | * | * | 180 | 152.3 | 128.8 | -104.1 | -172.7 | 76 | 0 | 0 | 114.5 | |||||
| 303 | D | 34.8 | Very low | 36.5 | Very low | 153 Ų | 153 | 150.8 Ų | 150.8 | 82% | 0.818 | 82% | 0.818 | S | S | * | * | trans | -64.5 | 150.4 | -175.8 | -57.7 | -65.8 | 0 | 0 | 0 | 116.1 | ||||
| 304 | S | 32.1 | Very low | 36.7 | Very low | 127 Ų | 127 | 146.1 Ų | 146.1 | 89% | 0.888 | 81% | 0.811 | S | S | * | * | trans | -166.2 | 139.4 | 135.3 | 74.8 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 305 | L | 40.4 | Very low | 36.2 | Very low | 165 Ų | 165 | 143 Ų | 143 | 86% | 0.864 | 81% | 0.812 | S | S | * | * | trans | -82.6 | 141.8 | 177.5 | -68 | 133.9 | 0 | 0 | 0 | 112 | ||||
| 306 | Y | 32.9 | Very low | 36.2 | Very low | 209 Ų | 209 | 143.3 Ų | 143.3 | 82% | 0.82 | 81% | 0.814 | S | S | * | * | -178.8 | 138.9 | 125.2 | -129.4 | -133.7 | 0 | 0 | 0 | 114.3 | |||||
| 307 | N | 34 | Very low | 36.5 | Very low | 137 Ų | 137 | 141.4 Ų | 141.4 | 73% | 0.733 | 81% | 0.811 | S | S | * | * | trans | 92 | 118.7 | 151.1 | -66.9 | -35.8 | 0 | 0 | 0 | 123.9 | ||||
| 308 | S | 37.7 | Very low | 36.2 | Very low | 94 Ų | 94 | 142 Ų | 142 | 66% | 0.657 | 81% | 0.809 | S | S | * | * | trans | -106.1 | 162 | 161.6 | -177.6 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 309 | P | 48.5 | Very low | 36 | Very low | 120 Ų | 120 | 144.9 Ų | 144.9 | 78% | 0.779 | 81% | 0.811 | S | S | * | * | -142.6 | 140.8 | 80.2 | 23.3 | 1 | 0 | 0 | 0 | 114.4 | |||||
| 310 | L | 39 | Very low | 36.2 | Very low | 149 Ų | 149 | 147 Ų | 147 | 78% | 0.78 | 82% | 0.817 | S | S | * | * | 62.5 | 110 | 84.5 | -82.2 | 162.9 | 0 | 0 | 0 | 117.7 | |||||
| 311 | T | 38.7 | Very low | 36.5 | Very low | 140 Ų | 140 | 145.7 Ų | 145.7 | 86% | 0.859 | 81% | 0.811 | S | S | * | * | trans | -159.2 | 100.3 | 142.9 | 33.1 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 312 | E | 33.3 | Very low | 36.9 | Very low | 182 Ų | 182 | 145 Ų | 145 | 85% | 0.85 | 81% | 0.808 | S | S | * | * | 50 | 112.8 | 98.9 | -76.1 | -139.6 | 131.1 | 0 | 0 | 115.7 | |||||
| 313 | S | 30.1 | Very low | 37.2 | Very low | 117 Ų | 117 | 139 Ų | 139 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | 171.9 | 120.4 | 98 | -158.7 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 314 | C | 35.8 | Very low | 37.7 | Very low | 116 Ų | 116 | 137.2 Ų | 137.2 | 78% | 0.784 | 79% | 0.788 | S | S | * | * | trans | -79.6 | 162.1 | 165.2 | -60.2 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 315 | L | 30.6 | Very low | 37.5 | Very low | 177 Ų | 177 | 135.6 Ų | 135.6 | 93% | 0.927 | 78% | 0.776 | S | S | * | * | trans | 172.8 | 125.1 | 134 | -85.8 | -174.5 | 0 | 0 | 0 | 110.5 | ||||
| 316 | S | 34.9 | Very low | 37.1 | Very low | 111 Ų | 111 | 135.9 Ų | 135.9 | 78% | 0.776 | 77% | 0.77 | S | S | * | * | trans | -87 | -168.4 | 157.9 | -41.2 | 0 | 0 | 0 | 0 | 109 | ||||
| 317 | P | 48.3 | Very low | 37.1 | Very low | 125 Ų | 125 | 132.1 Ų | 132.1 | 81% | 0.812 | 76% | 0.764 | S | S | * | * | cis | -127.6 | -164.4 | -27.2 | 34.7 | -13.2 | 0 | 0 | 0 | 111.3 | ||||
| 318 | A | 29.3 | Very low | 37 | Very low | 80 Ų | 80 | 131.1 Ų | 131.1 | 66% | 0.661 | 77% | 0.767 | S | S | * | * | trans | 115.2 | 122 | 155.3 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 319 | E | 37.2 | Very low | 37 | Very low | 191 Ų | 191 | 135.2 Ų | 135.2 | 89% | 0.893 | 78% | 0.776 | S | S | * | * | trans | 68.9 | 115.9 | 131.3 | -60.2 | 172.4 | 176.4 | 0 | 0 | 120.8 | ||||
| 320 | E | 38.7 | Very low | 36.5 | Very low | 201 Ų | 201 | 134.6 Ų | 134.6 | 94% | 0.939 | 77% | 0.771 | S | S | * | * | 171.5 | 131.6 | 113.9 | -165.9 | 166.2 | 107.3 | 0 | 0 | 111.6 | |||||
| 321 | E | 39.9 | Very low | 36.2 | Very low | 143 Ų | 143 | 135.1 Ų | 135.1 | 67% | 0.668 | 77% | 0.774 | S | S | * | * | trans | -106.2 | 159.5 | 178.2 | -137.6 | -101.9 | 142.7 | 0 | 0 | 108.4 | A323 | E321-A323 PolarHBondContact OE1-N 3.11Å; E321-A323 WeakPolarHBondContact OE2-CB 3.11Å; E321-A323 PolarHBondContact OE2-N 3.07Å | ||
| 322 | P | 47 | Very low | 36.1 | Very low | 118 Ų | 118 | 134.2 Ų | 134.2 | 77% | 0.766 | 77% | 0.772 | S | S | * | * | -152.6 | 132.7 | 95.4 | 33.9 | -13.1 | 0 | 0 | 0 | 118 | |||||
| 323 | A | 39.1 | Very low | 36.4 | Very low | 64 Ų | 64 | 131.3 Ų | 131.3 | 53% | 0.529 | 77% | 0.769 | S | S | . | * | 20.7 | 155.6 | 126.2 | 0 | 0 | 0 | 0 | 0 | 119.6 | E321 | E321-A323 PolarHBondContact OE1-N 3.11Å; E321-A323 WeakPolarHBondContact OE2-CB 3.11Å; E321-A323 PolarHBondContact OE2-N 3.07Å | |||
| 324 | P | 43.3 | Very low | 37.6 | Very low | 116 Ų | 116 | 131.5 Ų | 131.5 | 75% | 0.753 | 77% | 0.768 | S | S | * | * | cis | -146 | 175.2 | 44.3 | 26.7 | 0.6 | 0 | 0 | 0 | 114.9 | ||||
| 325 | C | 29.1 | Very low | 37.2 | Very low | 93 Ų | 93 | 133.7 Ų | 133.7 | 63% | 0.628 | 77% | 0.77 | S | S | * | * | cis | -170.4 | 148 | 8.7 | -119.6 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 326 | K | 32.4 | Very low | 37 | Very low | 171 Ų | 171 | 131.8 Ų | 131.8 | 74% | 0.743 | 77% | 0.766 | S | S | * | * | trans | 76.7 | 130.6 | 133.7 | -70.3 | 175.1 | -178.9 | 176.5 | 0 | 118.4 | ||||
| 327 | D | 31.5 | Very low | 36.8 | Very low | 129 Ų | 129 | 129 Ų | 129 | 69% | 0.69 | 76% | 0.755 | S | S | * | * | cis | -159.9 | 139 | 18.9 | -92.8 | -38.2 | 0 | 0 | 0 | 111.9 | ||||
| 328 | C | 32.2 | Very low | 36.4 | Very low | 116 Ų | 116 | 128.5 Ų | 128.5 | 78% | 0.784 | 76% | 0.755 | S | S | * | * | trans | 56.7 | 105 | 137.1 | -55.6 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 329 | Q | 38.5 | Very low | 36.4 | Very low | 181 Ų | 181 | 134.9 Ų | 134.9 | 85% | 0.846 | 76% | 0.762 | S | S | * | * | trans | -87.6 | 154.7 | 140.4 | -108.3 | -154 | -25.7 | 0 | 0 | 109.6 | ||||
| 330 | P | 38.5 | Very low | 36.6 | Very low | 106 Ų | 106 | 134.2 Ų | 134.2 | 69% | 0.688 | 76% | 0.759 | S | S | * | * | -151.2 | 150.4 | 110.1 | 30.1 | -9 | 0 | 0 | 0 | 116.5 | |||||
| 331 | L | 31.6 | Very low | 36.4 | Very low | 160 Ų | 160 | 135.4 Ų | 135.4 | 84% | 0.838 | 75% | 0.754 | S | S | * | * | trans | 75 | 125.3 | 145.8 | -60.2 | 160.1 | 0 | 0 | 0 | 120.1 | ||||
| 332 | C | 35.8 | Very low | 36.2 | Very low | 122 Ų | 122 | 137 Ų | 137 | 82% | 0.824 | 76% | 0.762 | S | S | * | * | trans | -79.7 | 152.4 | 162.2 | -62.8 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 333 | P | 40 | Very low | 35.9 | Very low | 121 Ų | 121 | 142.1 Ų | 142.1 | 79% | 0.786 | 77% | 0.766 | S | S | * | * | -149.3 | -176.8 | 94.2 | 40.2 | -19.5 | 0 | 0 | 0 | 113.9 | |||||
| 334 | P | 55.5 | Low | 35.9 | Very low | 121 Ų | 121 | 147.7 Ų | 147.7 | 79% | 0.786 | 78% | 0.781 | S | S | * | * | trans | -95.6 | 148.9 | -146.4 | 38.3 | -35 | 0 | 0 | 0 | 114.7 | ||||
| 335 | L | 27 | Very low | 35.6 | Very low | 161 Ų | 161 | 146.2 Ų | 146.2 | 84% | 0.843 | 78% | 0.779 | S | S | * | * | trans | -169.8 | 127.6 | 160.8 | -150.2 | 57 | 0 | 0 | 0 | 113.5 | ||||
| 336 | V | 27.9 | Very low | 36.3 | Very low | 138 Ų | 138 | 146.6 Ų | 146.6 | 84% | 0.836 | 78% | 0.783 | S | S | * | * | trans | 53.3 | 129.6 | 137.1 | 171.3 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 337 | G | 30.4 | Very low | 37.2 | Very low | 53 Ų | 53 | 146.6 Ų | 146.6 | 55% | 0.546 | 79% | 0.79 | S | S | . | * | trans | 161.7 | 37.2 | 149.3 | 0 | 0 | 0 | 0 | 0 | 117.9 | W339 | G337-W339 PolarHBondContact O-N 3.21Š| ||
| 338 | S | 38.9 | Very low | 38.1 | Very low | 114 Ų | 114 | 146.4 Ų | 146.4 | 80% | 0.797 | 79% | 0.794 | S | S | * | * | trans | -61.5 | 115.7 | 156.7 | 176.6 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 339 | W | 29.2 | Very low | 38.8 | Very low | 214 Ų | 214 | 145.6 Ų | 145.6 | 81% | 0.811 | 80% | 0.796 | S | S | * | * | trans | -144.2 | 92.4 | 158.6 | 57.6 | -82.6 | 0 | 0 | 0 | 106 | G337 | G337-W339 PolarHBondContact O-N 3.21Š| ||
| 340 | E | 41.3 | Very low | 39.2 | Very low | 177 Ų | 177 | 142.4 Ų | 142.4 | 83% | 0.827 | 79% | 0.793 | S | S | * | * | 40.9 | 95 | 85.5 | -89.8 | -179.3 | 163.4 | 0 | 0 | 115.3 | |||||
| 341 | R | 34.6 | Very low | 39.9 | Very low | 225 Ų | 225 | 143.1 Ų | 143.1 | 85% | 0.849 | 80% | 0.8 | S | S | * | * | trans | -158.9 | 111.9 | 132.1 | -158.9 | 177.1 | -75.4 | -156.8 | -1.2 | 105.2 | ||||
| 342 | Q | 37.1 | Very low | 40.5 | Very low | 177 Ų | 177 | 138.3 Ų | 138.3 | 83% | 0.827 | 79% | 0.79 | S | S | * | * | -166.4 | 129 | 58.8 | -171.3 | 161.7 | -86.2 | 0 | 0 | 112.1 | |||||
| 343 | R | 40.4 | Very low | 40.8 | Very low | 225 Ų | 225 | 139.5 Ų | 139.5 | 85% | 0.849 | 79% | 0.793 | S | S | * | * | trans | -30.7 | 149.7 | 156.8 | -50 | -174 | -169.9 | -129 | 9.6 | 113.7 | ||||
| 344 | Q | 39 | Very low | 41.2 | Very low | 181 Ų | 181 | 139.8 Ų | 139.8 | 85% | 0.846 | 79% | 0.792 | S | S | * | * | -161.2 | 130.2 | 58.1 | -84.8 | 174.3 | -34 | 0 | 0 | 110.2 | |||||
| 345 | A | 36.2 | Very low | 41 | Very low | 86 Ų | 86 | 139.4 Ų | 139.4 | 71% | 0.711 | 79% | 0.792 | S | S | * | * | 69.3 | 96 | 109.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 346 | S | 44 | Very low | 42 | Very low | 101 Ų | 101 | 139.3 Ų | 139.3 | 71% | 0.706 | 79% | 0.792 | S | S | * | * | 58.6 | 117.1 | 84.8 | 71.9 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 347 | D | 50.8 | Low | 43.3 | Very low | 170 Ų | 170 | 139.2 Ų | 139.2 | 91% | 0.909 | 79% | 0.787 | S | S | * | * | -160 | 139.5 | 123.3 | -96.4 | -23 | 0 | 0 | 0 | 114 | |||||
| 348 | V | 51.5 | Low | 44.2 | Very low | 126 Ų | 126 | 146 Ų | 146 | 76% | 0.764 | 80% | 0.804 | S | S | * | * | trans | -74.7 | 142.5 | 174.9 | 158.3 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 349 | A | 46.1 | Very low | 44.8 | Very low | 99 Ų | 99 | 147.7 Ų | 147.7 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | trans | -140 | 85.3 | 155.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | S351 | A349-S351 PolarHBondContact O-N 3.1Š| ||
| 350 | S | 48.3 | Very low | 45.9 | Very low | 113 Ų | 113 | 146 Ų | 146 | 79% | 0.79 | 81% | 0.805 | S | S | * | * | trans | -61.9 | 116.5 | 148.3 | -74.6 | 0 | 0 | 0 | 0 | 107.8 | G352 | S350-G352 PolarHBondContact O-N 3.46Š| ||
| 351 | S | 51.8 | Low | 46.6 | Very low | 121 Ų | 121 | 143.1 Ų | 143.1 | 85% | 0.846 | 80% | 0.802 | S | S | * | * | trans | -84.8 | 107.3 | 169.9 | 179.9 | 0 | 0 | 0 | 0 | 108.5 | A349 | A349-S351 PolarHBondContact O-N 3.1Š| ||
| 352 | G | 43.8 | Very low | 47.4 | Very low | 59 Ų | 59 | 140.4 Ų | 140.4 | 61% | 0.608 | 80% | 0.799 | S | S | * | * | trans | -72.7 | 141.3 | 170.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | S350 V354 | S350-G352 PolarHBondContact O-N 3.46Å; G352-V354 PolarHBondContact O-N 3.05Å | ||
| 353 | V | 44 | Very low | 48.2 | Very low | 148 Ų | 148 | 141.6 Ų | 141.6 | 90% | 0.897 | 81% | 0.805 | S | S | * | * | trans | -65.6 | 121.4 | 167.2 | -73.8 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 354 | V | 47.3 | Very low | 48.3 | Very low | 126 Ų | 126 | 142.9 Ų | 142.9 | 76% | 0.764 | 82% | 0.82 | S | S | * | * | trans | -93.3 | 111.2 | 167.9 | 163.2 | 0 | 0 | 0 | 0 | 107 | G352 L356 | G352-V354 PolarHBondContact O-N 3.05Å; V354-L356 PolarHBondContact O-N 3.36Å | ||
| 355 | S | 51.4 | Low | 48.7 | Very low | 114 Ų | 114 | 141 Ų | 141 | 80% | 0.797 | 82% | 0.819 | S | S | * | * | trans | -64.2 | 121.2 | 159.4 | -55 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 356 | L | 48.5 | Very low | 49.4 | Very low | 158 Ų | 158 | 143.9 Ų | 143.9 | 83% | 0.827 | 83% | 0.825 | S | S | * | * | trans | -99.2 | 112.3 | 174.2 | -152.9 | 140.3 | 0 | 0 | 0 | 106.7 | V354 | V354-L356 PolarHBondContact O-N 3.36Š| ||
| 357 | D | 54.6 | Low | 49.7 | Very low | 137 Ų | 137 | 146.3 Ų | 146.3 | 73% | 0.733 | 83% | 0.831 | S | S | * | * | trans | -57.4 | 136.9 | 174.9 | -115 | -122.5 | 0 | 0 | 0 | 110.3 | ||||
| 358 | E | 49.9 | Very low | 49.6 | Very low | 194 Ų | 194 | 144.9 Ų | 144.9 | 91% | 0.907 | 83% | 0.827 | S | S | * | * | trans | -83 | 106.8 | 174.3 | -66.9 | 179.3 | 113.4 | 0 | 0 | 109.1 | ||||
| 359 | D | 50.7 | Low | 49.5 | Very low | 151 Ų | 151 | 146.1 Ų | 146.1 | 81% | 0.807 | 83% | 0.831 | S | S | * | * | trans | -99.5 | 111.4 | 165.2 | -91.6 | -62.5 | 0 | 0 | 0 | 109.1 | ||||
| 360 | E | 51.8 | Low | 49.8 | Very low | 178 Ų | 178 | 149.2 Ų | 149.2 | 83% | 0.832 | 83% | 0.832 | S | S | * | * | trans | -68.5 | 144 | 167.5 | -77.3 | -148.2 | 127 | 0 | 0 | 111.5 | ||||
| 361 | P | 57 | Low | 49.9 | Very low | 117 Ų | 117 | 151.8 Ų | 151.8 | 76% | 0.76 | 84% | 0.835 | S | S | * | * | trans | -106.8 | 116.4 | 148.5 | 31.2 | -25.1 | 0 | 0 | 0 | 111.1 | E363 | P361-E363 PolarHBondContact O-N 3.35Š| ||
| 362 | E | 50.5 | Low | 49.7 | Very low | 167 Ų | 167 | 154.2 Ų | 154.2 | 78% | 0.78 | 83% | 0.834 | S | S | * | * | trans | -53.9 | 125.5 | 159.6 | -63.7 | -177.5 | 154.1 | 0 | 0 | 110.1 | ||||
| 363 | E | 53.8 | Low | 50.2 | Low | 202 Ų | 202 | 162.1 Ų | 162.1 | 94% | 0.944 | 85% | 0.852 | S | S | * | * | trans | -106.5 | 127.2 | 157.2 | -83.8 | -167.3 | 156.2 | 0 | 0 | 109 | P361 | P361-E363 PolarHBondContact O-N 3.35Š| ||
| 364 | Q | 43 | Very low | 50.8 | Low | 253 Ų | 253 | 163.4 Ų | 163.4 | 100% | 1.182 | 85% | 0.848 | S | S | * | * | trans | -120.6 | 0 | 178.3 | -149.6 | 171.7 | 102.1 | 0 | 0 | 108.7 |
Retrieved 364 of 364 residues in 387.3 ms
(Link to these results)