| 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 | 39.3 | Very low | 64.5 | Low | 236 Ų | 236 | 112.5 Ų | 112.5 | 100% | 1.163 | 56% | 0.563 | S | S | * | * | 0 | 116.4 | 0 | -69.8 | -165.2 | 161.3 | 0 | 0 | 107.5 | N3 | M1-N3 PolarHBondContact O-N 3.18Š| |||
| 2 | R | 39.1 | Very low | 65.9 | Low | 250 Ų | 250 | 113.4 Ų | 113.4 | 94% | 0.943 | 57% | 0.565 | S | S | * | * | trans | -77 | 116.9 | -175.6 | -65.2 | 178.9 | -157 | 177.9 | 6.2 | 107.8 | E4 | R2-E4 PolarHBondContact O-N 3.42Š| ||
| 3 | N | 47.5 | Very low | 67.2 | Low | 159 Ų | 159 | 104.8 Ų | 104.8 | 85% | 0.85 | 52% | 0.522 | S | S | * | . | trans | -63.4 | 112 | 173.1 | -74.6 | -24.3 | 0 | 0 | 0 | 108.3 | M1 | M1-N3 PolarHBondContact O-N 3.18Š| ||
| 4 | E | 51.8 | Low | 68.2 | Low | 172 Ų | 172 | 98.6 Ų | 98.6 | 80% | 0.804 | 49% | 0.493 | S | S | * | . | trans | -58.4 | 141.5 | 168.2 | -79.2 | -157.3 | 146.4 | 0 | 0 | 109.8 | R2 S6 | R2-E4 PolarHBondContact O-N 3.42Å; E4-S6 PolarHBondContact O-N 2.96Å | ||
| 5 | P | 57.8 | Low | 69 | Low | 87 Ų | 87 | 101 Ų | 101 | 57% | 0.565 | 51% | 0.508 | S | S | * | . | trans | -62.2 | 111.4 | 176 | 25.9 | -32.2 | 0 | 0 | 0 | 108.7 | K7 | P5-K7 PolarHBondContact O-N 3.4Š| ||
| 6 | S | 67.6 | Low | 69.5 | Low | 75 Ų | 75 | 98.3 Ų | 98.3 | 52% | 0.524 | 50% | 0.501 | S | S | . | . | trans | -51.8 | 114.2 | -177.3 | 56.4 | 0 | 0 | 0 | 0 | 110.8 | E4 L8 | E4-S6 PolarHBondContact O-N 2.96Å; S6-L8 PolarHBondContact O-N 2.98Å | ||
| 7 | K | 79.4 | Confident | 69.7 | Low | 122 Ų | 122 | 95.1 Ų | 95.1 | 53% | 0.53 | 50% | 0.498 | S | S | . | . | trans | -64.2 | 115.1 | 169.2 | -76.1 | -177.3 | -178.7 | -170.3 | 0 | 108.7 | P5 E449 I457 | P5-K7 PolarHBondContact O-N 3.4Å; K7-E449 WeakPolarHBondContact CD-OE1 3.49Å; K7-E449 WeakPolarHBondContact CE-OE1 3.41Å; K7-E449 IonicContact NZ-OE1 3.26Å; K7-E449 PolarHBondContact NZ-OE1 2.95Å; K7-E449 IonicContact NZ-OE2 2.73Å; K7-I457 HydrophobicContact CB-CG2 3.52Å; K7-I457 HydrophobicContact CD-CG2 4.25Å; K7-I457 HydrophobicContact CG-CG2 3.94Å | ||
| 8 | L | 82.9 | Confident | 70 | Confident | 36 Ų | 36 | 98.3 Ų | 98.3 | 19% | 0.188 | 50% | 0.502 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.5 | 135.7 | -176.5 | -64.8 | 175.2 | 0 | 0 | 0 | 111.6 | S6 Q12 I13 Y445 Y458 | S6-L8 PolarHBondContact O-N 2.98Å; L8-Q12 VanDerWaalsContact CA-OE1 3.31Å; L8-Q12 HydrophobicContact CB-CB 4.24Å; L8-Q12 HydrophobicContact CD2-CB 4Å; L8-I13 HydrophobicContact CB-CD1 4.13Å; L8-I13 HydrophobicContact CB-CG1 3.82Å; L8-I13 HydrophobicContact CD1-CG1 4.37Å; L8-Y445 HydrophobicContact CD1-CE1 4.02Å; L8-Y458 PolarHBondContact N-O 2.8Å; L8-Y458 PolarHBondContact O-N 2.69Å |
| 9 | C | 84.9 | Confident | 70.3 | Confident | 16 Ų | 16 | 96.3 Ų | 96.3 | 11% | 0.108 | 49% | 0.49 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.5 | 158.4 | 171.3 | -177.1 | 0 | 0 | 0 | 0 | 110.9 | C11 Q12 I13 Q456 | C9-C11 PolarHBondContact O-N 2.98Å; C9-Q12 WeakPolarHBondContact O-CA 3.46Å; C9-Q12 WeakPolarHBondContact O-CB 3.47Å; C9-Q12 PolarHBondContact O-N 3.39Å; C9-I13 WeakPolarHBondContact O-CG1 3.21Å; C9-I13 PolarHBondContact O-N 3.05Å; C9-I13 VanDerWaalsContact O-N 3.16Å; C9-Q456 WeakPolarHBondContact CA-O 3.48Å |
| 10 | I | 82.4 | Confident | 70.3 | Confident | 29 Ų | 29 | 98.3 Ų | 98.3 | 15% | 0.149 | 50% | 0.496 | C | S | . | . | H | α-helix | trans | -47.9 | -36.2 | 173.7 | -141.8 | 168 | 0 | 0 | 0 | 113.1 | Q12 I13 C14 C21 A435 L438 Y458 | I10-Q12 VanDerWaalsContact C-N 3.31Å; I10-Q12 PolarHBondContact O-N 3.07Å; I10-I13 PolarHBondContact O-N 3Å; I10-C14 VanDerWaalsContact O-CB 3.29Å; I10-C14 WeakPolarHBondContact O-CB 3.32Å; I10-C14 PolarHBondContact O-N 2.89Å; I10-C14 VanDerWaalsContact O-N 3.08Å; I10-C21 HydrophobicContact CG2-CB 4.14Å; I10-A435 HydrophobicContact CG1-CB 4.38Å; I10-L438 HydrophobicContact CD1-CD1 3.96Å; I10-L438 HydrophobicContact CG1-CD1 3.53Å; I10-Y458 HydrophobicContact CB-CE2 4.3Å; I10-Y458 HydrophobicContact CG1-CE2 4.25Å |
| 11 | C | 77.2 | Confident | 70.3 | Confident | 55 Ų | 55 | 94 Ų | 94 | 37% | 0.372 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -65.1 | -32.9 | 177.2 | -58.3 | 0 | 0 | 0 | 0 | 113.3 | C9 C21 | C9-C11 PolarHBondContact O-N 2.98Å; C11-C21 WeakPolarHBondContact SG-CB 3.35Å; C11-C21 PolarHBondContact SG-N 2.66Å |
| 12 | Q | 81.1 | Confident | 71.6 | Confident | 124 Ų | 124 | 88.2 Ų | 88.2 | 58% | 0.579 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -84.6 | -22.1 | -179 | -66.8 | 173.6 | -39.5 | 0 | 0 | 111.8 | L8 C9 I10 | L8-Q12 VanDerWaalsContact CA-OE1 3.31Å; L8-Q12 HydrophobicContact CB-CB 4.24Å; L8-Q12 HydrophobicContact CD2-CB 4Å; C9-Q12 WeakPolarHBondContact O-CA 3.46Å; C9-Q12 WeakPolarHBondContact O-CB 3.47Å; C9-Q12 PolarHBondContact O-N 3.39Å; I10-Q12 VanDerWaalsContact C-N 3.31Å; I10-Q12 PolarHBondContact O-N 3.07Å |
| 13 | I | 82.3 | Confident | 72.7 | Confident | 2 Ų | 2 | 81.8 Ų | 81.8 | 1% | 0.01 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -85.9 | -18.2 | 175.7 | -58.1 | 166 | 0 | 0 | 0 | 110.8 | L8 C9 I10 N15 P434 A435 L438 Y445 Y458 | L8-I13 HydrophobicContact CB-CD1 4.13Å; L8-I13 HydrophobicContact CB-CG1 3.82Å; L8-I13 HydrophobicContact CD1-CG1 4.37Å; C9-I13 WeakPolarHBondContact O-CG1 3.21Å; C9-I13 PolarHBondContact O-N 3.05Å; C9-I13 VanDerWaalsContact O-N 3.16Å; I10-I13 PolarHBondContact O-N 3Å; I13-N15 PolarHBondContact O-N 2.91Å; I13-P434 HydrophobicContact CG2-CB 3.83Å; I13-P434 HydrophobicContact CG2-CG 4.38Å; I13-P434 WeakPolarHBondContact O-CG 3.47Å; I13-A435 HydrophobicContact CG2-CB 4.33Å; I13-L438 HydrophobicContact CD1-CD2 4.36Å; I13-L438 HydrophobicContact CG2-CD2 4.47Å; I13-Y445 HydrophobicContact CD1-CD1 4.1Å; I13-Y445 HydrophobicContact CD1-CD2 4.44Å; I13-Y445 HydrophobicContact CD1-CG 4.07Å; I13-Y445 HydrophobicContact CG1-CD1 4.42Å; I13-Y445 HydrophobicContact CG1-CE1 4.34Å; I13-Y445 HydrophobicContact CG1-CE2 4.47Å; I13-Y445 HydrophobicContact CG2-CD2 3.68Å; I13-Y445 HydrophobicContact CG2-CE2 3.6Å; I13-Y445 HydrophobicContact CG2-CG 4.37Å; I13-Y458 HydrophobicContact CD1-CD2 3.67Å; I13-Y458 HydrophobicContact CD1-CG 3.85Å |
| 14 | C | 81.7 | Confident | 73.1 | Confident | 18 Ų | 18 | 79.6 Ų | 79.6 | 12% | 0.122 | 42% | 0.42 | C | S | . | . | trans | -84.5 | 115.8 | -173.9 | 179.2 | 0 | 0 | 0 | 0 | 113.1 | I10 G17 H19 A435 | I10-C14 VanDerWaalsContact O-CB 3.29Å; I10-C14 WeakPolarHBondContact O-CB 3.32Å; I10-C14 PolarHBondContact O-N 2.89Å; I10-C14 VanDerWaalsContact O-N 3.08Å; C14-G17 PolarHBondContact SG-N 3.43Å; C14-G17 VanDerWaalsContact SG-N 3.39Å; C14-H19 HydrophobicContact CB-CB 3.88Å; C14-H19 PolarHBondContact SG-N 2.82Å; C14-H19 VanDerWaalsContact SG-N 3.39Å; C14-H19 PolarHBondContact SG-ND1 3.37Å; C14-A435 HydrophobicContact CB-CB 3.81Å | ||
| 15 | N | 79.9 | Confident | 73.1 | Confident | 134 Ų | 134 | 81.6 Ų | 81.6 | 72% | 0.717 | 43% | 0.426 | S | S | * | . | S | Bend | trans | -94.1 | -11.9 | 174.8 | -63.3 | 2.6 | 0 | 0 | 0 | 113.3 | I13 C433 | I13-N15 PolarHBondContact O-N 2.91Å; N15-C433 PolarHBondContact N-SG 3.04Å; N15-C433 VanDerWaalsContact N-SG 3.38Å |
| 16 | C | 76.8 | Confident | 72.8 | Confident | 57 Ų | 57 | 86.5 Ų | 86.5 | 39% | 0.385 | 43% | 0.433 | S | S | . | . | S | Bend | trans | -96.7 | -0.2 | -176.5 | 67.6 | 0 | 0 | 0 | 0 | 114.7 | R18 H19 C433 | C16-R18 PolarHBondContact O-N 3.01Å; C16-H19 VanDerWaalsContact SG-CE1 3.52Å; C16-H19 PolarHBondContact SG-ND1 2.85Å; C16-C433 HydrophobicContact CB-CB 3.95Å; C16-C433 PolarHBondContact SG-SG 2.92Å |
| 17 | G | 74.3 | Confident | 72 | Confident | 44 Ų | 44 | 92.8 Ų | 92.8 | 45% | 0.454 | 45% | 0.451 | S | S | . | . | S | Bend | trans | 67.2 | -5.6 | -177.6 | 0 | 0 | 0 | 0 | 0 | 116.6 | C14 K20 | C14-G17 PolarHBondContact SG-N 3.43Å; C14-G17 VanDerWaalsContact SG-N 3.39Å; G17-K20 WeakPolarHBondContact O-CE 3.39Å |
| 18 | R | 74.6 | Confident | 70.8 | Confident | 154 Ų | 154 | 91.5 Ų | 91.5 | 58% | 0.581 | 45% | 0.453 | S | S | * | . | trans | -86.7 | -27.7 | -176.9 | -63.4 | -175.9 | 178.2 | -152 | -2.5 | 114.1 | C16 K20 | C16-R18 PolarHBondContact O-N 3.01Å; R18-K20 PolarHBondContact O-N 2.85Å | ||
| 19 | H | 74.8 | Confident | 69.4 | Low | 59 Ų | 59 | 98.5 Ų | 98.5 | 27% | 0.273 | 49% | 0.485 | S | S | . | . | trans | -91.1 | 107.5 | 178.5 | -50.2 | 88.6 | 0 | 0 | 0 | 109.4 | C14 C16 A435 | C14-H19 HydrophobicContact CB-CB 3.88Å; C14-H19 PolarHBondContact SG-N 2.82Å; C14-H19 VanDerWaalsContact SG-N 3.39Å; C14-H19 PolarHBondContact SG-ND1 3.37Å; C16-H19 VanDerWaalsContact SG-CE1 3.52Å; C16-H19 PolarHBondContact SG-ND1 2.85Å; H19-A435 HydrophobicContact CB-CB 3.91Å | ||
| 20 | K | 70.7 | Confident | 67.8 | Low | 137 Ų | 137 | 104.6 Ų | 104.6 | 60% | 0.596 | 52% | 0.515 | S | S | * | . | trans | -118.1 | 138.4 | 178.8 | -63.3 | 177.2 | -173 | -71.8 | 0 | 108.5 | G17 R18 | G17-K20 WeakPolarHBondContact O-CE 3.39Å; R18-K20 PolarHBondContact O-N 2.85Å | ||
| 21 | C | 70.2 | Confident | 66.6 | Low | 9 Ų | 9 | 109.6 Ų | 109.6 | 6% | 0.061 | 55% | 0.547 | C | S | . | . | trans | -71.9 | 136.8 | 168.9 | -164.6 | 0 | 0 | 0 | 0 | 108.5 | I10 C11 H23 H455 | I10-C21 HydrophobicContact CG2-CB 4.14Å; C11-C21 WeakPolarHBondContact SG-CB 3.35Å; C11-C21 PolarHBondContact SG-N 2.66Å; C21-H23 PolarHBondContact O-N 3.21Å; C21-H455 PolarHBondContact SG-ND1 3.48Å | ||
| 22 | P | 67.9 | Low | 65.7 | Low | 113 Ų | 113 | 115.1 Ų | 115.1 | 73% | 0.734 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.2 | -16.4 | -179.3 | 11.7 | -25.9 | 0 | 0 | 0 | 115.3 | ||
| 23 | H | 60.8 | Low | 64.5 | Low | 116 Ų | 116 | 114.9 Ų | 114.9 | 54% | 0.537 | 57% | 0.574 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -111.5 | 12 | -166.2 | -64.4 | -71.2 | 0 | 0 | 0 | 117.3 | C21 T453 | C21-H23 PolarHBondContact O-N 3.21Å; H23-T453 WeakPolarHBondContact CB-O 3.46Å |
| 24 | Q | 57.5 | Low | 63.2 | Low | 112 Ų | 112 | 119.6 Ų | 119.6 | 52% | 0.523 | 61% | 0.606 | S | S | . | * | trans | -148.8 | 111.2 | 168.2 | -122 | 177.1 | 14.8 | 0 | 0 | 113.4 | R26 | Q24-R26 PolarHBondContact O-N 2.81Š| ||
| 25 | K | 51.6 | Low | 62.2 | Low | 214 Ų | 214 | 127 Ų | 127 | 93% | 0.93 | 64% | 0.639 | S | S | * | * | trans | -73.3 | 51.1 | 169.2 | -64.4 | -176.5 | -178.1 | 178.8 | 0 | 111.7 | K27 | K25-K27 PolarHBondContact O-N 3.33Å; K25-K27 VanDerWaalsContact O-N 3.07Å | ||
| 26 | R | 50.6 | Low | 61.4 | Low | 191 Ų | 191 | 124.8 Ų | 124.8 | 72% | 0.721 | 63% | 0.626 | S | S | * | * | trans | -68.7 | 107.8 | 168.7 | -88.2 | -172.7 | 169.5 | -159.5 | -1.5 | 108.3 | Q24 T28 | Q24-R26 PolarHBondContact O-N 2.81Å; R26-T28 PolarHBondContact O-N 2.84Å | ||
| 27 | K | 50.5 | Low | 61 | Low | 206 Ų | 206 | 125 Ų | 125 | 90% | 0.896 | 63% | 0.629 | S | S | * | * | trans | -64.8 | 92.9 | 169.2 | -75.7 | -178.6 | 176.5 | -179.9 | 0 | 108.2 | K25 Q29 | K25-K27 PolarHBondContact O-N 3.33Å; K25-K27 VanDerWaalsContact O-N 3.07Å; K27-Q29 PolarHBondContact O-N 2.93Å | ||
| 28 | T | 53.5 | Low | 60.9 | Low | 95 Ų | 95 | 130.2 Ų | 130.2 | 58% | 0.583 | 64% | 0.641 | S | S | * | * | trans | -73.4 | 115.2 | 163.8 | 46.8 | 0 | 0 | 0 | 0 | 107.5 | R26 I30 | R26-T28 PolarHBondContact O-N 2.84Å; T28-I30 PolarHBondContact O-N 3.41Å; T28-I30 VanDerWaalsContact O-N 3.14Å | ||
| 29 | Q | 53.9 | Low | 60.2 | Low | 184 Ų | 184 | 130.6 Ų | 130.6 | 86% | 0.86 | 64% | 0.643 | S | S | * | * | trans | -59.8 | 114.3 | 170.7 | -70 | 178.6 | -3.2 | 0 | 0 | 107.8 | K27 T31 | K27-Q29 PolarHBondContact O-N 2.93Å; Q29-T31 PolarHBondContact O-N 2.72Å; Q29-T31 PolarHBondContact O-OG1 2.85Å | ||
| 30 | I | 51.4 | Low | 59.7 | Low | 143 Ų | 143 | 131.9 Ų | 131.9 | 73% | 0.733 | 66% | 0.656 | S | S | * | * | trans | -78.5 | 100.1 | 178.2 | -63.4 | 170.5 | 0 | 0 | 0 | 106.4 | T28 K32 | T28-I30 PolarHBondContact O-N 3.41Å; T28-I30 VanDerWaalsContact O-N 3.14Å; I30-K32 WeakPolarHBondContact CG2-O 3.44Å; I30-K32 PolarHBondContact O-N 3.14Å | ||
| 31 | T | 58.2 | Low | 59.5 | Low | 135 Ų | 135 | 129.8 Ų | 129.8 | 83% | 0.828 | 65% | 0.654 | S | S | * | * | trans | -84.3 | 7.9 | -177 | -21.6 | 0 | 0 | 0 | 0 | 113.4 | Q29 | Q29-T31 PolarHBondContact O-N 2.72Å; Q29-T31 PolarHBondContact O-OG1 2.85Å | ||
| 32 | K | 58.5 | Low | 59.4 | Low | 170 Ų | 170 | 136.5 Ų | 136.5 | 74% | 0.739 | 69% | 0.685 | S | S | * | * | S | Bend | trans | -139.1 | 131.5 | 177.5 | -64.6 | -172.5 | 179.5 | -175.3 | 0 | 110.6 | I30 C34 | I30-K32 WeakPolarHBondContact CG2-O 3.44Å; I30-K32 PolarHBondContact O-N 3.14Å; K32-C34 PolarHBondContact O-N 3.4Å |
| 33 | P | 55.8 | Low | 59.4 | Low | 120 Ų | 120 | 137.6 Ų | 137.6 | 78% | 0.779 | 68% | 0.675 | S | S | * | * | trans | -57.9 | 134.8 | 177.1 | 23.7 | -31.1 | 0 | 0 | 0 | 110 | E35 | P33-E35 PolarHBondContact O-N 3.42Å; P33-E35 VanDerWaalsContact O-N 3.11Å | ||
| 34 | C | 54.2 | Low | 59.9 | Low | 100 Ų | 100 | 138.2 Ų | 138.2 | 68% | 0.676 | 68% | 0.681 | S | S | * | * | trans | -68.9 | 106.9 | -177.8 | -160.8 | 0 | 0 | 0 | 0 | 109 | K32 I36 | K32-C34 PolarHBondContact O-N 3.4Å; C34-I36 PolarHBondContact O-N 3.21Å | ||
| 35 | E | 60.2 | Low | 60.2 | Low | 175 Ų | 175 | 136.7 Ų | 136.7 | 82% | 0.818 | 69% | 0.688 | S | S | * | * | trans | -70.9 | 5.7 | -178.3 | -65.3 | 178.5 | 170.3 | 0 | 0 | 114.1 | P33 | P33-E35 PolarHBondContact O-N 3.42Å; P33-E35 VanDerWaalsContact O-N 3.11Å | ||
| 36 | I | 63.2 | Low | 60.7 | Low | 87 Ų | 87 | 133.5 Ų | 133.5 | 45% | 0.446 | 68% | 0.676 | S | S | . | * | trans | -110.9 | 95.2 | -179.6 | -53.5 | 164.2 | 0 | 0 | 0 | 107.5 | C34 T41 | C34-I36 PolarHBondContact O-N 3.21Å; I36-T41 HydrophobicContact CG2-CG2 4.16Å | ||
| 37 | S | 68.8 | Low | 61.6 | Low | 62 Ų | 62 | 133.8 Ų | 133.8 | 43% | 0.434 | 68% | 0.682 | S | S | . | * | trans | -84.6 | 157.5 | 169.8 | 59.2 | 0 | 0 | 0 | 0 | 110.5 | Y39 T40 | S37-Y39 PolarHBondContact O-N 3.06Å; S37-T40 PolarHBondContact O-N 3.46Å; S37-T40 PolarHBondContact O-OG1 3.08Å | ||
| 38 | E | 71.3 | Confident | 62 | Low | 152 Ų | 152 | 132 Ų | 132 | 71% | 0.71 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -52.8 | -30.4 | 173.1 | -70.1 | -178.6 | 158.1 | 0 | 0 | 112 | T40 T41 Q42 | E38-T40 PolarHBondContact O-N 3.4Å; E38-T41 PolarHBondContact O-N 3.03Å; E38-T41 VanDerWaalsContact O-N 3.13Å; E38-T41 PolarHBondContact O-OG1 2.94Å; E38-Q42 PolarHBondContact O-N 2.81Å |
| 39 | Y | 60.6 | Low | 62.8 | Low | 162 Ų | 162 | 134.1 Ų | 134.1 | 64% | 0.635 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -56.5 | -42.7 | 174.9 | -173 | -99.1 | 0 | 0 | 0 | 113.1 | S37 T41 Q42 Y43 | S37-Y39 PolarHBondContact O-N 3.06Å; Y39-T41 VanDerWaalsContact C-N 3.29Å; Y39-T41 PolarHBondContact O-N 3.35Å; Y39-Q42 PolarHBondContact O-N 3.16Å; Y39-Y43 HydrophobicContact CE1-CD2 4.31Å; Y39-Y43 HydrophobicContact CE2-CD2 4.44Å; Y39-Y43 AromaticContact CZ-CD2 3.93Å; Y39-Y43 VanDerWaalsContact O-CB 3.3Å; Y39-Y43 WeakPolarHBondContact O-CB 3.37Å; Y39-Y43 PolarHBondContact O-N 3.16Å; Y39-Y43 VanDerWaalsContact O-N 3.08Å |
| 40 | T | 64.4 | Low | 63.2 | Low | 86 Ų | 86 | 130.6 Ų | 130.6 | 53% | 0.528 | 68% | 0.681 | S | S | . | * | H | α-helix | trans | -72.9 | -22.3 | 179 | 51.3 | 0 | 0 | 0 | 0 | 113.1 | S37 E38 | S37-T40 PolarHBondContact O-N 3.46Å; S37-T40 PolarHBondContact O-OG1 3.08Å; E38-T40 PolarHBondContact O-N 3.4Å |
| 41 | T | 66.5 | Low | 64.1 | Low | 93 Ų | 93 | 130.4 Ų | 130.4 | 57% | 0.571 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -87.4 | -23.7 | 177.1 | 54.4 | 0 | 0 | 0 | 0 | 114.1 | I36 E38 Y39 | I36-T41 HydrophobicContact CG2-CG2 4.16Å; E38-T41 PolarHBondContact O-N 3.03Å; E38-T41 VanDerWaalsContact O-N 3.13Å; E38-T41 PolarHBondContact O-OG1 2.94Å; Y39-T41 VanDerWaalsContact C-N 3.29Å; Y39-T41 PolarHBondContact O-N 3.35Å |
| 42 | Q | 68.8 | Low | 64.5 | Low | 150 Ų | 150 | 132.1 Ų | 132.1 | 70% | 0.701 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -107.3 | -4.8 | -177.3 | -66.2 | -176.6 | 1.6 | 0 | 0 | 114 | E38 Y39 I44 | E38-Q42 PolarHBondContact O-N 2.81Å; Y39-Q42 PolarHBondContact O-N 3.16Å; Q42-I44 PolarHBondContact O-N 3.29Å; Q42-I44 VanDerWaalsContact O-N 3.16Å |
| 43 | Y | 67.5 | Low | 65.2 | Low | 137 Ų | 137 | 128.4 Ų | 128.4 | 54% | 0.537 | 68% | 0.68 | S | S | . | * | trans | -67.1 | 114 | -179 | -174.1 | -101.5 | 0 | 0 | 0 | 112 | Y39 A45 | Y39-Y43 HydrophobicContact CE1-CD2 4.31Å; Y39-Y43 HydrophobicContact CE2-CD2 4.44Å; Y39-Y43 AromaticContact CZ-CD2 3.93Å; Y39-Y43 VanDerWaalsContact O-CB 3.3Å; Y39-Y43 WeakPolarHBondContact O-CB 3.37Å; Y39-Y43 PolarHBondContact O-N 3.16Å; Y39-Y43 VanDerWaalsContact O-N 3.08Å; Y43-A45 HydrophobicContact CE1-CB 4.24Å; Y43-A45 PolarHBondContact O-N 3.41Å | ||
| 44 | I | 71 | Confident | 65.7 | Low | 129 Ų | 129 | 129.1 Ų | 129.1 | 66% | 0.662 | 69% | 0.687 | S | S | * | * | trans | -82 | 110.7 | 169.4 | -58.8 | 171.4 | 0 | 0 | 0 | 107.1 | Q42 H46 | Q42-I44 PolarHBondContact O-N 3.29Å; Q42-I44 VanDerWaalsContact O-N 3.16Å; I44-H46 PolarHBondContact O-CD2 2.99Å; I44-H46 PolarHBondContact O-N 3.4Å | ||
| 45 | A | 63.8 | Low | 66.4 | Low | 80 Ų | 80 | 132.3 Ų | 132.3 | 66% | 0.661 | 69% | 0.689 | S | S | * | * | trans | -64.8 | 99.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | Y43 K47 | Y43-A45 HydrophobicContact CE1-CB 4.24Å; Y43-A45 PolarHBondContact O-N 3.41Å; A45-K47 PolarHBondContact O-N 2.79Å | ||
| 46 | H | 62.7 | Low | 66.6 | Low | 147 Ų | 147 | 129 Ų | 129 | 68% | 0.681 | 68% | 0.683 | S | S | * | * | trans | -65.2 | 129.8 | 167.9 | -67.2 | -79.5 | 0 | 0 | 0 | 108.8 | I44 L48 | I44-H46 PolarHBondContact O-CD2 2.99Å; I44-H46 PolarHBondContact O-N 3.4Å; H46-L48 PolarHBondContact O-N 3.39Å | ||
| 47 | K | 68.7 | Low | 66.6 | Low | 196 Ų | 196 | 130.3 Ų | 130.3 | 85% | 0.852 | 70% | 0.697 | S | S | * | * | trans | -60.5 | 113.2 | 173 | -66.9 | -178.2 | -179.1 | -178.7 | 0 | 107.8 | A45 I49 | A45-K47 PolarHBondContact O-N 2.79Å; K47-I49 VanDerWaalsContact C-N 3.3Å; K47-I49 PolarHBondContact O-N 3.39Å | ||
| 48 | L | 59.5 | Low | 66 | Low | 170 Ų | 170 | 135.6 Ų | 135.6 | 89% | 0.89 | 71% | 0.714 | S | S | * | * | trans | -67.9 | 93.5 | 169.5 | -67.9 | 171.7 | 0 | 0 | 0 | 107.1 | H46 | H46-L48 PolarHBondContact O-N 3.39Š| ||
| 49 | I | 69.3 | Low | 65.4 | Low | 139 Ų | 139 | 137.1 Ų | 137.1 | 71% | 0.713 | 72% | 0.719 | S | S | * | * | trans | -75.6 | 123.4 | 169.1 | -54.6 | 170.4 | 0 | 0 | 0 | 105.4 | K47 V51 | K47-I49 VanDerWaalsContact C-N 3.3Å; K47-I49 PolarHBondContact O-N 3.39Å; I49-V51 PolarHBondContact O-N 3.43Å | ||
| 50 | P | 63.7 | Low | 64.9 | Low | 109 Ų | 109 | 131.8 Ų | 131.8 | 71% | 0.708 | 71% | 0.713 | S | S | * | * | trans | -51.2 | 130.9 | 173.5 | -23.4 | 32.4 | 0 | 0 | 0 | 109.4 | E52 | P50-E52 PolarHBondContact O-N 3.38Š| ||
| 51 | V | 70.3 | Confident | 64.1 | Low | 139 Ų | 139 | 134 Ų | 134 | 84% | 0.842 | 73% | 0.726 | S | S | * | * | trans | -59.2 | 112.4 | 175.9 | 177.4 | 0 | 0 | 0 | 0 | 107.3 | I49 S53 | I49-V51 PolarHBondContact O-N 3.43Å; V51-S53 PolarHBondContact O-N 3.47Å | ||
| 52 | E | 66.4 | Low | 63.2 | Low | 171 Ų | 171 | 137 Ų | 137 | 80% | 0.799 | 73% | 0.734 | S | S | * | * | trans | -59.5 | 133.2 | 175.3 | -66.8 | -164.1 | 172.6 | 0 | 0 | 108.8 | P50 C54 | P50-E52 PolarHBondContact O-N 3.38Å; E52-C54 PolarHBondContact O-N 3.25Å | ||
| 53 | S | 72 | Confident | 62.3 | Low | 92 Ų | 92 | 134.5 Ų | 134.5 | 64% | 0.643 | 74% | 0.738 | S | S | * | * | trans | -60.6 | 129.6 | -178.2 | 73.1 | 0 | 0 | 0 | 0 | 109.6 | V51 K55 | V51-S53 PolarHBondContact O-N 3.47Å; S53-K55 PolarHBondContact O-N 3.49Å | ||
| 54 | C | 67.8 | Low | 61.4 | Low | 135 Ų | 135 | 136.1 Ų | 136.1 | 91% | 0.912 | 75% | 0.751 | S | S | * | * | S | Bend | trans | -66.6 | 6.7 | 169.9 | -51.4 | 0 | 0 | 0 | 0 | 113.1 | E52 | E52-C54 PolarHBondContact O-N 3.25Š|
| 55 | K | 67.5 | Low | 60.5 | Low | 167 Ų | 167 | 132.7 Ų | 132.7 | 73% | 0.726 | 75% | 0.748 | S | S | * | * | S | Bend | trans | -79.3 | 125.2 | 176 | -159.6 | 175.2 | -175.4 | -178.1 | 0 | 107.5 | S53 | S53-K55 PolarHBondContact O-N 3.49Š|
| 56 | P | 66 | Low | 60.4 | Low | 106 Ų | 106 | 137.9 Ų | 137.9 | 69% | 0.688 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 135.1 | 176.4 | 19.9 | -29.2 | 0 | 0 | 0 | 109.1 | H58 | P56-H58 PolarHBondContact O-N 3.48Š|
| 57 | P | 61.4 | Low | 60.1 | Low | 114 Ų | 114 | 138.6 Ų | 138.6 | 74% | 0.74 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 133.8 | 179.7 | 22.6 | -32.3 | 0 | 0 | 0 | 108.3 | K59 | P57-K59 VanDerWaalsContact C-N 3.29Å; P57-K59 PolarHBondContact O-N 3.46Å |
| 58 | H | 57.3 | Low | 59.6 | Low | 173 Ų | 173 | 133.3 Ų | 133.3 | 80% | 0.801 | 76% | 0.756 | S | S | * | * | trans | -59.3 | 98.5 | 174.5 | 179.6 | -82 | 0 | 0 | 0 | 107.1 | P56 G60 | P56-H58 PolarHBondContact O-N 3.48Å; H58-G60 VanDerWaalsContact C-N 3.3Å; H58-G60 PolarHBondContact O-N 3.09Å | ||
| 59 | K | 59.3 | Low | 59.8 | Low | 185 Ų | 185 | 129 Ų | 129 | 80% | 0.804 | 74% | 0.74 | S | S | * | * | trans | -59.6 | 104.3 | 165.9 | -69.8 | -175 | 179.7 | -176.5 | 0 | 104.4 | P57 V61 | P57-K59 VanDerWaalsContact C-N 3.29Å; P57-K59 PolarHBondContact O-N 3.46Å; K59-V61 PolarHBondContact O-N 3.26Å | ||
| 60 | G | 49.2 | Very low | 59.8 | Low | 50 Ų | 50 | 127.1 Ų | 127.1 | 52% | 0.515 | 73% | 0.732 | S | S | . | * | trans | -50.3 | 111.5 | 164.1 | 0 | 0 | 0 | 0 | 0 | 105.3 | H58 Q62 | H58-G60 VanDerWaalsContact C-N 3.3Å; H58-G60 PolarHBondContact O-N 3.09Å; G60-Q62 PolarHBondContact O-N 2.95Å | ||
| 61 | V | 48.3 | Very low | 60.3 | Low | 133 Ų | 133 | 125.8 Ų | 125.8 | 81% | 0.806 | 72% | 0.722 | S | S | * | * | trans | -58.5 | 102.5 | 172.4 | 176.5 | 0 | 0 | 0 | 0 | 103.7 | K59 A63 | K59-V61 PolarHBondContact O-N 3.26Å; V61-A63 PolarHBondContact O-N 3.37Å | ||
| 62 | Q | 46.1 | Very low | 60.5 | Low | 155 Ų | 155 | 124.6 Ų | 124.6 | 72% | 0.724 | 72% | 0.715 | S | S | * | * | trans | -56.8 | 115.8 | 172 | -74.2 | -178.4 | -24.2 | 0 | 0 | 104.9 | G60 E64 | G60-Q62 PolarHBondContact O-N 2.95Å; Q62-E64 PolarHBondContact O-N 3.11Å | ||
| 63 | A | 49.9 | Very low | 61 | Low | 97 Ų | 97 | 122.2 Ų | 122.2 | 80% | 0.802 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -72.9 | 37.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | V61 G65 | V61-A63 PolarHBondContact O-N 3.37Å; A63-G65 VanDerWaalsContact C-N 3.28Å; A63-G65 PolarHBondContact O-N 3.06Å |
| 64 | E | 48.7 | Very low | 61.2 | Low | 172 Ų | 172 | 125.4 Ų | 125.4 | 80% | 0.804 | 70% | 0.701 | S | S | * | * | trans | -98.8 | 59.6 | 173.3 | -71.1 | 172.4 | 178.7 | 0 | 0 | 107.4 | Q62 | Q62-E64 PolarHBondContact O-N 3.11Š| ||
| 65 | G | 53.3 | Low | 61.7 | Low | 57 Ų | 57 | 123.3 Ų | 123.3 | 59% | 0.588 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -162.8 | 121.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 107.3 | A63 M67 | A63-G65 VanDerWaalsContact C-N 3.28Å; A63-G65 PolarHBondContact O-N 3.06Å; G65-M67 PolarHBondContact O-N 3.5Å; G65-M67 VanDerWaalsContact O-N 3.13Å |
| 66 | H | 61.2 | Low | 62.2 | Low | 189 Ų | 189 | 120.6 Ų | 120.6 | 88% | 0.875 | 68% | 0.678 | S | S | * | * | trans | -51.3 | 122.8 | 178.4 | -151.3 | -78.5 | 0 | 0 | 0 | 108.4 | A68 | H66-A68 PolarHBondContact O-N 2.82Š| ||
| 67 | M | 56.3 | Low | 62.4 | Low | 161 Ų | 161 | 122.8 Ų | 122.8 | 79% | 0.793 | 68% | 0.677 | S | S | * | * | trans | -51.4 | 117.5 | 178.4 | -173.6 | -174.4 | -156.2 | 0 | 0 | 107.5 | G65 S69 | G65-M67 PolarHBondContact O-N 3.5Å; G65-M67 VanDerWaalsContact O-N 3.13Å; M67-S69 VanDerWaalsContact C-N 3.28Å; M67-S69 PolarHBondContact O-N 3.47Å | ||
| 68 | A | 57.7 | Low | 63.1 | Low | 85 Ų | 85 | 121 Ų | 121 | 70% | 0.702 | 66% | 0.664 | S | S | * | * | trans | -65.4 | 97.3 | 172.1 | 0 | 0 | 0 | 0 | 0 | 106.5 | H66 D70 | H66-A68 PolarHBondContact O-N 2.82Å; A68-D70 PolarHBondContact O-N 3.05Å | ||
| 69 | S | 64.7 | Low | 63.9 | Low | 80 Ų | 80 | 118.5 Ų | 118.5 | 56% | 0.559 | 66% | 0.663 | S | S | * | * | trans | -63.4 | -4.9 | 177.6 | -74.9 | 0 | 0 | 0 | 0 | 113.2 | M67 R74 | M67-S69 VanDerWaalsContact C-N 3.28Å; M67-S69 PolarHBondContact O-N 3.47Å; S69-R74 PolarHBondContact O-NH1 2.89Å | ||
| 70 | D | 69.1 | Low | 64.3 | Low | 99 Ų | 99 | 116.7 Ų | 116.7 | 53% | 0.529 | 66% | 0.657 | S | S | . | * | trans | -93.8 | 103.9 | 176.8 | -60.6 | -32.5 | 0 | 0 | 0 | 109 | A68 R74 V75 | A68-D70 PolarHBondContact O-N 3.05Å; D70-R74 HydrophobicContact CB-CB 4.25Å; D70-V75 HydrophobicContact CB-CG2 3.76Å | ||
| 71 | T | 74 | Confident | 65 | Low | 82 Ų | 82 | 120 Ų | 120 | 50% | 0.503 | 67% | 0.669 | S | S | . | * | trans | -60.3 | 153.9 | 168.6 | 56.5 | 0 | 0 | 0 | 0 | 109.4 | H73 R74 V75 | T71-H73 CarbonylContact O-C 3.6Å; T71-H73 PolarHBondContact O-N 2.58Å; T71-R74 WeakPolarHBondContact O-CA 3.33Å; T71-R74 WeakPolarHBondContact O-CB 3.29Å; T71-R74 PolarHBondContact O-N 3.07Å; T71-R74 PolarHBondContact OG1-N 2.92Å; T71-V75 PolarHBondContact O-N 3.07Å; T71-V75 VanDerWaalsContact O-N 3.12Å | ||
| 72 | T | 74.6 | Confident | 65.7 | Low | 114 Ų | 114 | 121.6 Ų | 121.6 | 70% | 0.699 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -49.6 | -37.9 | 174.9 | 50.5 | 0 | 0 | 0 | 0 | 111.3 | R74 V75 D76 | T72-R74 PolarHBondContact O-N 3.16Å; T72-V75 PolarHBondContact O-N 3.16Å; T72-D76 WeakPolarHBondContact O-CB 3.47Å; T72-D76 PolarHBondContact O-N 3.23Å; T72-D76 VanDerWaalsContact O-OD2 3.1Å |
| 73 | H | 76.8 | Confident | 66.3 | Low | 120 Ų | 120 | 118.8 Ų | 118.8 | 56% | 0.556 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -60.4 | -40.6 | 172.1 | -172.5 | -53.4 | 0 | 0 | 0 | 114.1 | T71 V75 F77 | T71-H73 CarbonylContact O-C 3.6Å; T71-H73 PolarHBondContact O-N 2.58Å; H73-V75 VanDerWaalsContact C-N 3.33Å; H73-F77 WeakPolarHBondContact O-CB 3.49Å; H73-F77 PolarHBondContact O-N 3.01Å |
| 74 | R | 75.9 | Confident | 66.4 | Low | 159 Ų | 159 | 121.2 Ų | 121.2 | 60% | 0.6 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -68.8 | -31.8 | 177.3 | -85.8 | -177.6 | 135.2 | 162.5 | -4.5 | 112.8 | S69 D70 T71 T72 V78 | S69-R74 PolarHBondContact O-NH1 2.89Å; D70-R74 HydrophobicContact CB-CB 4.25Å; T71-R74 WeakPolarHBondContact O-CA 3.33Å; T71-R74 WeakPolarHBondContact O-CB 3.29Å; T71-R74 PolarHBondContact O-N 3.07Å; T71-R74 PolarHBondContact OG1-N 2.92Å; T72-R74 PolarHBondContact O-N 3.16Å; R74-V78 WeakPolarHBondContact O-CG2 3.31Å |
| 75 | V | 78.5 | Confident | 66.2 | Low | 91 Ų | 91 | 119.4 Ų | 119.4 | 55% | 0.552 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -78.9 | -40.3 | 176.9 | -177.6 | 0 | 0 | 0 | 0 | 111 | D70 T71 T72 H73 | D70-V75 HydrophobicContact CB-CG2 3.76Å; T71-V75 PolarHBondContact O-N 3.07Å; T71-V75 VanDerWaalsContact O-N 3.12Å; T72-V75 PolarHBondContact O-N 3.16Å; H73-V75 VanDerWaalsContact C-N 3.33Å |
| 76 | D | 78 | Confident | 66.2 | Low | 111 Ų | 111 | 124.4 Ų | 124.4 | 59% | 0.594 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -83.8 | -29.5 | -173.8 | -62.4 | -23.4 | 0 | 0 | 0 | 112.9 | T72 | T72-D76 WeakPolarHBondContact O-CB 3.47Å; T72-D76 PolarHBondContact O-N 3.23Å; T72-D76 VanDerWaalsContact O-OD2 3.1Å |
| 77 | F | 71 | Confident | 65.8 | Low | 152 Ų | 152 | 119.3 Ų | 119.3 | 67% | 0.667 | 66% | 0.658 | S | S | * | * | trans | -115.4 | 61.1 | -178 | -69.9 | -94.1 | 0 | 0 | 0 | 112 | H73 | H73-F77 WeakPolarHBondContact O-CB 3.49Å; H73-F77 PolarHBondContact O-N 3.01Å | ||
| 78 | V | 74.9 | Confident | 65.1 | Low | 77 Ų | 77 | 116.6 Ų | 116.6 | 47% | 0.467 | 65% | 0.654 | S | S | . | * | trans | -81.2 | 131.7 | 170 | -169.9 | 0 | 0 | 0 | 0 | 108.8 | R74 H80 | R74-V78 WeakPolarHBondContact O-CG2 3.31Å; V78-H80 PolarHBondContact O-N 3.11Å | ||
| 79 | P | 73.6 | Confident | 64.5 | Low | 120 Ų | 120 | 122.7 Ų | 122.7 | 78% | 0.779 | 66% | 0.659 | S | S | * | * | trans | -64.6 | 100.7 | 175 | 7.4 | -3.3 | 0 | 0 | 0 | 109.6 | ||||
| 80 | H | 68.2 | Low | 64.2 | Low | 147 Ų | 147 | 128.2 Ų | 128.2 | 68% | 0.681 | 67% | 0.673 | S | S | * | * | trans | -69 | 127.3 | 172.2 | -64.6 | -61.4 | 0 | 0 | 0 | 108.4 | V78 L82 | V78-H80 PolarHBondContact O-N 3.11Å; H80-L82 PolarHBondContact O-N 3.05Å | ||
| 81 | P | 64.9 | Low | 63.7 | Low | 119 Ų | 119 | 132.6 Ų | 132.6 | 77% | 0.773 | 69% | 0.69 | S | S | * | * | trans | -57.2 | 118.2 | 170.2 | 24 | -30.6 | 0 | 0 | 0 | 106.4 | S83 | P81-S83 PolarHBondContact O-N 3.43Š| ||
| 82 | L | 62.2 | Low | 63 | Low | 167 Ų | 167 | 132.1 Ų | 132.1 | 87% | 0.874 | 70% | 0.695 | S | S | * | * | trans | -61.6 | 93.2 | 172 | -63.4 | 175.9 | 0 | 0 | 0 | 105.3 | H80 I84 | H80-L82 PolarHBondContact O-N 3.05Å; L82-I84 PolarHBondContact O-N 3.41Å | ||
| 83 | S | 57.8 | Low | 62.7 | Low | 96 Ų | 96 | 135.6 Ų | 135.6 | 67% | 0.671 | 70% | 0.703 | S | S | * | * | trans | -56.4 | 116.3 | 164.9 | 61.7 | 0 | 0 | 0 | 0 | 103.6 | P81 Q85 | P81-S83 PolarHBondContact O-N 3.43Å; S83-Q85 PolarHBondContact O-N 3.08Å | ||
| 84 | I | 52.8 | Low | 62.4 | Low | 148 Ų | 148 | 138.7 Ų | 138.7 | 76% | 0.759 | 71% | 0.711 | S | S | * | * | trans | -50.2 | 104.6 | 173.3 | -62.3 | 165.4 | 0 | 0 | 0 | 103.4 | L82 N86 | L82-I84 PolarHBondContact O-N 3.41Å; I84-N86 PolarHBondContact O-N 3.49Å | ||
| 85 | Q | 45.1 | Very low | 62.3 | Low | 133 Ų | 133 | 139.6 Ų | 139.6 | 62% | 0.621 | 72% | 0.722 | S | S | * | * | trans | -62.4 | 118.7 | -179.3 | -73.4 | -141.7 | -25.2 | 0 | 0 | 104.5 | S83 S87 C88 | S83-Q85 PolarHBondContact O-N 3.08Å; Q85-S87 WeakPolarHBondContact CB-OG 3.38Å; Q85-S87 PolarHBondContact O-N 3.4Å; Q85-S87 PolarHBondContact OE1-OG 2.81Å; Q85-C88 PolarHBondContact O-N 3.13Å | ||
| 86 | N | 52.9 | Low | 62.2 | Low | 162 Ų | 162 | 139.3 Ų | 139.3 | 87% | 0.866 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.7 | -3.6 | 169.9 | -65.4 | -18.3 | 0 | 0 | 0 | 111.3 | I84 | I84-N86 PolarHBondContact O-N 3.49Š|
| 87 | S | 52.7 | Low | 61.9 | Low | 83 Ų | 83 | 138.9 Ų | 138.9 | 58% | 0.58 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.1 | -13.7 | 170.3 | 76.2 | 0 | 0 | 0 | 0 | 114.4 | Q85 R89 | Q85-S87 WeakPolarHBondContact CB-OG 3.38Å; Q85-S87 PolarHBondContact O-N 3.4Å; Q85-S87 PolarHBondContact OE1-OG 2.81Å; S87-R89 PolarHBondContact O-N 3.03Å |
| 88 | C | 42.2 | Very low | 62.2 | Low | 104 Ų | 104 | 141.4 Ų | 141.4 | 70% | 0.703 | 74% | 0.739 | S | S | * | * | S | Bend | trans | -71.9 | 82.8 | 164.1 | -154.5 | 0 | 0 | 0 | 0 | 106.4 | Q85 K90 | Q85-C88 PolarHBondContact O-N 3.13Å; C88-K90 PolarHBondContact O-N 3.5Å |
| 89 | R | 45.7 | Very low | 62.1 | Low | 212 Ų | 212 | 140.7 Ų | 140.7 | 80% | 0.8 | 75% | 0.747 | S | S | * | * | trans | -42.9 | 111 | 174 | -176.8 | 179.3 | -173.9 | 175.8 | 1.8 | 106.4 | S87 E91 | S87-R89 PolarHBondContact O-N 3.03Å; R89-E91 PolarHBondContact O-N 3.25Å | ||
| 90 | K | 57.2 | Low | 62 | Low | 197 Ų | 197 | 141.3 Ų | 141.3 | 86% | 0.857 | 75% | 0.749 | S | S | * | * | trans | -44.4 | 120 | 170.8 | -69.8 | -177.4 | 179.4 | 179.6 | 0 | 105.7 | C88 A92 | C88-K90 PolarHBondContact O-N 3.5Å; K90-A92 PolarHBondContact O-N 2.87Å | ||
| 91 | E | 57.7 | Low | 62.5 | Low | 190 Ų | 190 | 143.6 Ų | 143.6 | 89% | 0.888 | 76% | 0.757 | S | S | * | * | trans | -44.8 | 110.8 | -179.9 | -75 | 178.8 | 164.3 | 0 | 0 | 107.1 | R89 Q93 | R89-E91 PolarHBondContact O-N 3.25Å; E91-Q93 PolarHBondContact O-N 2.92Å | ||
| 92 | A | 59.6 | Low | 62.9 | Low | 73 Ų | 73 | 144.1 Ų | 144.1 | 60% | 0.603 | 75% | 0.754 | S | S | * | * | trans | -59.6 | 121 | -178.2 | 0 | 0 | 0 | 0 | 0 | 105.6 | K90 Y94 | K90-A92 PolarHBondContact O-N 2.87Å; A92-Y94 PolarHBondContact O-N 3.38Å | ||
| 93 | Q | 69.7 | Low | 63.6 | Low | 187 Ų | 187 | 138.1 Ų | 138.1 | 87% | 0.874 | 73% | 0.732 | S | S | * | * | trans | -49.1 | 115.3 | 176.7 | -81.5 | 179.3 | -15.5 | 0 | 0 | 107.8 | E91 Q95 | E91-Q93 PolarHBondContact O-N 2.92Å; Q93-Q95 PolarHBondContact O-N 3.4Å; Q93-Q95 VanDerWaalsContact O-N 3.07Å | ||
| 94 | Y | 70 | Confident | 64.8 | Low | 185 Ų | 185 | 138.7 Ų | 138.7 | 73% | 0.725 | 73% | 0.727 | S | S | * | * | trans | -56.5 | 116.3 | -177.6 | 171.2 | -104.6 | 0 | 0 | 0 | 109 | A92 P96 P97 | A92-Y94 PolarHBondContact O-N 3.38Å; Y94-P96 HydrophobicContact CD1-CB 4.49Å; Y94-P96 HydrophobicContact CE1-CB 3.77Å; Y94-P96 WeakPolarHBondContact O-CD 3.1Å; Y94-P97 WeakPolarHBondContact OH-CD 3.43Å | ||
| 95 | Q | 74.4 | Confident | 66 | Low | 177 Ų | 177 | 135.3 Ų | 135.3 | 83% | 0.827 | 71% | 0.714 | S | S | * | * | trans | -90.1 | 109.6 | 168.4 | -68.7 | -165.3 | 6 | 0 | 0 | 107.7 | Q93 | Q93-Q95 PolarHBondContact O-N 3.4Å; Q93-Q95 VanDerWaalsContact O-N 3.07Å | ||
| 96 | P | 75.4 | Confident | 67.8 | Low | 86 Ų | 86 | 134.2 Ų | 134.2 | 56% | 0.558 | 72% | 0.716 | S | S | * | * | trans | -59.5 | 139.7 | 175.2 | 24 | -31.6 | 0 | 0 | 0 | 109.5 | Y94 Q98 | Y94-P96 HydrophobicContact CD1-CB 4.49Å; Y94-P96 HydrophobicContact CE1-CB 3.77Å; Y94-P96 WeakPolarHBondContact O-CD 3.1Å; P96-Q98 PolarHBondContact O-N 2.99Å | ||
| 97 | P | 72.4 | Confident | 69.2 | Low | 101 Ų | 101 | 133.9 Ų | 133.9 | 66% | 0.656 | 70% | 0.704 | S | S | * | * | trans | -57.7 | 129.1 | 176.6 | 23.1 | -31.5 | 0 | 0 | 0 | 109.3 | Y94 G99 | Y94-P97 WeakPolarHBondContact OH-CD 3.43Å; P97-G99 PolarHBondContact O-N 3.48Å | ||
| 98 | Q | 76.7 | Confident | 70.6 | Confident | 206 Ų | 206 | 133.3 Ų | 133.3 | 96% | 0.963 | 70% | 0.697 | S | S | * | * | trans | -72.6 | 20.8 | 178.5 | -66.1 | -132.6 | -19.8 | 0 | 0 | 113.7 | P96 | P96-Q98 PolarHBondContact O-N 2.99Š| ||
| 99 | G | 73 | Confident | 72.5 | Confident | 61 Ų | 61 | 135.9 Ų | 135.9 | 63% | 0.629 | 70% | 0.696 | S | S | * | * | trans | -89.4 | 120.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | P97 F101 | P97-G99 PolarHBondContact O-N 3.48Å; G99-F101 PolarHBondContact O-N 3.16Å | ||
| 100 | T | 72.2 | Confident | 74.1 | Confident | 134 Ų | 134 | 133.3 Ų | 133.3 | 82% | 0.822 | 69% | 0.693 | S | S | * | * | trans | -66.9 | 124 | 164.6 | 50.8 | 0 | 0 | 0 | 0 | 109 | D102 | T100-D102 PolarHBondContact O-N 3.44Š| ||
| 101 | F | 77.2 | Confident | 74.9 | Confident | 194 Ų | 194 | 132.3 Ų | 132.3 | 85% | 0.851 | 69% | 0.685 | S | S | * | * | trans | -65.6 | 113.9 | 170.9 | 175 | -111.9 | 0 | 0 | 0 | 108.7 | G99 G103 | G99-F101 PolarHBondContact O-N 3.16Å; F101-G103 VanDerWaalsContact CE1-CA 3.49Å; F101-G103 PolarHBondContact O-N 3.14Å; F101-G103 VanDerWaalsContact O-N 3.1Å | ||
| 102 | D | 73.6 | Confident | 75.7 | Confident | 130 Ų | 130 | 127 Ų | 127 | 70% | 0.695 | 67% | 0.666 | S | S | * | * | trans | -64.4 | -18.2 | -172.3 | -154.1 | 14.8 | 0 | 0 | 0 | 112.2 | T100 L104 | T100-D102 PolarHBondContact O-N 3.44Å; D102-L104 WeakPolarHBondContact O-CG 3.39Å; D102-L104 PolarHBondContact O-N 3.23Å | ||
| 103 | G | 77.8 | Confident | 76.3 | Confident | 42 Ų | 42 | 127.1 Ų | 127.1 | 43% | 0.433 | 67% | 0.674 | S | S | . | * | trans | 61.8 | -1.9 | 170 | 0 | 0 | 0 | 0 | 0 | 116.1 | F101 T105 | F101-G103 VanDerWaalsContact CE1-CA 3.49Å; F101-G103 PolarHBondContact O-N 3.14Å; F101-G103 VanDerWaalsContact O-N 3.1Å; G103-T105 PolarHBondContact O-N 3.12Å | ||
| 104 | L | 81.9 | Confident | 76.4 | Confident | 108 Ų | 108 | 126.5 Ų | 126.5 | 57% | 0.565 | 67% | 0.669 | S | S | * | * | trans | -84 | 104.4 | -179.3 | -65 | 179.1 | 0 | 0 | 0 | 109.7 | D102 | D102-L104 WeakPolarHBondContact O-CG 3.39Å; D102-L104 PolarHBondContact O-N 3.23Å | ||
| 105 | T | 79.5 | Confident | 76.6 | Confident | 77 Ų | 77 | 123.7 Ų | 123.7 | 47% | 0.472 | 67% | 0.673 | S | S | . | * | trans | -71.4 | 155.9 | 164.2 | 67.5 | 0 | 0 | 0 | 0 | 110 | G103 Y107 T108 K109 | G103-T105 PolarHBondContact O-N 3.12Å; T105-Y107 PolarHBondContact O-N 3.2Å; T105-T108 PolarHBondContact N-OG1 2.92Å; T105-T108 PolarHBondContact O-N 3.42Å; T105-T108 VanDerWaalsContact O-N 3.16Å; T105-T108 PolarHBondContact O-OG1 3.45Å; T105-T108 VanDerWaalsContact O-OG1 3.09Å; T105-T108 PolarHBondContact OG1-N 2.98Å; T105-T108 VanDerWaalsContact OG1-N 3.12Å; T105-T108 PolarHBondContact OG1-OG1 3.03Å; T105-K109 PolarHBondContact O-N 3.25Å | ||
| 106 | T | 81.1 | Confident | 76.1 | Confident | 109 Ų | 109 | 118.3 Ų | 118.3 | 67% | 0.669 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -53.8 | -36.6 | 171.6 | 46.6 | 0 | 0 | 0 | 0 | 111.5 | K109 E110 | T106-K109 PolarHBondContact O-N 3.35Å; T106-E110 WeakPolarHBondContact O-CB 3.25Å; T106-E110 WeakPolarHBondContact O-CG 3.25Å; T106-E110 PolarHBondContact O-N 3.2Å |
| 107 | Y | 82.3 | Confident | 75.9 | Confident | 155 Ų | 155 | 123.5 Ų | 123.5 | 61% | 0.608 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -61.7 | -48.9 | 176 | -175.4 | -97.3 | 0 | 0 | 0 | 113.1 | T105 K109 E110 Y111 | T105-Y107 PolarHBondContact O-N 3.2Å; Y107-K109 VanDerWaalsContact C-N 3.3Å; Y107-K109 PolarHBondContact O-N 2.79Å; Y107-E110 PolarHBondContact O-N 3.38Å; Y107-Y111 HydrophobicContact CE2-CG 4.39Å; Y107-Y111 WeakPolarHBondContact O-CA 3.47Å; Y107-Y111 VanDerWaalsContact O-CB 3.24Å; Y107-Y111 WeakPolarHBondContact O-CB 3.25Å; Y107-Y111 PolarHBondContact O-N 3.06Å |
| 108 | T | 82.6 | Confident | 75.8 | Confident | 71 Ų | 71 | 126.8 Ų | 126.8 | 44% | 0.436 | 69% | 0.693 | S | S | . | * | H | α-helix | trans | -68.1 | -30 | 177.8 | 32.1 | 0 | 0 | 0 | 0 | 112.8 | T105 | T105-T108 PolarHBondContact N-OG1 2.92Å; T105-T108 PolarHBondContact O-N 3.42Å; T105-T108 VanDerWaalsContact O-N 3.16Å; T105-T108 PolarHBondContact O-OG1 3.45Å; T105-T108 VanDerWaalsContact O-OG1 3.09Å; T105-T108 PolarHBondContact OG1-N 2.98Å; T105-T108 VanDerWaalsContact OG1-N 3.12Å; T105-T108 PolarHBondContact OG1-OG1 3.03Å |
| 109 | K | 81.9 | Confident | 75.6 | Confident | 159 Ų | 159 | 121.4 Ų | 121.4 | 69% | 0.691 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -73.4 | -41.6 | 176.7 | -168.7 | 175.2 | -179.2 | 177.4 | 0 | 112.5 | T105 T106 Y107 | T105-K109 PolarHBondContact O-N 3.25Å; T106-K109 PolarHBondContact O-N 3.35Å; Y107-K109 VanDerWaalsContact C-N 3.3Å; Y107-K109 PolarHBondContact O-N 2.79Å |
| 110 | E | 80.2 | Confident | 75.4 | Confident | 158 Ų | 158 | 122.6 Ų | 122.6 | 74% | 0.738 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -89.6 | -34.4 | -174.5 | -67.1 | -178.1 | -177.5 | 0 | 0 | 113 | T106 Y107 T112 | T106-E110 WeakPolarHBondContact O-CB 3.25Å; T106-E110 WeakPolarHBondContact O-CG 3.25Å; T106-E110 PolarHBondContact O-N 3.2Å; Y107-E110 PolarHBondContact O-N 3.38Å; E110-T112 PolarHBondContact O-N 3.34Å |
| 111 | Y | 73.2 | Confident | 75.2 | Confident | 175 Ų | 175 | 121.1 Ų | 121.1 | 69% | 0.686 | 68% | 0.68 | S | S | * | * | trans | -97.4 | 54.2 | -178.3 | -149.8 | -96.5 | 0 | 0 | 0 | 112.1 | Y107 | Y107-Y111 HydrophobicContact CE2-CG 4.39Å; Y107-Y111 WeakPolarHBondContact O-CA 3.47Å; Y107-Y111 VanDerWaalsContact O-CB 3.24Å; Y107-Y111 WeakPolarHBondContact O-CB 3.25Å; Y107-Y111 PolarHBondContact O-N 3.06Å | ||
| 112 | T | 74.2 | Confident | 74.9 | Confident | 79 Ų | 79 | 118.6 Ų | 118.6 | 49% | 0.485 | 68% | 0.681 | S | S | . | * | trans | -77.8 | 126.4 | 166.9 | 49.9 | 0 | 0 | 0 | 0 | 108.4 | E110 K114 | E110-T112 PolarHBondContact O-N 3.34Å; T112-K114 PolarHBondContact O-N 3.26Å | ||
| 113 | G | 72.5 | Confident | 74.4 | Confident | 75 Ų | 75 | 120.7 Ų | 120.7 | 77% | 0.773 | 68% | 0.683 | S | S | * | * | trans | -56.9 | 98.5 | -180 | 0 | 0 | 0 | 0 | 0 | 110.9 | P115 | G113-P115 WeakPolarHBondContact O-CD 3.32Š| ||
| 114 | K | 72.7 | Confident | 73.9 | Confident | 174 Ų | 174 | 123.7 Ų | 123.7 | 76% | 0.757 | 70% | 0.696 | S | S | * | * | trans | -67.1 | 122.4 | 173.9 | -62.1 | -77 | 178 | 174.8 | 0 | 106.5 | T112 G116 | T112-K114 PolarHBondContact O-N 3.26Å; K114-G116 PolarHBondContact O-N 3.24Å | ||
| 115 | P | 72.8 | Confident | 73.1 | Confident | 126 Ų | 126 | 125.4 Ų | 125.4 | 82% | 0.818 | 71% | 0.71 | S | S | * | * | trans | -62.6 | 103.4 | 173.2 | 25.5 | -32.1 | 0 | 0 | 0 | 107.8 | G113 Q117 | G113-P115 WeakPolarHBondContact O-CD 3.32Å; P115-Q117 PolarHBondContact O-N 3.49Å | ||
| 116 | G | 64.2 | Low | 72.1 | Confident | 64 Ų | 64 | 128.7 Ų | 128.7 | 66% | 0.66 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 124.8 | 171 | 0 | 0 | 0 | 0 | 0 | 108.3 | K114 L118 | K114-G116 PolarHBondContact O-N 3.24Å; G116-L118 PolarHBondContact O-N 2.87Å; G116-L118 VanDerWaalsContact O-N 3.1Å |
| 117 | Q | 71.5 | Confident | 71.3 | Confident | 195 Ų | 195 | 134.7 Ų | 134.7 | 91% | 0.911 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 116.9 | 167.5 | -82.8 | 178.6 | -13.3 | 0 | 0 | 107.8 | P115 A119 | P115-Q117 PolarHBondContact O-N 3.49Å; Q117-A119 PolarHBondContact O-N 2.97Å; Q117-A119 VanDerWaalsContact O-N 3.15Å |
| 118 | L | 70.9 | Confident | 70.2 | Confident | 171 Ų | 171 | 137.3 Ų | 137.3 | 90% | 0.895 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 119.3 | 170.7 | -69.3 | 172.4 | 0 | 0 | 0 | 107.7 | G116 A120 | G116-L118 PolarHBondContact O-N 2.87Å; G116-L118 VanDerWaalsContact O-N 3.1Å; L118-A120 PolarHBondContact O-N 3.47Å |
| 119 | A | 72 | Confident | 69.2 | Low | 92 Ų | 92 | 137.2 Ų | 137.2 | 76% | 0.76 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 124.7 | 171.7 | 0 | 0 | 0 | 0 | 0 | 108.5 | Q117 P121 | Q117-A119 PolarHBondContact O-N 2.97Å; Q117-A119 VanDerWaalsContact O-N 3.15Å; A119-P121 VanDerWaalsContact O-CD 3.29Å; A119-P121 WeakPolarHBondContact O-CD 3.3Å; A119-P121 VanDerWaalsContact O-N 3.15Å |
| 120 | A | 69.3 | Low | 68.2 | Low | 87 Ų | 87 | 134.8 Ų | 134.8 | 72% | 0.719 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 118.6 | -179.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | L118 V122 | L118-A120 PolarHBondContact O-N 3.47Å; A120-V122 PolarHBondContact O-N 3.41Å |
| 121 | P | 68.7 | Low | 67.4 | Low | 102 Ų | 102 | 133.4 Ų | 133.4 | 66% | 0.662 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 117.4 | 178.1 | 25.9 | -31.9 | 0 | 0 | 0 | 109.4 | A119 K123 | A119-P121 VanDerWaalsContact O-CD 3.29Å; A119-P121 WeakPolarHBondContact O-CD 3.3Å; A119-P121 VanDerWaalsContact O-N 3.15Å; P121-K123 PolarHBondContact O-N 2.94Å |
| 122 | V | 70.2 | Confident | 67.2 | Low | 142 Ų | 142 | 128.7 Ų | 128.7 | 86% | 0.861 | 77% | 0.77 | S | S | * | * | trans | -72.8 | 91.8 | 168.6 | -179.2 | 0 | 0 | 0 | 0 | 107.6 | A120 | A120-V122 PolarHBondContact O-N 3.41Š| ||
| 123 | K | 63 | Low | 66.8 | Low | 173 Ų | 173 | 133.9 Ų | 133.9 | 75% | 0.752 | 79% | 0.786 | S | S | * | * | trans | -79.1 | 124.6 | 174.2 | -69.7 | -176.9 | 179.1 | -179.8 | 0 | 109.4 | P121 | P121-K123 PolarHBondContact O-N 2.94Š| ||
| 124 | P | 66.8 | Low | 66.8 | Low | 106 Ų | 106 | 139 Ų | 139 | 69% | 0.688 | 79% | 0.787 | S | S | * | * | trans | -62.4 | 141.6 | 172.7 | 25.1 | -32.2 | 0 | 0 | 0 | 110.5 | I126 | P124-I126 PolarHBondContact O-N 3.14Š| ||
| 125 | T | 64.7 | Low | 66.7 | Low | 143 Ų | 143 | 138 Ų | 138 | 88% | 0.877 | 79% | 0.79 | S | S | * | * | trans | -67.1 | 94.7 | 178.7 | -49.5 | 0 | 0 | 0 | 0 | 110.4 | R127 | T125-R127 PolarHBondContact O-N 3.45Š| ||
| 126 | I | 59.6 | Low | 66.7 | Low | 146 Ų | 146 | 133.9 Ų | 133.9 | 75% | 0.749 | 77% | 0.771 | S | S | * | * | trans | -77.9 | 119.5 | 169.9 | -60.1 | 170.6 | 0 | 0 | 0 | 107.8 | P124 K128 | P124-I126 PolarHBondContact O-N 3.14Å; I126-K128 PolarHBondContact O-N 3.01Å | ||
| 127 | R | 64.3 | Low | 66.9 | Low | 235 Ų | 235 | 138.5 Ų | 138.5 | 89% | 0.887 | 78% | 0.775 | S | S | * | * | trans | -63.8 | 118.8 | 172.8 | -66 | -176.9 | 177.7 | -168.4 | -0.9 | 108.5 | T125 G129 | T125-R127 PolarHBondContact O-N 3.45Å; R127-G129 PolarHBondContact O-N 2.93Å; R127-G129 VanDerWaalsContact O-N 3.12Å | ||
| 128 | K | 60 | Low | 67.2 | Low | 210 Ų | 210 | 132.1 Ų | 132.1 | 91% | 0.913 | 76% | 0.755 | S | S | * | * | trans | -62.9 | 110.6 | 175.7 | -69.8 | -178.9 | 178.4 | -179.6 | 0 | 109.2 | I126 | I126-K128 PolarHBondContact O-N 3.01Š| ||
| 129 | G | 59.8 | Low | 67.6 | Low | 70 Ų | 70 | 129.2 Ų | 129.2 | 72% | 0.722 | 75% | 0.745 | S | S | * | * | trans | -70.6 | 142.8 | 161.3 | 0 | 0 | 0 | 0 | 0 | 110.2 | R127 | R127-G129 PolarHBondContact O-N 2.93Å; R127-G129 VanDerWaalsContact O-N 3.12Å | ||
| 130 | S | 61.8 | Low | 68.1 | Low | 107 Ų | 107 | 132.3 Ų | 132.3 | 75% | 0.748 | 74% | 0.738 | S | S | * | * | trans | 27.1 | 113.4 | 169.1 | -173.5 | 0 | 0 | 0 | 0 | 118.2 | A132 | S130-A132 PolarHBondContact O-N 3.04Å; S130-A132 VanDerWaalsContact O-N 3.12Å; S130-A132 PolarHBondContact OG-N 3.25Å | ||
| 131 | S | 64.2 | Low | 68.5 | Low | 129 Ų | 129 | 132.2 Ų | 132.2 | 90% | 0.902 | 73% | 0.729 | S | S | * | * | trans | -78.5 | 26.7 | 172.8 | 57.9 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 132 | A | 68.1 | Low | 69 | Low | 76 Ų | 76 | 130.4 Ų | 130.4 | 63% | 0.628 | 72% | 0.716 | S | S | * | * | trans | -79.2 | 122.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | S130 F134 | S130-A132 PolarHBondContact O-N 3.04Å; S130-A132 VanDerWaalsContact O-N 3.12Å; S130-A132 PolarHBondContact OG-N 3.25Å; A132-F134 PolarHBondContact O-N 3.5Å | ||
| 133 | K | 66.2 | Low | 69.7 | Low | 188 Ų | 188 | 128.2 Ų | 128.2 | 82% | 0.817 | 70% | 0.699 | S | S | * | * | trans | -65.5 | 116 | 175 | -60.1 | -178.7 | -178.1 | -178.4 | 0 | 108.3 | D135 | K133-D135 PolarHBondContact O-N 3.11Š| ||
| 134 | F | 72.3 | Confident | 70.5 | Confident | 183 Ų | 183 | 127.7 Ų | 127.7 | 80% | 0.803 | 69% | 0.694 | S | S | * | * | trans | -87.2 | 99.1 | 169.5 | 175.5 | -103.3 | 0 | 0 | 0 | 107.8 | A132 G136 | A132-F134 PolarHBondContact O-N 3.5Å; F134-G136 PolarHBondContact O-N 2.84Å; F134-G136 VanDerWaalsContact O-N 3.07Å | ||
| 135 | D | 69.5 | Low | 71.2 | Confident | 154 Ų | 154 | 129.6 Ų | 129.6 | 82% | 0.824 | 69% | 0.687 | S | S | * | * | trans | -83.3 | 58.5 | 175.8 | -68.2 | -23.4 | 0 | 0 | 0 | 110.4 | K133 | K133-D135 PolarHBondContact O-N 3.11Š| ||
| 136 | G | 72.5 | Confident | 71.8 | Confident | 39 Ų | 39 | 129 Ų | 129 | 40% | 0.402 | 69% | 0.686 | S | S | . | * | trans | -108.6 | 96.1 | 173.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | F134 | F134-G136 PolarHBondContact O-N 2.84Å; F134-G136 VanDerWaalsContact O-N 3.07Å | ||
| 137 | E | 70 | Confident | 72.7 | Confident | 161 Ų | 161 | 130.2 Ų | 130.2 | 75% | 0.752 | 68% | 0.681 | S | S | * | * | trans | -71.9 | 127.6 | 165.5 | -65.7 | -175.1 | 171.7 | 0 | 0 | 108.7 | V142 | E137-V142 HydrophobicContact CB-CG2 4.09Š| ||
| 138 | A | 77.9 | Confident | 72.9 | Confident | 60 Ų | 60 | 128.8 Ų | 128.8 | 50% | 0.496 | 68% | 0.681 | S | S | . | * | trans | -64.8 | 141.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | Y140 T141 V142 | A138-Y140 PolarHBondContact O-N 3.38Å; A138-Y140 VanDerWaalsContact O-N 3.11Å; A138-T141 PolarHBondContact N-OG1 2.98Å; A138-T141 PolarHBondContact O-N 3.22Å; A138-T141 PolarHBondContact O-OG1 2.87Å; A138-V142 PolarHBondContact O-N 2.7Å | ||
| 139 | T | 78.9 | Confident | 73.2 | Confident | 111 Ų | 111 | 126.4 Ų | 126.4 | 68% | 0.681 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -51.8 | -39.2 | 178.7 | 36.6 | 0 | 0 | 0 | 0 | 112.2 | T141 V142 D143 | T139-T141 VanDerWaalsContact C-N 3.32Å; T139-T141 PolarHBondContact O-N 2.77Å; T139-V142 PolarHBondContact O-N 3.18Å; T139-V142 VanDerWaalsContact O-N 3.1Å; T139-D143 WeakPolarHBondContact O-CB 3.36Å; T139-D143 PolarHBondContact O-N 3.03Å |
| 140 | Y | 82.4 | Confident | 73.6 | Confident | 156 Ų | 156 | 132 Ų | 132 | 61% | 0.612 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -57 | -39.7 | 175.2 | -179.3 | -97.3 | 0 | 0 | 0 | 113.8 | A138 V142 Y144 | A138-Y140 PolarHBondContact O-N 3.38Å; A138-Y140 VanDerWaalsContact O-N 3.11Å; Y140-V142 VanDerWaalsContact C-N 3.32Å; Y140-V142 PolarHBondContact O-N 3.27Å; Y140-Y144 AromaticContact CD2-CD2 3.21Å; Y140-Y144 HydrophobicContact CD2-CD2 3.21Å; Y140-Y144 AromaticContact CD2-CE2 3.6Å; Y140-Y144 HydrophobicContact CD2-CE2 3.6Å; Y140-Y144 AromaticContact CD2-CG 3.99Å; Y140-Y144 HydrophobicContact CD2-CG 3.99Å; Y140-Y144 HydrophobicContact CE2-CD1 4.42Å; Y140-Y144 AromaticContact CE2-CD2 3.39Å; Y140-Y144 HydrophobicContact CE2-CD2 3.39Å; Y140-Y144 AromaticContact CE2-CE2 3.86Å; Y140-Y144 HydrophobicContact CE2-CE2 3.86Å; Y140-Y144 AromaticContact CE2-CG 3.69Å; Y140-Y144 HydrophobicContact CE2-CG 3.69Å; Y140-Y144 HydrophobicContact CG-CD2 4.01Å; Y140-Y144 WeakPolarHBondContact O-CB 3.36Å; Y140-Y144 PolarHBondContact O-N 3.45Å |
| 141 | T | 77.8 | Confident | 73.1 | Confident | 86 Ų | 86 | 137.9 Ų | 137.9 | 53% | 0.528 | 69% | 0.69 | S | S | . | * | H | α-helix | trans | -71.1 | -28.7 | 178.9 | 42 | 0 | 0 | 0 | 0 | 112.9 | A138 T139 | A138-T141 PolarHBondContact N-OG1 2.98Å; A138-T141 PolarHBondContact O-N 3.22Å; A138-T141 PolarHBondContact O-OG1 2.87Å; T139-T141 VanDerWaalsContact C-N 3.32Å; T139-T141 PolarHBondContact O-N 2.77Å |
| 142 | V | 79.8 | Confident | 72.6 | Confident | 64 Ų | 64 | 142.2 Ų | 142.2 | 39% | 0.388 | 69% | 0.687 | S | S | . | * | H | α-helix | trans | -78.9 | -42.4 | 176.2 | 179.5 | 0 | 0 | 0 | 0 | 110.9 | E137 A138 T139 Y140 | E137-V142 HydrophobicContact CB-CG2 4.09Å; A138-V142 PolarHBondContact O-N 2.7Å; T139-V142 PolarHBondContact O-N 3.18Å; T139-V142 VanDerWaalsContact O-N 3.1Å; Y140-V142 VanDerWaalsContact C-N 3.32Å; Y140-V142 PolarHBondContact O-N 3.27Å |
| 143 | D | 84.2 | Confident | 72.1 | Confident | 95 Ų | 95 | 146.9 Ų | 146.9 | 51% | 0.508 | 70% | 0.696 | S | S | . | * | H | α-helix | trans | -78.2 | -38.6 | -173 | -65.3 | -25.6 | 0 | 0 | 0 | 112.7 | T139 | T139-D143 WeakPolarHBondContact O-CB 3.36Å; T139-D143 PolarHBondContact O-N 3.03Å |
| 144 | Y | 80.2 | Confident | 71.1 | Confident | 163 Ų | 163 | 144 Ų | 144 | 64% | 0.639 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.3 | 50.2 | -174.3 | -62.9 | -88.5 | 0 | 0 | 0 | 112.9 | Y140 | Y140-Y144 AromaticContact CD2-CD2 3.21Å; Y140-Y144 HydrophobicContact CD2-CD2 3.21Å; Y140-Y144 AromaticContact CD2-CE2 3.6Å; Y140-Y144 HydrophobicContact CD2-CE2 3.6Å; Y140-Y144 AromaticContact CD2-CG 3.99Å; Y140-Y144 HydrophobicContact CD2-CG 3.99Å; Y140-Y144 HydrophobicContact CE2-CD1 4.42Å; Y140-Y144 AromaticContact CE2-CD2 3.39Å; Y140-Y144 HydrophobicContact CE2-CD2 3.39Å; Y140-Y144 AromaticContact CE2-CE2 3.86Å; Y140-Y144 HydrophobicContact CE2-CE2 3.86Å; Y140-Y144 AromaticContact CE2-CG 3.69Å; Y140-Y144 HydrophobicContact CE2-CG 3.69Å; Y140-Y144 HydrophobicContact CG-CD2 4.01Å; Y140-Y144 WeakPolarHBondContact O-CB 3.36Å; Y140-Y144 PolarHBondContact O-N 3.45Å |
| 145 | R | 80 | Confident | 70.1 | Confident | 145 Ų | 145 | 141.5 Ų | 141.5 | 55% | 0.547 | 69% | 0.694 | S | S | . | * | trans | -76.6 | 142.5 | 169 | 50.6 | -175.5 | 168.2 | -176.6 | -5.8 | 111 | W147 | R145-W147 HydrophobicContact CG-CZ2 4.25Å; R145-W147 VanDerWaalsContact O-CD1 3.23Å; R145-W147 PolarHBondContact O-N 3.1Å; R145-W147 PolarHBondContact O-NE1 3.17Å | ||
| 146 | P | 78.9 | Confident | 69.1 | Low | 131 Ų | 131 | 139.7 Ų | 139.7 | 85% | 0.851 | 69% | 0.689 | S | S | * | * | trans | -62 | 108.2 | 174.7 | 23 | -30.5 | 0 | 0 | 0 | 109.9 | ||||
| 147 | W | 77.5 | Confident | 67.8 | Low | 171 Ų | 171 | 141.1 Ų | 141.1 | 65% | 0.648 | 70% | 0.703 | S | S | * | * | trans | -72.1 | 133.5 | 178.7 | -60.6 | 96.3 | 0 | 0 | 0 | 110.2 | R145 L149 | R145-W147 HydrophobicContact CG-CZ2 4.25Å; R145-W147 VanDerWaalsContact O-CD1 3.23Å; R145-W147 PolarHBondContact O-N 3.1Å; R145-W147 PolarHBondContact O-NE1 3.17Å; W147-L149 VanDerWaalsContact C-N 3.28Å; W147-L149 PolarHBondContact O-N 3.04Å | ||
| 148 | K | 68.3 | Low | 66.7 | Low | 205 Ų | 205 | 144.4 Ų | 144.4 | 89% | 0.891 | 71% | 0.709 | S | S | * | * | trans | -68.6 | 91.1 | 164.1 | -73.6 | -178.5 | 179.6 | 177.8 | 0 | 107.5 | E150 | K148-E150 PolarHBondContact O-N 2.98Å; K148-E150 VanDerWaalsContact O-N 3.12Å | ||
| 149 | L | 67.1 | Low | 65.4 | Low | 161 Ų | 161 | 149.9 Ų | 149.9 | 84% | 0.843 | 72% | 0.724 | S | S | * | * | trans | -60.8 | 113.9 | 170.5 | -73.5 | 160.8 | 0 | 0 | 0 | 107.7 | W147 R151 | W147-L149 VanDerWaalsContact C-N 3.28Å; W147-L149 PolarHBondContact O-N 3.04Å; L149-R151 PolarHBondContact O-N 3.29Å | ||
| 150 | E | 67.3 | Low | 64 | Low | 186 Ų | 186 | 148.7 Ų | 148.7 | 87% | 0.869 | 72% | 0.72 | S | S | * | * | trans | -53.2 | 128.4 | 166.1 | -70.5 | -170 | 164.8 | 0 | 0 | 107.4 | K148 R152 | K148-E150 PolarHBondContact O-N 2.98Å; K148-E150 VanDerWaalsContact O-N 3.12Å; E150-R152 PolarHBondContact O-N 3.05Å | ||
| 151 | R | 51.9 | Low | 63 | Low | 231 Ų | 231 | 148.7 Ų | 148.7 | 87% | 0.872 | 73% | 0.731 | S | S | * | * | trans | -56.4 | 105.6 | -179.4 | 178.2 | -176.2 | -68.5 | 169.6 | -1.8 | 107.2 | L149 E153 | L149-R151 PolarHBondContact O-N 3.29Å; R151-E153 PolarHBondContact O-N 2.72Å | ||
| 152 | R | 54.7 | Low | 61.9 | Low | 220 Ų | 220 | 153 Ų | 153 | 83% | 0.83 | 74% | 0.738 | S | S | * | * | trans | -56.8 | 111.3 | 170.9 | -168.5 | 173.8 | -173.3 | 161.5 | 1.5 | 106.5 | E150 L154 | E150-R152 PolarHBondContact O-N 3.05Å; R152-L154 PolarHBondContact O-N 2.83Å | ||
| 153 | E | 55.9 | Low | 61.2 | Low | 175 Ų | 175 | 158.3 Ų | 158.3 | 82% | 0.818 | 76% | 0.758 | S | S | * | * | trans | -59.8 | 97.7 | 167 | -70.2 | -174 | 166.6 | 0 | 0 | 106.2 | R151 S155 | R151-E153 PolarHBondContact O-N 2.72Å; E153-S155 PolarHBondContact O-N 2.79Å | ||
| 154 | L | 47 | Very low | 60.6 | Low | 127 Ų | 127 | 161 Ų | 161 | 67% | 0.665 | 77% | 0.765 | S | S | * | * | trans | -55.3 | 117.7 | 162.8 | -66.9 | 169.1 | 0 | 0 | 0 | 104.5 | R152 T156 G157 | R152-L154 PolarHBondContact O-N 2.83Å; L154-T156 PolarHBondContact O-N 3.17Å; L154-G157 PolarHBondContact O-N 3.06Å | ||
| 155 | S | 50.7 | Low | 60.2 | Low | 130 Ų | 130 | 158 Ų | 158 | 91% | 0.909 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.1 | 12.3 | 167.9 | -51.2 | 0 | 0 | 0 | 0 | 113 | E153 | E153-S155 PolarHBondContact O-N 2.79Š|
| 156 | T | 48.6 | Very low | 60 | Low | 117 Ų | 117 | 157.4 Ų | 157.4 | 72% | 0.718 | 77% | 0.774 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.4 | 8.4 | 174.2 | -16.2 | 0 | 0 | 0 | 0 | 112.7 | L154 | L154-T156 PolarHBondContact O-N 3.17Š|
| 157 | G | 45.7 | Very low | 59.9 | Low | 68 Ų | 68 | 158.7 Ų | 158.7 | 70% | 0.701 | 77% | 0.772 | S | S | * | * | trans | -105.2 | -5.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 116.1 | L154 | L154-G157 PolarHBondContact O-N 3.06Š| ||
| 158 | R | 45.9 | Very low | 60 | Low | 230 Ų | 230 | 155.9 Ų | 155.9 | 87% | 0.868 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -80.4 | 116.6 | 162.9 | -166.8 | -175.5 | -113 | -132.5 | 1.8 | 105.6 | S160 | R158-S160 PolarHBondContact O-N 3.36Š|
| 159 | E | 49.7 | Very low | 60.4 | Low | 176 Ų | 176 | 155.3 Ų | 155.3 | 82% | 0.822 | 77% | 0.774 | S | S | * | * | trans | -24 | 95.1 | 179.5 | -77.8 | 161.3 | 149.9 | 0 | 0 | 111.3 | N161 | E159-N161 PolarHBondContact O-N 3.26Š| ||
| 160 | S | 50.2 | Low | 60.8 | Low | 86 Ų | 86 | 153 Ų | 153 | 60% | 0.601 | 77% | 0.771 | S | S | * | * | trans | -63.5 | 114.4 | 168.5 | -175.3 | 0 | 0 | 0 | 0 | 103.6 | R158 W162 | R158-S160 PolarHBondContact O-N 3.36Å; S160-W162 PolarHBondContact O-N 2.98Å | ||
| 161 | N | 60.6 | Low | 61.4 | Low | 155 Ų | 155 | 146 Ų | 146 | 83% | 0.829 | 75% | 0.749 | S | S | * | * | trans | -65.2 | 46.1 | 171.7 | -66 | -43.9 | 0 | 0 | 0 | 110.4 | E159 Q163 | E159-N161 PolarHBondContact O-N 3.26Å; N161-Q163 PolarHBondContact O-N 2.85Å | ||
| 162 | W | 55.8 | Low | 62.7 | Low | 177 Ų | 177 | 140.1 Ų | 140.1 | 67% | 0.67 | 74% | 0.739 | S | S | * | * | trans | -85.4 | 98.7 | 179.3 | -150.6 | 105.1 | 0 | 0 | 0 | 106.7 | S160 K164 P165 | S160-W162 PolarHBondContact O-N 2.98Å; W162-K164 VanDerWaalsContact CZ3-CA 3.46Å; W162-K164 PolarHBondContact O-N 2.87Å; W162-P165 HydrophobicContact CH2-CG 3.64Å; W162-P165 VanDerWaalsContact CZ3-CD 3.43Å; W162-P165 HydrophobicContact CZ3-CG 3.84Å | ||
| 163 | Q | 66 | Low | 64.1 | Low | 176 Ų | 176 | 133.5 Ų | 133.5 | 82% | 0.822 | 72% | 0.724 | S | S | * | * | trans | -73 | 110.1 | 172.4 | -71.1 | -155.5 | -30.2 | 0 | 0 | 109.5 | N161 | N161-Q163 PolarHBondContact O-N 2.85Š| ||
| 164 | K | 71.2 | Confident | 65.4 | Low | 151 Ų | 151 | 130.1 Ų | 130.1 | 66% | 0.657 | 72% | 0.716 | S | S | * | * | trans | -41.3 | 129.9 | 167.9 | 61.2 | -179.6 | -176.6 | 178.4 | 0 | 109.1 | W162 N166 | W162-K164 VanDerWaalsContact CZ3-CA 3.46Å; W162-K164 PolarHBondContact O-N 2.87Å; K164-N166 PolarHBondContact O-N 3.02Å | ||
| 165 | P | 71.9 | Confident | 67 | Low | 99 Ų | 99 | 132 Ų | 132 | 64% | 0.643 | 72% | 0.715 | S | S | * | * | trans | -69.3 | 111.2 | -177.8 | -9.4 | 30.2 | 0 | 0 | 0 | 105.8 | W162 L167 | W162-P165 HydrophobicContact CH2-CG 3.64Å; W162-P165 VanDerWaalsContact CZ3-CD 3.43Å; W162-P165 HydrophobicContact CZ3-CG 3.84Å; P165-L167 PolarHBondContact O-N 2.77Å | ||
| 166 | N | 74.7 | Confident | 68.6 | Low | 134 Ų | 134 | 129.1 Ų | 129.1 | 72% | 0.717 | 69% | 0.693 | S | S | * | * | trans | -85.7 | 16.5 | 179.1 | -97.5 | -11.1 | 0 | 0 | 0 | 111.8 | K164 P168 | K164-N166 PolarHBondContact O-N 3.02Å; N166-P168 VanDerWaalsContact O-CD 3.28Å; N166-P168 WeakPolarHBondContact O-CD 3.37Å | ||
| 167 | L | 77.5 | Confident | 70.2 | Confident | 157 Ų | 157 | 125.9 Ų | 125.9 | 82% | 0.822 | 68% | 0.677 | S | S | * | * | trans | -75.4 | 117 | 173.3 | -92.6 | 89.8 | 0 | 0 | 0 | 109.2 | P165 | P165-L167 PolarHBondContact O-N 2.77Š| ||
| 168 | P | 78.6 | Confident | 72.1 | Confident | 112 Ų | 112 | 127.6 Ų | 127.6 | 73% | 0.727 | 67% | 0.671 | S | S | * | * | trans | -62.6 | 149.2 | 170.3 | 27.2 | -32.5 | 0 | 0 | 0 | 109.9 | N166 S170 | N166-P168 VanDerWaalsContact O-CD 3.28Å; N166-P168 WeakPolarHBondContact O-CD 3.37Å; P168-S170 PolarHBondContact O-N 3.29Å; P168-S170 VanDerWaalsContact O-N 3.11Å | ||
| 169 | F | 77.8 | Confident | 73.7 | Confident | 194 Ų | 194 | 124.8 Ų | 124.8 | 85% | 0.851 | 66% | 0.661 | S | S | * | * | trans | -59.5 | 113.7 | 177 | 175.9 | -104.4 | 0 | 0 | 0 | 110.5 | G171 | F169-G171 VanDerWaalsContact C-N 3.35Å; F169-G171 PolarHBondContact O-N 2.92Å | ||
| 170 | S | 74.6 | Confident | 75.1 | Confident | 112 Ų | 112 | 120.2 Ų | 120.2 | 78% | 0.783 | 65% | 0.645 | S | S | * | * | trans | -95.8 | 31.1 | -177.6 | 72.2 | 0 | 0 | 0 | 0 | 113.2 | P168 T172 | P168-S170 PolarHBondContact O-N 3.29Å; P168-S170 VanDerWaalsContact O-N 3.11Å; S170-T172 PolarHBondContact O-N 2.59Å | ||
| 171 | G | 79.9 | Confident | 76.4 | Confident | 40 Ų | 40 | 120.4 Ų | 120.4 | 41% | 0.412 | 65% | 0.652 | S | S | . | * | trans | -82.4 | 94.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | F169 P173 | F169-G171 VanDerWaalsContact C-N 3.35Å; F169-G171 PolarHBondContact O-N 2.92Å; G171-P173 WeakPolarHBondContact O-CD 3.35Å | ||
| 172 | T | 80.6 | Confident | 77 | Confident | 106 Ų | 106 | 122 Ų | 122 | 65% | 0.65 | 65% | 0.648 | S | S | * | * | trans | -77 | 120.3 | 164.4 | 40.2 | 0 | 0 | 0 | 0 | 108.8 | S170 | S170-T172 PolarHBondContact O-N 2.59Š| ||
| 173 | P | 83 | Confident | 77.9 | Confident | 81 Ų | 81 | 121.4 Ų | 121.4 | 53% | 0.526 | 66% | 0.658 | S | S | . | * | trans | -60.5 | 145.1 | 175.9 | 21.9 | -30 | 0 | 0 | 0 | 110.2 | G171 Y175 T176 A177 | G171-P173 WeakPolarHBondContact O-CD 3.35Å; P173-Y175 PolarHBondContact O-N 2.96Å; P173-T176 WeakPolarHBondContact CD-OG1 3.45Å; P173-T176 HydrophobicContact CG-CG2 3.93Å; P173-T176 WeakPolarHBondContact CG-OG1 3.36Å; P173-T176 PolarHBondContact O-N 3.4Å; P173-T176 PolarHBondContact O-OG1 3.32Å; P173-A177 PolarHBondContact O-N 2.91Å | ||
| 174 | T | 82.7 | Confident | 78 | Confident | 105 Ų | 105 | 117.2 Ų | 117.2 | 64% | 0.644 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -49.4 | -40.7 | -176.3 | 2.7 | 0 | 0 | 0 | 0 | 111.8 | T176 A177 D178 | T174-T176 PolarHBondContact O-N 2.77Å; T174-A177 PolarHBondContact O-N 3.03Å; T174-A177 VanDerWaalsContact O-N 3.09Å; T174-D178 VanDerWaalsContact O-CB 3.29Å; T174-D178 WeakPolarHBondContact O-CB 3.12Å; T174-D178 PolarHBondContact O-N 3.07Å |
| 175 | Y | 82.1 | Confident | 78.1 | Confident | 165 Ų | 165 | 119 Ų | 119 | 65% | 0.647 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -55.6 | -44.2 | 175 | -178.1 | -99.5 | 0 | 0 | 0 | 113.9 | P173 A177 Y179 | P173-Y175 PolarHBondContact O-N 2.96Å; Y175-A177 VanDerWaalsContact C-N 3.35Å; Y175-Y179 AromaticContact CD2-CD2 3.47Å; Y175-Y179 HydrophobicContact CD2-CD2 3.47Å; Y175-Y179 VanDerWaalsContact CD2-CD2 3.47Å; Y175-Y179 AromaticContact CD2-CE2 3.78Å; Y175-Y179 HydrophobicContact CD2-CE2 3.78Å; Y175-Y179 HydrophobicContact CD2-CG 4.24Å; Y175-Y179 AromaticContact CE2-CD2 3.67Å; Y175-Y179 HydrophobicContact CE2-CD2 3.67Å; Y175-Y179 HydrophobicContact CE2-CE2 4.01Å; Y175-Y179 HydrophobicContact CE2-CG 4.02Å; Y175-Y179 HydrophobicContact CG-CD2 4.21Å; Y175-Y179 WeakPolarHBondContact O-CB 3.37Å; Y175-Y179 WeakPolarHBondContact O-CD2 3.49Å; Y175-Y179 PolarHBondContact O-N 3.24Å |
| 176 | T | 83.9 | Confident | 78.2 | Confident | 71 Ų | 71 | 119.7 Ų | 119.7 | 44% | 0.436 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -74.4 | -25 | 178 | 54 | 0 | 0 | 0 | 0 | 113.5 | P173 T174 V180 | P173-T176 WeakPolarHBondContact CD-OG1 3.45Å; P173-T176 HydrophobicContact CG-CG2 3.93Å; P173-T176 WeakPolarHBondContact CG-OG1 3.36Å; P173-T176 PolarHBondContact O-N 3.4Å; P173-T176 PolarHBondContact O-OG1 3.32Å; T174-T176 PolarHBondContact O-N 2.77Å; T176-V180 WeakPolarHBondContact O-CG2 3.49Å |
| 177 | A | 82.5 | Confident | 77.8 | Confident | 48 Ų | 48 | 119.4 Ų | 119.4 | 40% | 0.397 | 67% | 0.671 | S | S | . | * | H | α-helix | trans | -78.7 | -37.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | P173 T174 Y175 | P173-A177 PolarHBondContact O-N 2.91Å; T174-A177 PolarHBondContact O-N 3.03Å; T174-A177 VanDerWaalsContact O-N 3.09Å; Y175-A177 VanDerWaalsContact C-N 3.35Å |
| 178 | D | 84.3 | Confident | 77.5 | Confident | 104 Ų | 104 | 118.3 Ų | 118.3 | 56% | 0.556 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -86.3 | -32.1 | -173.8 | -62 | -24.6 | 0 | 0 | 0 | 112.5 | T174 | T174-D178 VanDerWaalsContact O-CB 3.29Å; T174-D178 WeakPolarHBondContact O-CB 3.12Å; T174-D178 PolarHBondContact O-N 3.07Å |
| 179 | Y | 80 | Confident | 77.4 | Confident | 172 Ų | 172 | 116.8 Ų | 116.8 | 68% | 0.675 | 66% | 0.663 | S | S | * | * | trans | -107.2 | 58.5 | -176 | -66 | -91 | 0 | 0 | 0 | 112.7 | Y175 | Y175-Y179 AromaticContact CD2-CD2 3.47Å; Y175-Y179 HydrophobicContact CD2-CD2 3.47Å; Y175-Y179 VanDerWaalsContact CD2-CD2 3.47Å; Y175-Y179 AromaticContact CD2-CE2 3.78Å; Y175-Y179 HydrophobicContact CD2-CE2 3.78Å; Y175-Y179 HydrophobicContact CD2-CG 4.24Å; Y175-Y179 AromaticContact CE2-CD2 3.67Å; Y175-Y179 HydrophobicContact CE2-CD2 3.67Å; Y175-Y179 HydrophobicContact CE2-CE2 4.01Å; Y175-Y179 HydrophobicContact CE2-CG 4.02Å; Y175-Y179 HydrophobicContact CG-CD2 4.21Å; Y175-Y179 WeakPolarHBondContact O-CB 3.37Å; Y175-Y179 WeakPolarHBondContact O-CD2 3.49Å; Y175-Y179 PolarHBondContact O-N 3.24Å | ||
| 180 | V | 79.1 | Confident | 77 | Confident | 79 Ų | 79 | 114 Ų | 114 | 48% | 0.479 | 67% | 0.665 | S | S | . | * | trans | -89 | 137.9 | 171.3 | -172.9 | 0 | 0 | 0 | 0 | 109.5 | T176 Y182 | T176-V180 WeakPolarHBondContact O-CG2 3.49Å; V180-Y182 WeakPolarHBondContact O-CD2 3.38Å; V180-Y182 PolarHBondContact O-N 2.72Å | ||
| 181 | A | 76.6 | Confident | 76.9 | Confident | 91 Ų | 91 | 116.4 Ų | 116.4 | 75% | 0.752 | 66% | 0.662 | S | S | * | * | trans | -65.6 | 95.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 110.4 | N183 | A181-N183 PolarHBondContact O-N 3.29Š| ||
| 182 | Y | 73.9 | Confident | 76.2 | Confident | 189 Ų | 189 | 120.2 Ų | 120.2 | 74% | 0.741 | 68% | 0.679 | S | S | * | * | trans | -73.7 | 115.7 | 170.1 | -66.4 | -79.2 | 0 | 0 | 0 | 108.6 | V180 A184 | V180-Y182 WeakPolarHBondContact O-CD2 3.38Å; V180-Y182 PolarHBondContact O-N 2.72Å; Y182-A184 PolarHBondContact O-N 2.95Å | ||
| 183 | N | 75.2 | Confident | 75.2 | Confident | 163 Ų | 163 | 121.3 Ų | 121.3 | 87% | 0.872 | 69% | 0.686 | S | S | * | * | trans | -68.5 | 76.1 | 169.2 | -70.9 | -41.6 | 0 | 0 | 0 | 109.3 | A181 K185 | A181-N183 PolarHBondContact O-N 3.29Å; N183-K185 PolarHBondContact O-N 3.43Å | ||
| 184 | A | 68.6 | Low | 73.9 | Confident | 89 Ų | 89 | 124.6 Ų | 124.6 | 74% | 0.736 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 119 | 171.9 | 0 | 0 | 0 | 0 | 0 | 108.1 | Y182 | Y182-A184 PolarHBondContact O-N 2.95Š|
| 185 | K | 72.6 | Confident | 72.6 | Confident | 189 Ų | 189 | 124.1 Ų | 124.1 | 82% | 0.822 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 139 | 171.8 | -64.7 | -177.4 | -178.3 | 178.7 | 0 | 108.2 | N183 | N183-K185 PolarHBondContact O-N 3.43Š|
| 186 | P | 73.5 | Confident | 71.2 | Confident | 113 Ų | 113 | 123.8 Ų | 123.8 | 73% | 0.734 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 136.5 | 178.2 | 19.4 | -29.4 | 0 | 0 | 0 | 109.7 | V188 | P186-V188 PolarHBondContact O-N 2.99Š|
| 187 | P | 66.6 | Low | 70.2 | Confident | 128 Ų | 128 | 127.1 Ų | 127.1 | 83% | 0.831 | 71% | 0.71 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 126.7 | -176.3 | 22.5 | -31.5 | 0 | 0 | 0 | 110 | S189 | P187-S189 PolarHBondContact O-N 2.88Š|
| 188 | V | 71 | Confident | 68.8 | Low | 133 Ų | 133 | 132 Ų | 132 | 81% | 0.806 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 124.4 | 174 | -171.3 | 0 | 0 | 0 | 0 | 107.2 | P186 C190 | P186-V188 PolarHBondContact O-N 2.99Å; V188-C190 PolarHBondContact O-N 3.12Å |
| 189 | S | 77.7 | Confident | 67.7 | Low | 81 Ų | 81 | 133.3 Ų | 133.3 | 57% | 0.566 | 73% | 0.731 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 125.2 | -176.4 | 100.2 | 0 | 0 | 0 | 0 | 109.8 | P187 K191 | P187-S189 PolarHBondContact O-N 2.88Å; S189-K191 PolarHBondContact O-N 3.15Å; S189-K191 VanDerWaalsContact O-N 3.13Å |
| 190 | C | 69.5 | Low | 67.2 | Low | 134 Ų | 134 | 134 Ų | 134 | 91% | 0.905 | 74% | 0.741 | S | S | * | * | trans | -75 | 10.7 | 172.4 | -48.5 | 0 | 0 | 0 | 0 | 112.6 | V188 | V188-C190 PolarHBondContact O-N 3.12Š| ||
| 191 | K | 70.6 | Confident | 66.6 | Low | 164 Ų | 164 | 135.5 Ų | 135.5 | 71% | 0.713 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -70.8 | 127.5 | 173.7 | -66.2 | -177.3 | 177.3 | -179.8 | 0 | 107.4 | S189 V193 | S189-K191 PolarHBondContact O-N 3.15Å; S189-K191 VanDerWaalsContact O-N 3.13Å; K191-V193 PolarHBondContact O-N 2.89Å; K191-V193 VanDerWaalsContact O-N 3.17Å |
| 192 | P | 65.2 | Low | 66.1 | Low | 120 Ų | 120 | 137.3 Ų | 137.3 | 78% | 0.779 | 75% | 0.754 | S | S | * | * | trans | -54.3 | 126.4 | 177.2 | 20.8 | -30.1 | 0 | 0 | 0 | 108.6 | H194 | P192-H194 PolarHBondContact O-N 3.28Š| ||
| 193 | V | 59.9 | Low | 65.8 | Low | 129 Ų | 129 | 136.5 Ų | 136.5 | 78% | 0.782 | 76% | 0.755 | S | S | * | * | trans | -60.1 | 113.7 | 178.4 | -176.7 | 0 | 0 | 0 | 0 | 106.5 | K191 C195 | K191-V193 PolarHBondContact O-N 2.89Å; K191-V193 VanDerWaalsContact O-N 3.17Å; V193-C195 PolarHBondContact O-N 3.41Å | ||
| 194 | H | 56.7 | Low | 65.6 | Low | 149 Ų | 149 | 133.1 Ų | 133.1 | 69% | 0.69 | 74% | 0.744 | S | S | * | * | trans | -71.2 | 84.7 | 175.5 | -172.1 | -70.2 | 0 | 0 | 0 | 107.9 | P192 F196 | P192-H194 PolarHBondContact O-N 3.28Å; H194-F196 VanDerWaalsContact C-N 3.3Å; H194-F196 AromaticContact CE1-CD2 3.43Å; H194-F196 VanDerWaalsContact CE1-CD2 3.43Å; H194-F196 WeakPolarHBondContact CE1-CD2 3.47Å; H194-F196 AromaticContact ND1-CD2 3.91Å; H194-F196 PolarHBondContact O-N 3.24Å | ||
| 195 | C | 55.6 | Low | 65.6 | Low | 95 Ų | 95 | 133.6 Ų | 133.6 | 64% | 0.642 | 73% | 0.734 | S | S | * | * | trans | -66.2 | 96.2 | 165.1 | -61.1 | 0 | 0 | 0 | 0 | 106.4 | V193 L197 | V193-C195 PolarHBondContact O-N 3.41Å; C195-L197 PolarHBondContact O-N 3.07Å | ||
| 196 | F | 51.2 | Low | 65.5 | Low | 158 Ų | 158 | 127.6 Ų | 127.6 | 69% | 0.693 | 72% | 0.717 | S | S | * | * | trans | -66.2 | 92 | 171.5 | -158.4 | -83 | 0 | 0 | 0 | 106.8 | H194 E198 | H194-F196 VanDerWaalsContact C-N 3.3Å; H194-F196 AromaticContact CE1-CD2 3.43Å; H194-F196 VanDerWaalsContact CE1-CD2 3.43Å; H194-F196 WeakPolarHBondContact CE1-CD2 3.47Å; H194-F196 AromaticContact ND1-CD2 3.91Å; H194-F196 PolarHBondContact O-N 3.24Å; F196-E198 VanDerWaalsContact C-N 3.34Å; F196-E198 HydrophobicContact CD1-CB 4.05Å; F196-E198 HydrophobicContact CE1-CB 4.11Å; F196-E198 HydrophobicContact CE1-CG 4.26Å; F196-E198 PolarHBondContact O-N 3.23Å; F196-E198 VanDerWaalsContact O-N 3.15Å | ||
| 197 | L | 63.4 | Low | 65.5 | Low | 142 Ų | 142 | 126 Ų | 126 | 74% | 0.743 | 71% | 0.705 | S | S | * | * | trans | -72.2 | 100.6 | 160.4 | -106.5 | 80.8 | 0 | 0 | 0 | 105.5 | C195 N199 | C195-L197 PolarHBondContact O-N 3.07Å; L197-N199 PolarHBondContact O-N 3.34Å | ||
| 198 | E | 54.3 | Low | 66.1 | Low | 151 Ų | 151 | 126.2 Ų | 126.2 | 71% | 0.706 | 70% | 0.699 | S | S | * | * | trans | -64.2 | 103.1 | 172.1 | -170 | 163.1 | -157.4 | 0 | 0 | 107.9 | F196 Q200 | F196-E198 VanDerWaalsContact C-N 3.34Å; F196-E198 HydrophobicContact CD1-CB 4.05Å; F196-E198 HydrophobicContact CE1-CB 4.11Å; F196-E198 HydrophobicContact CE1-CG 4.26Å; F196-E198 PolarHBondContact O-N 3.23Å; F196-E198 VanDerWaalsContact O-N 3.15Å; E198-Q200 PolarHBondContact O-N 3.29Å | ||
| 199 | N | 60.7 | Low | 66.5 | Low | 130 Ų | 130 | 127.2 Ų | 127.2 | 70% | 0.695 | 69% | 0.689 | S | S | * | * | trans | -65 | 105 | 170.9 | -76.4 | -28.8 | 0 | 0 | 0 | 107.3 | L197 T201 | L197-N199 PolarHBondContact O-N 3.34Å; N199-T201 PolarHBondContact O-N 2.76Å | ||
| 200 | Q | 69.5 | Low | 66.4 | Low | 187 Ų | 187 | 130.4 Ų | 130.4 | 87% | 0.874 | 69% | 0.689 | S | S | * | * | trans | -68.6 | 10.2 | 176.9 | -62.1 | -166.3 | 0.4 | 0 | 0 | 113.7 | E198 P202 | E198-Q200 PolarHBondContact O-N 3.29Å; Q200-P202 WeakPolarHBondContact O-CD 3.5Å | ||
| 201 | T | 65.8 | Low | 66.7 | Low | 110 Ų | 110 | 127.6 Ų | 127.6 | 68% | 0.675 | 67% | 0.665 | S | S | * | * | S | Bend | trans | -97.1 | 113.1 | 178.4 | 34 | 0 | 0 | 0 | 0 | 108.9 | N199 F203 | N199-T201 PolarHBondContact O-N 2.76Å; T201-F203 PolarHBondContact O-N 3.38Å |
| 202 | P | 67.5 | Low | 67.1 | Low | 129 Ų | 129 | 123.9 Ų | 123.9 | 84% | 0.838 | 66% | 0.659 | S | S | * | * | trans | -62 | 123 | -179.8 | 20.9 | -27.1 | 0 | 0 | 0 | 109.6 | Q200 S204 | Q200-P202 WeakPolarHBondContact O-CD 3.5Å; P202-S204 PolarHBondContact O-N 3.01Å | ||
| 203 | F | 66.4 | Low | 67.5 | Low | 172 Ų | 172 | 126 Ų | 126 | 75% | 0.754 | 65% | 0.653 | S | S | * | * | trans | -71 | 125.3 | 175.8 | -178.8 | -111.2 | 0 | 0 | 0 | 109.4 | T201 D205 | T201-F203 PolarHBondContact O-N 3.38Å; F203-D205 VanDerWaalsContact C-N 3.26Å; F203-D205 HydrophobicContact CD1-CB 3.91Å; F203-D205 HydrophobicContact CE1-CB 4.25Å; F203-D205 VanDerWaalsContact CE1-OD1 3.31Å; F203-D205 WeakPolarHBondContact CE1-OD1 3.37Å; F203-D205 PolarHBondContact O-N 3.16Å | ||
| 204 | S | 72.2 | Confident | 68 | Low | 93 Ų | 93 | 128.2 Ų | 128.2 | 65% | 0.65 | 65% | 0.648 | S | S | * | * | trans | -70.3 | 83 | 173.3 | 161.3 | 0 | 0 | 0 | 0 | 109.2 | P202 S206 | P202-S204 PolarHBondContact O-N 3.01Å; S204-S206 PolarHBondContact O-N 2.87Å | ||
| 205 | D | 68.3 | Low | 68.5 | Low | 98 Ų | 98 | 128 Ų | 128 | 52% | 0.524 | 66% | 0.657 | S | S | . | * | trans | -80.9 | 11.6 | -175.2 | -155.6 | 39.3 | 0 | 0 | 0 | 113.7 | F203 R210 | F203-D205 VanDerWaalsContact C-N 3.26Å; F203-D205 HydrophobicContact CD1-CB 3.91Å; F203-D205 HydrophobicContact CE1-CB 4.25Å; F203-D205 VanDerWaalsContact CE1-OD1 3.31Å; F203-D205 WeakPolarHBondContact CE1-OD1 3.37Å; F203-D205 PolarHBondContact O-N 3.16Å; D205-R210 PolarHBondContact O-NH1 3.24Å; D205-R210 IonicContact OD2-NH1 3.16Å; D205-R210 PolarHBondContact OD2-NH1 2.89Å | ||
| 206 | S | 69.7 | Low | 68.7 | Low | 64 Ų | 64 | 130.6 Ų | 130.6 | 45% | 0.448 | 66% | 0.663 | S | S | . | * | trans | -96.3 | 94.9 | 175.1 | 62.3 | 0 | 0 | 0 | 0 | 110.2 | S204 | S204-S206 PolarHBondContact O-N 2.87Š| ||
| 207 | T | 74.6 | Confident | 69.1 | Low | 80 Ų | 80 | 129.9 Ų | 129.9 | 49% | 0.491 | 67% | 0.667 | S | S | . | * | trans | -78.8 | 143.7 | 162.6 | 53.1 | 0 | 0 | 0 | 0 | 109.4 | Y209 R210 D211 | T207-Y209 PolarHBondContact O-N 2.94Å; T207-Y209 VanDerWaalsContact O-N 3.12Å; T207-R210 WeakPolarHBondContact O-CB 3.26Å; T207-R210 PolarHBondContact O-N 2.73Å; T207-D211 PolarHBondContact O-N 3.2Å; T207-D211 VanDerWaalsContact O-N 3.15Å | ||
| 208 | D | 78.5 | Confident | 68.9 | Low | 132 Ų | 132 | 129.9 Ų | 129.9 | 71% | 0.706 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -44.1 | -40.8 | 172.5 | 53.5 | -7.3 | 0 | 0 | 0 | 112.8 | D211 S212 | D208-D211 PolarHBondContact O-N 3.19Å; D208-S212 VanDerWaalsContact O-CB 3.25Å; D208-S212 WeakPolarHBondContact O-CB 3.36Å; D208-S212 PolarHBondContact O-N 3.32Å; D208-S212 PolarHBondContact O-OG 2.89Å |
| 209 | Y | 79.1 | Confident | 69 | Low | 154 Ų | 154 | 127.1 Ų | 127.1 | 60% | 0.604 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -60.7 | -45.1 | 175.1 | -174.5 | -94.9 | 0 | 0 | 0 | 113 | T207 D211 S212 Y213 | T207-Y209 PolarHBondContact O-N 2.94Å; T207-Y209 VanDerWaalsContact O-N 3.12Å; Y209-D211 VanDerWaalsContact C-N 3.3Å; Y209-D211 PolarHBondContact O-N 3.36Å; Y209-S212 PolarHBondContact O-N 3.48Å; Y209-Y213 HydrophobicContact CD1-CD2 4.46Å; Y209-Y213 AromaticContact CD2-CD2 3.45Å; Y209-Y213 HydrophobicContact CD2-CD2 3.45Å; Y209-Y213 VanDerWaalsContact CD2-CD2 3.45Å; Y209-Y213 AromaticContact CD2-CE2 3.57Å; Y209-Y213 HydrophobicContact CD2-CE2 3.57Å; Y209-Y213 HydrophobicContact CE1-CD2 4.44Å; Y209-Y213 AromaticContact CE2-CD2 3.43Å; Y209-Y213 HydrophobicContact CE2-CD2 3.43Å; Y209-Y213 VanDerWaalsContact CE2-CD2 3.43Å; Y209-Y213 AromaticContact CE2-CE2 3.56Å; Y209-Y213 HydrophobicContact CE2-CE2 3.56Å; Y209-Y213 HydrophobicContact CE2-CG 4.23Å; Y209-Y213 AromaticContact CG-CD2 4Å; Y209-Y213 HydrophobicContact CG-CD2 4Å; Y209-Y213 HydrophobicContact CG-CE2 4.48Å; Y209-Y213 AromaticContact CZ-CD2 3.95Å; Y209-Y213 WeakPolarHBondContact O-CD2 3.25Å; Y209-Y213 PolarHBondContact O-N 3.03Å |
| 210 | R | 75.4 | Confident | 68.7 | Low | 148 Ų | 148 | 130 Ų | 130 | 56% | 0.558 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -69.2 | -30.7 | -178.2 | -156.8 | -174.7 | 177.9 | -176.4 | 2.1 | 112 | D205 T207 | D205-R210 PolarHBondContact O-NH1 3.24Å; D205-R210 IonicContact OD2-NH1 3.16Å; D205-R210 PolarHBondContact OD2-NH1 2.89Å; T207-R210 WeakPolarHBondContact O-CB 3.26Å; T207-R210 PolarHBondContact O-N 2.73Å |
| 211 | D | 76.2 | Confident | 67.6 | Low | 75 Ų | 75 | 131.6 Ų | 131.6 | 40% | 0.401 | 67% | 0.672 | S | S | . | * | H | α-helix | trans | -79.4 | -31.4 | 173.7 | -77.5 | -28.7 | 0 | 0 | 0 | 113.3 | T207 D208 Y209 R214 | T207-D211 PolarHBondContact O-N 3.2Å; T207-D211 VanDerWaalsContact O-N 3.15Å; D208-D211 PolarHBondContact O-N 3.19Å; Y209-D211 VanDerWaalsContact C-N 3.3Å; Y209-D211 PolarHBondContact O-N 3.36Å; D211-R214 IonicContact OD1-CZ 3.61Å; D211-R214 IonicContact OD1-NE 2.69Å; D211-R214 IonicContact OD1-NH2 3.58Å; D211-R214 PolarHBondContact OD1-NH2 3.04Å |
| 212 | S | 78.4 | Confident | 66.8 | Low | 85 Ų | 85 | 130.3 Ų | 130.3 | 59% | 0.594 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -77.2 | -34.6 | 179.9 | -55.6 | 0 | 0 | 0 | 0 | 113.5 | D208 Y209 | D208-S212 VanDerWaalsContact O-CB 3.25Å; D208-S212 WeakPolarHBondContact O-CB 3.36Å; D208-S212 PolarHBondContact O-N 3.32Å; D208-S212 PolarHBondContact O-OG 2.89Å; Y209-S212 PolarHBondContact O-N 3.48Å |
| 213 | Y | 74.9 | Confident | 66.1 | Low | 166 Ų | 166 | 135.2 Ų | 135.2 | 65% | 0.651 | 67% | 0.674 | S | S | * | * | trans | -114.8 | 56.5 | -172 | -64.2 | -80.7 | 0 | 0 | 0 | 112 | Y209 | Y209-Y213 HydrophobicContact CD1-CD2 4.46Å; Y209-Y213 AromaticContact CD2-CD2 3.45Å; Y209-Y213 HydrophobicContact CD2-CD2 3.45Å; Y209-Y213 VanDerWaalsContact CD2-CD2 3.45Å; Y209-Y213 AromaticContact CD2-CE2 3.57Å; Y209-Y213 HydrophobicContact CD2-CE2 3.57Å; Y209-Y213 HydrophobicContact CE1-CD2 4.44Å; Y209-Y213 AromaticContact CE2-CD2 3.43Å; Y209-Y213 HydrophobicContact CE2-CD2 3.43Å; Y209-Y213 VanDerWaalsContact CE2-CD2 3.43Å; Y209-Y213 AromaticContact CE2-CE2 3.56Å; Y209-Y213 HydrophobicContact CE2-CE2 3.56Å; Y209-Y213 HydrophobicContact CE2-CG 4.23Å; Y209-Y213 AromaticContact CG-CD2 4Å; Y209-Y213 HydrophobicContact CG-CD2 4Å; Y209-Y213 HydrophobicContact CG-CE2 4.48Å; Y209-Y213 AromaticContact CZ-CD2 3.95Å; Y209-Y213 WeakPolarHBondContact O-CD2 3.25Å; Y209-Y213 PolarHBondContact O-N 3.03Å | ||
| 214 | R | 70.9 | Confident | 65.4 | Low | 175 Ų | 175 | 132.3 Ų | 132.3 | 66% | 0.66 | 67% | 0.672 | S | S | * | * | trans | -76.5 | 134.6 | 170.8 | -65.1 | -179.3 | 179.6 | -138.6 | 0.9 | 109.7 | D211 L216 | D211-R214 IonicContact OD1-CZ 3.61Å; D211-R214 IonicContact OD1-NE 2.69Å; D211-R214 IonicContact OD1-NH2 3.58Å; D211-R214 PolarHBondContact OD1-NH2 3.04Å; R214-L216 PolarHBondContact O-N 3.26Å | ||
| 215 | T | 65.3 | Low | 64.5 | Low | 144 Ų | 144 | 135 Ų | 135 | 88% | 0.883 | 68% | 0.678 | S | S | * | * | trans | -60.9 | 104.2 | 171.8 | 41.6 | 0 | 0 | 0 | 0 | 109.1 | D217 | T215-D217 PolarHBondContact O-N 3.32Š| ||
| 216 | L | 60.5 | Low | 63.5 | Low | 149 Ų | 149 | 139 Ų | 139 | 78% | 0.78 | 69% | 0.691 | S | S | * | * | trans | -63.2 | 124.6 | 170 | -82.8 | 147.5 | 0 | 0 | 0 | 108.3 | R214 L218 | R214-L216 PolarHBondContact O-N 3.26Å; L216-L218 PolarHBondContact O-N 2.84Å | ||
| 217 | D | 59.6 | Low | 62.5 | Low | 144 Ų | 144 | 142 Ų | 142 | 77% | 0.77 | 70% | 0.702 | S | S | * | * | trans | -66.6 | 98.4 | 171.2 | -140.8 | -25 | 0 | 0 | 0 | 107.6 | T215 S219 | T215-D217 PolarHBondContact O-N 3.32Å; D217-S219 VanDerWaalsContact CG-OG 3.3Å; D217-S219 PolarHBondContact O-N 3.19Å; D217-S219 VanDerWaalsContact O-N 3.16Å; D217-S219 PolarHBondContact OD1-OG 2.86Å | ||
| 218 | L | 58.6 | Low | 61.2 | Low | 141 Ų | 141 | 143.6 Ų | 143.6 | 74% | 0.738 | 71% | 0.711 | S | S | * | * | G | 310 helix | trans | -77.4 | 11.1 | -177 | -74 | 168.1 | 0 | 0 | 0 | 112.6 | L216 E220 | L216-L218 PolarHBondContact O-N 2.84Å; L218-E220 PolarHBondContact O-N 3.45Å |
| 219 | S | 56.8 | Low | 59.7 | Low | 93 Ų | 93 | 143.9 Ų | 143.9 | 65% | 0.65 | 71% | 0.708 | S | S | * | * | G | 310 helix | trans | -69.8 | -9.6 | -174.2 | 39.9 | 0 | 0 | 0 | 0 | 114.5 | D217 | D217-S219 VanDerWaalsContact CG-OG 3.3Å; D217-S219 PolarHBondContact O-N 3.19Å; D217-S219 VanDerWaalsContact O-N 3.16Å; D217-S219 PolarHBondContact OD1-OG 2.86Å |
| 220 | E | 55.8 | Low | 58.3 | Low | 190 Ų | 190 | 145 Ų | 145 | 89% | 0.888 | 72% | 0.718 | S | S | * | * | G | 310 helix | trans | -118.1 | -4.3 | 179.7 | -70.5 | -171.7 | 158.5 | 0 | 0 | 115.9 | L218 | L218-E220 PolarHBondContact O-N 3.45Š|
| 221 | R | 45.8 | Very low | 57 | Low | 222 Ų | 222 | 142.5 Ų | 142.5 | 84% | 0.838 | 72% | 0.72 | S | S | * | * | S | Bend | trans | -99.4 | 105.6 | -176.8 | -146.1 | 171.8 | -160.4 | 160.5 | 4.6 | 112.8 | ||
| 222 | A | 47.8 | Very low | 56.1 | Low | 83 Ų | 83 | 147.7 Ų | 147.7 | 69% | 0.686 | 74% | 0.741 | S | S | * | * | trans | 68.5 | 89 | 160.7 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 223 | R | 53 | Low | 55 | Low | 231 Ų | 231 | 152.3 Ų | 152.3 | 87% | 0.872 | 75% | 0.751 | S | S | * | * | trans | -45.1 | 128.9 | 149.1 | -62 | 178.9 | -178.1 | -172.7 | 0.3 | 107.3 | I225 | R223-I225 PolarHBondContact O-N 3.14Š| ||
| 224 | P | 53 | Low | 54.5 | Low | 112 Ų | 112 | 150.3 Ų | 150.3 | 73% | 0.727 | 76% | 0.755 | S | S | * | * | trans | -54.7 | 121.6 | 175.4 | 20.1 | -29 | 0 | 0 | 0 | 107.3 | K226 | P224-K226 PolarHBondContact O-N 2.91Š| ||
| 225 | I | 52.6 | Low | 54.3 | Low | 149 Ų | 149 | 148.5 Ų | 148.5 | 76% | 0.764 | 76% | 0.764 | S | S | * | * | trans | -56.7 | 100.4 | 168.9 | -62.7 | 169.6 | 0 | 0 | 0 | 104.2 | R223 N227 | R223-I225 PolarHBondContact O-N 3.14Å; I225-N227 VanDerWaalsContact C-N 3.26Å; I225-N227 PolarHBondContact O-N 2.8Å | ||
| 226 | K | 47.2 | Very low | 54.6 | Low | 183 Ų | 183 | 147 Ų | 147 | 80% | 0.796 | 75% | 0.754 | S | S | * | * | trans | -61.8 | 100.2 | 167.8 | -75.8 | -177.4 | 177.9 | -179.9 | 0 | 104.1 | P224 V228 | P224-K226 PolarHBondContact O-N 2.91Å; K226-V228 VanDerWaalsContact C-N 3.28Å; K226-V228 PolarHBondContact O-N 3Å | ||
| 227 | N | 48.6 | Very low | 55.1 | Low | 126 Ų | 126 | 145.3 Ų | 145.3 | 67% | 0.674 | 75% | 0.752 | S | S | * | * | trans | -55.4 | 106.3 | 161.7 | -74.2 | -24.4 | 0 | 0 | 0 | 104.9 | I225 E229 | I225-N227 VanDerWaalsContact C-N 3.26Å; I225-N227 PolarHBondContact O-N 2.8Å; N227-E229 HydrophobicContact CB-CG 4.17Å; N227-E229 PolarHBondContact O-N 2.86Å | ||
| 228 | V | 47.7 | Very low | 55.7 | Low | 113 Ų | 113 | 145.4 Ų | 145.4 | 69% | 0.685 | 75% | 0.75 | S | S | * | * | trans | -71.2 | 70.7 | 168.6 | -177.5 | 0 | 0 | 0 | 0 | 105.1 | K226 H230 | K226-V228 VanDerWaalsContact C-N 3.28Å; K226-V228 PolarHBondContact O-N 3Å; V228-H230 PolarHBondContact O-N 3Å; V228-H230 VanDerWaalsContact O-N 3.17Å; V228-H230 PolarHBondContact O-ND1 3.17Å | ||
| 229 | E | 46.4 | Very low | 56.5 | Low | 139 Ų | 139 | 148 Ų | 148 | 65% | 0.65 | 76% | 0.758 | S | S | * | * | trans | -66.1 | 114.6 | 166 | -72 | -176.4 | -179.7 | 0 | 0 | 105.6 | N227 T231 | N227-E229 HydrophobicContact CB-CG 4.17Å; N227-E229 PolarHBondContact O-N 2.86Å; E229-T231 HydrophobicContact CB-CG2 4.19Å; E229-T231 PolarHBondContact O-N 3.13Å | ||
| 230 | H | 50.2 | Low | 57.4 | Low | 177 Ų | 177 | 150.1 Ų | 150.1 | 82% | 0.819 | 76% | 0.757 | S | S | * | * | trans | -67.7 | 66 | 173.2 | -65.1 | 67.1 | 0 | 0 | 0 | 108.4 | V228 H232 | V228-H230 PolarHBondContact O-N 3Å; V228-H230 VanDerWaalsContact O-N 3.17Å; V228-H230 PolarHBondContact O-ND1 3.17Å; H230-H232 PolarHBondContact O-N 3.2Å | ||
| 231 | T | 47.6 | Very low | 58.7 | Low | 95 Ų | 95 | 146 Ų | 146 | 58% | 0.583 | 74% | 0.741 | S | S | * | * | trans | -88 | 97.8 | 170.2 | 51.5 | 0 | 0 | 0 | 0 | 106.2 | E229 K233 | E229-T231 HydrophobicContact CB-CG2 4.19Å; E229-T231 PolarHBondContact O-N 3.13Å; T231-K233 VanDerWaalsContact C-N 3.29Å; T231-K233 PolarHBondContact O-N 2.82Å | ||
| 232 | H | 58 | Low | 60.5 | Low | 185 Ų | 185 | 138.2 Ų | 138.2 | 86% | 0.856 | 72% | 0.721 | S | S | * | * | trans | -54.9 | 100.5 | 162.4 | -102.7 | -89.7 | 0 | 0 | 0 | 107 | H230 V234 | H230-H232 PolarHBondContact O-N 3.2Å; H232-V234 PolarHBondContact O-N 3.01Å | ||
| 233 | K | 55.2 | Low | 62.4 | Low | 182 Ų | 182 | 139.7 Ų | 139.7 | 79% | 0.791 | 72% | 0.721 | S | S | * | * | trans | -60 | 112 | 170.3 | -68 | -175.7 | 179.5 | -176.5 | 0 | 106.2 | T231 T235 | T231-K233 VanDerWaalsContact C-N 3.29Å; T231-K233 PolarHBondContact O-N 2.82Å; K233-T235 PolarHBondContact O-N 2.96Å | ||
| 234 | V | 63.5 | Low | 64 | Low | 124 Ų | 124 | 134.3 Ų | 134.3 | 75% | 0.752 | 71% | 0.706 | S | S | * | * | trans | -59.3 | 113.4 | 174.5 | 175.7 | 0 | 0 | 0 | 0 | 107.2 | H232 V236 | H232-V234 PolarHBondContact O-N 3.01Å; V234-V236 HydrophobicContact CG1-CB 4.21Å; V234-V236 HydrophobicContact CG1-CG2 4.47Å; V234-V236 PolarHBondContact O-N 2.85Å | ||
| 235 | T | 66.2 | Low | 65.6 | Low | 136 Ų | 136 | 134.2 Ų | 134.2 | 83% | 0.834 | 70% | 0.697 | S | S | * | * | trans | -71.8 | -9.8 | -175.4 | -47.8 | 0 | 0 | 0 | 0 | 112.9 | K233 P237 | K233-T235 PolarHBondContact O-N 2.96Å; T235-P237 VanDerWaalsContact O-CD 3.26Å; T235-P237 WeakPolarHBondContact O-CD 3.43Å | ||
| 236 | V | 71.8 | Confident | 67 | Low | 113 Ų | 113 | 133.1 Ų | 133.1 | 69% | 0.685 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -80.2 | 114.7 | 178.9 | -174 | 0 | 0 | 0 | 0 | 108.7 | V234 M238 | V234-V236 HydrophobicContact CG1-CB 4.21Å; V234-V236 HydrophobicContact CG1-CG2 4.47Å; V234-V236 PolarHBondContact O-N 2.85Å; V236-M238 PolarHBondContact O-N 2.94Å |
| 237 | P | 71.9 | Confident | 69 | Low | 114 Ų | 114 | 128.8 Ų | 128.8 | 74% | 0.74 | 67% | 0.674 | S | S | * | * | trans | -63.1 | 120.9 | 174.2 | 25.1 | -29.7 | 0 | 0 | 0 | 108.5 | T235 | T235-P237 VanDerWaalsContact O-CD 3.26Å; T235-P237 WeakPolarHBondContact O-CD 3.43Å | ||
| 238 | M | 71.4 | Confident | 70.7 | Confident | 145 Ų | 145 | 131 Ų | 131 | 71% | 0.714 | 67% | 0.674 | S | S | * | * | trans | -65.4 | 136.3 | 171 | 176.6 | -176.4 | -140.2 | 0 | 0 | 108.2 | V236 H240 | V236-M238 PolarHBondContact O-N 2.94Å; M238-H240 WeakPolarHBondContact CB-ND1 3.43Å; M238-H240 HydrophobicContact CG-CB 4.17Å; M238-H240 PolarHBondContact O-CE1 3.08Å; M238-H240 PolarHBondContact O-N 2.75Å; M238-H240 PolarHBondContact O-ND1 3.01Å; M238-H240 HydrophobicContact SD-CB 4.18Å | ||
| 239 | E | 76.2 | Confident | 72.4 | Confident | 196 Ų | 196 | 132.6 Ų | 132.6 | 92% | 0.916 | 67% | 0.669 | S | S | * | * | trans | -82.7 | 90 | 165 | -77.9 | -179.2 | 159.1 | 0 | 0 | 108.1 | ||||
| 240 | H | 75.8 | Confident | 73.8 | Confident | 137 Ų | 137 | 136.1 Ų | 136.1 | 63% | 0.634 | 68% | 0.676 | S | S | * | * | trans | -96.4 | 0.2 | -176.3 | 28.1 | -81.9 | 0 | 0 | 0 | 114 | M238 S242 | M238-H240 WeakPolarHBondContact CB-ND1 3.43Å; M238-H240 HydrophobicContact CG-CB 4.17Å; M238-H240 PolarHBondContact O-CE1 3.08Å; M238-H240 PolarHBondContact O-N 2.75Å; M238-H240 PolarHBondContact O-ND1 3.01Å; M238-H240 HydrophobicContact SD-CB 4.18Å; H240-S242 PolarHBondContact O-N 2.95Å | ||
| 241 | L | 82.7 | Confident | 75.4 | Confident | 103 Ų | 103 | 134.4 Ų | 134.4 | 54% | 0.539 | 67% | 0.666 | S | S | . | * | trans | -86 | 111.4 | 177.3 | -65.2 | 176.8 | 0 | 0 | 0 | 109.8 | M245 | L241-M245 HydrophobicContact CD2-CB 4.16Å; L241-M245 HydrophobicContact CD2-CE 3.97Å; L241-M245 HydrophobicContact CD2-SD 4.48Å | ||
| 242 | S | 84.4 | Confident | 76.7 | Confident | 60 Ų | 60 | 135.1 Ų | 135.1 | 42% | 0.42 | 67% | 0.671 | S | S | . | * | trans | -64.7 | 155.7 | 166.7 | 63.6 | 0 | 0 | 0 | 0 | 110.4 | H240 H244 M245 H246 | H240-S242 PolarHBondContact O-N 2.95Å; S242-H244 PolarHBondContact O-N 3.17Å; S242-H244 VanDerWaalsContact O-N 3.14Å; S242-M245 PolarHBondContact O-N 2.98Å; S242-M245 WeakPolarHBondContact OG-CG 3.46Å; S242-M245 PolarHBondContact OG-N 3.32Å; S242-H246 PolarHBondContact O-N 3.46Å | ||
| 243 | T | 86.4 | Confident | 77.5 | Confident | 113 Ų | 113 | 132.4 Ų | 132.4 | 69% | 0.693 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -52 | -37.6 | 175.7 | 51.2 | 0 | 0 | 0 | 0 | 111.9 | M245 H246 D247 | T243-M245 PolarHBondContact O-N 3.02Å; T243-H246 PolarHBondContact O-N 3.36Å; T243-D247 WeakPolarHBondContact O-CB 3.39Å; T243-D247 VanDerWaalsContact O-CG 3.22Å; T243-D247 PolarHBondContact O-N 2.89Å |
| 244 | H | 86.7 | Confident | 78.5 | Confident | 118 Ų | 118 | 131.3 Ų | 131.3 | 55% | 0.546 | 67% | 0.668 | S | S | . | * | H | α-helix | trans | -61 | -45.2 | 174.5 | -179.9 | -86.7 | 0 | 0 | 0 | 113.1 | S242 H246 Y248 | S242-H244 PolarHBondContact O-N 3.17Å; S242-H244 VanDerWaalsContact O-N 3.14Å; H244-H246 VanDerWaalsContact C-N 3.28Å; H244-H246 PolarHBondContact O-N 3.5Å; H244-Y248 AromaticContact CD2-CD2 3.73Å; H244-Y248 WeakPolarHBondContact O-CB 3.31Å; H244-Y248 WeakPolarHBondContact O-CD2 3.06Å; H244-Y248 PolarHBondContact O-N 3.16Å |
| 245 | M | 86.5 | Confident | 79.2 | Confident | 111 Ų | 111 | 130.7 Ų | 130.7 | 55% | 0.547 | 67% | 0.667 | S | S | . | * | H | α-helix | trans | -69.5 | -29.1 | 177.8 | -69.3 | 179.6 | 73 | 0 | 0 | 112.3 | L241 S242 T243 | L241-M245 HydrophobicContact CD2-CB 4.16Å; L241-M245 HydrophobicContact CD2-CE 3.97Å; L241-M245 HydrophobicContact CD2-SD 4.48Å; S242-M245 PolarHBondContact O-N 2.98Å; S242-M245 WeakPolarHBondContact OG-CG 3.46Å; S242-M245 PolarHBondContact OG-N 3.32Å; T243-M245 PolarHBondContact O-N 3.02Å |
| 246 | H | 83.3 | Confident | 79.9 | Confident | 126 Ų | 126 | 129.7 Ų | 129.7 | 58% | 0.583 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -74.1 | -41.5 | 176.5 | -151.3 | 66.9 | 0 | 0 | 0 | 112 | S242 T243 H244 Y249 | S242-H246 PolarHBondContact O-N 3.46Å; T243-H246 PolarHBondContact O-N 3.36Å; H244-H246 VanDerWaalsContact C-N 3.28Å; H244-H246 PolarHBondContact O-N 3.5Å; H246-Y249 WeakPolarHBondContact O-CD1 3.28Å |
| 247 | D | 87.8 | Confident | 80.2 | Confident | 91 Ų | 91 | 128.3 Ų | 128.3 | 49% | 0.487 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -84.6 | -32.5 | -174.6 | -65.5 | -22.1 | 0 | 0 | 0 | 113.5 | T243 | T243-D247 WeakPolarHBondContact O-CB 3.39Å; T243-D247 VanDerWaalsContact O-CG 3.22Å; T243-D247 PolarHBondContact O-N 2.89Å |
| 248 | Y | 84.8 | Confident | 80.6 | Confident | 172 Ų | 172 | 127 Ų | 127 | 68% | 0.675 | 66% | 0.659 | S | S | * | * | S | Bend | trans | -113.8 | 59.1 | -173.9 | -61.3 | -89.3 | 0 | 0 | 0 | 112.6 | H244 | H244-Y248 AromaticContact CD2-CD2 3.73Å; H244-Y248 WeakPolarHBondContact O-CB 3.31Å; H244-Y248 WeakPolarHBondContact O-CD2 3.06Å; H244-Y248 PolarHBondContact O-N 3.16Å |
| 249 | Y | 84.4 | Confident | 80.9 | Confident | 147 Ų | 147 | 126.4 Ų | 126.4 | 58% | 0.576 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -86.9 | 167.5 | 163.5 | 68.2 | -84.3 | 0 | 0 | 0 | 111 | H246 K251 | H246-Y249 WeakPolarHBondContact O-CD1 3.28Å; Y249-K251 HydrophobicContact CE2-CG 4.12Å; Y249-K251 PolarHBondContact O-N 3.3Å |
| 250 | W | 76 | Confident | 81.1 | Confident | 213 Ų | 213 | 125.1 Ų | 125.1 | 81% | 0.807 | 66% | 0.66 | S | S | * | * | trans | -64.7 | 104 | 175.2 | 54.4 | -82.7 | 0 | 0 | 0 | 109.7 | T252 | W250-T252 HydrophobicContact CE3-CG2 3.84Å; W250-T252 HydrophobicContact CZ3-CG2 3.51Å | ||
| 251 | K | 82.1 | Confident | 81.1 | Confident | 141 Ų | 141 | 124.6 Ų | 124.6 | 61% | 0.613 | 67% | 0.668 | S | S | * | * | trans | -81.3 | 119.8 | 174.6 | -65.7 | 178.9 | -176.4 | 177 | 0 | 108.3 | Y249 T253 | Y249-K251 HydrophobicContact CE2-CG 4.12Å; Y249-K251 PolarHBondContact O-N 3.3Å; K251-T253 PolarHBondContact O-N 3.48Å | ||
| 252 | T | 75.1 | Confident | 80.5 | Confident | 111 Ų | 111 | 128.2 Ų | 128.2 | 68% | 0.681 | 68% | 0.682 | S | S | * | * | trans | -69.7 | 98.7 | 169.2 | 40.4 | 0 | 0 | 0 | 0 | 109 | W250 I254 | W250-T252 HydrophobicContact CE3-CG2 3.84Å; W250-T252 HydrophobicContact CZ3-CG2 3.51Å; T252-I254 PolarHBondContact O-N 3.13Å | ||
| 253 | T | 75.3 | Confident | 79.8 | Confident | 127 Ų | 127 | 135.4 Ų | 135.4 | 78% | 0.779 | 70% | 0.702 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 116.6 | 166 | 41 | 0 | 0 | 0 | 0 | 108.6 | K251 P255 | K251-T253 PolarHBondContact O-N 3.48Å; T253-P255 WeakPolarHBondContact O-CD 3.45Å |
| 254 | I | 76.5 | Confident | 78.9 | Confident | 159 Ų | 159 | 135.3 Ų | 135.3 | 82% | 0.815 | 70% | 0.702 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 119.7 | 163.6 | -57.1 | 171.2 | 0 | 0 | 0 | 105.7 | T252 S256 | T252-I254 PolarHBondContact O-N 3.13Å; I254-S256 PolarHBondContact O-N 3.41Å |
| 255 | P | 77.4 | Confident | 77.9 | Confident | 111 Ų | 111 | 131.6 Ų | 131.6 | 72% | 0.721 | 70% | 0.695 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 137.8 | 176.2 | 23.1 | -31.2 | 0 | 0 | 0 | 109.1 | T253 A257 | T253-P255 WeakPolarHBondContact O-CD 3.45Å; P255-A257 PolarHBondContact O-N 2.81Å |
| 256 | S | 80.7 | Confident | 77.1 | Confident | 115 Ų | 115 | 134 Ų | 134 | 80% | 0.804 | 71% | 0.708 | S | S | * | * | P | Polyproline II helix | trans | -52.8 | 127.9 | 178.6 | -173.5 | 0 | 0 | 0 | 0 | 109.7 | I254 S258 | I254-S256 PolarHBondContact O-N 3.41Å; S256-S258 PolarHBondContact O-N 3.25Å |
| 257 | A | 78.1 | Confident | 76.3 | Confident | 85 Ų | 85 | 135.6 Ų | 135.6 | 70% | 0.702 | 72% | 0.716 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 131.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 109 | P255 C259 | P255-A257 PolarHBondContact O-N 2.81Å; A257-C259 PolarHBondContact O-N 3.34Å |
| 258 | S | 80.2 | Confident | 75.6 | Confident | 85 Ų | 85 | 136.8 Ų | 136.8 | 59% | 0.594 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -59 | 127.7 | -178.3 | 115 | 0 | 0 | 0 | 0 | 109.5 | S256 K260 | S256-S258 PolarHBondContact O-N 3.25Å; S258-K260 PolarHBondContact O-N 2.95Å; S258-K260 WeakPolarHBondContact OG-CB 3.43Å; S258-K260 PolarHBondContact OG-N 3.15Å |
| 259 | C | 79.6 | Confident | 75.2 | Confident | 133 Ų | 133 | 135.1 Ų | 135.1 | 90% | 0.899 | 73% | 0.725 | S | S | * | * | trans | -73.2 | 10.9 | 173.9 | -52.3 | 0 | 0 | 0 | 0 | 113.1 | A257 | A257-C259 PolarHBondContact O-N 3.34Š| ||
| 260 | K | 79.2 | Confident | 74.9 | Confident | 170 Ų | 170 | 135.2 Ų | 135.2 | 74% | 0.739 | 73% | 0.731 | S | S | * | * | S | Bend | trans | -75.3 | 131.4 | 174.6 | -60.7 | -179.6 | 178.2 | 179.3 | 0 | 108 | S258 E262 | S258-K260 PolarHBondContact O-N 2.95Å; S258-K260 WeakPolarHBondContact OG-CB 3.43Å; S258-K260 PolarHBondContact OG-N 3.15Å; K260-E262 PolarHBondContact O-N 3.35Å |
| 261 | P | 75.5 | Confident | 75.1 | Confident | 125 Ų | 125 | 130.9 Ų | 130.9 | 81% | 0.812 | 73% | 0.73 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 133.3 | 173.5 | 24.3 | -32.1 | 0 | 0 | 0 | 108.9 | Y263 | P261-Y263 PolarHBondContact O-N 3.05Š|
| 262 | E | 70.8 | Confident | 75 | Confident | 179 Ų | 179 | 132.1 Ų | 132.1 | 84% | 0.836 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 118.8 | 174.8 | -164 | 168.2 | -163.5 | 0 | 0 | 107.9 | K260 T264 | K260-E262 PolarHBondContact O-N 3.35Å; E262-T264 VanDerWaalsContact C-N 3.28Å; E262-T264 PolarHBondContact O-N 3.43Å |
| 263 | Y | 69.8 | Low | 75.3 | Confident | 211 Ų | 211 | 134.9 Ų | 134.9 | 83% | 0.827 | 74% | 0.741 | S | S | * | * | trans | -71.6 | 88.6 | 178.6 | -175.4 | -95.2 | 0 | 0 | 0 | 108.5 | P261 G265 | P261-Y263 PolarHBondContact O-N 3.05Å; Y263-G265 PolarHBondContact O-N 3.32Å; Y263-G265 VanDerWaalsContact O-N 3.14Å | ||
| 264 | T | 67.2 | Low | 75.5 | Confident | 112 Ų | 112 | 135.7 Ų | 135.7 | 69% | 0.687 | 73% | 0.734 | S | S | * | * | trans | -72.7 | 100.9 | 162.2 | 49.4 | 0 | 0 | 0 | 0 | 106.2 | E262 I266 | E262-T264 VanDerWaalsContact C-N 3.28Å; E262-T264 PolarHBondContact O-N 3.43Å; T264-I266 PolarHBondContact O-N 2.93Å; T264-I266 VanDerWaalsContact O-N 3.08Å | ||
| 265 | G | 65.9 | Low | 75.8 | Confident | 39 Ų | 39 | 132 Ų | 132 | 40% | 0.402 | 72% | 0.716 | S | S | . | * | trans | -51.8 | 123.3 | 172.9 | 0 | 0 | 0 | 0 | 0 | 108.2 | Y263 Q267 | Y263-G265 PolarHBondContact O-N 3.32Å; Y263-G265 VanDerWaalsContact O-N 3.14Å; G265-Q267 VanDerWaalsContact C-N 3.25Å; G265-Q267 PolarHBondContact O-N 2.76Å | ||
| 266 | I | 68.7 | Low | 76.1 | Confident | 162 Ų | 162 | 130.6 Ų | 130.6 | 83% | 0.831 | 71% | 0.705 | S | S | * | * | trans | -61.6 | 94.2 | 177.5 | -58.1 | 170.3 | 0 | 0 | 0 | 106.5 | T264 N268 | T264-I266 PolarHBondContact O-N 2.93Å; T264-I266 VanDerWaalsContact O-N 3.08Å; I266-N268 PolarHBondContact O-N 2.81Å | ||
| 267 | Q | 66.8 | Low | 76.3 | Confident | 159 Ų | 159 | 130.3 Ų | 130.3 | 74% | 0.743 | 70% | 0.698 | S | S | * | * | trans | -83 | 105.8 | 171.7 | -64.4 | -141.7 | -21.4 | 0 | 0 | 106.4 | G265 N269 | G265-Q267 VanDerWaalsContact C-N 3.25Å; G265-Q267 PolarHBondContact O-N 2.76Å; Q267-N269 PolarHBondContact O-N 3.05Å | ||
| 268 | N | 72.9 | Confident | 76.7 | Confident | 116 Ų | 116 | 132 Ų | 132 | 62% | 0.62 | 69% | 0.692 | S | S | * | * | trans | -72 | 100.6 | 169 | -165.8 | -4.1 | 0 | 0 | 0 | 107.8 | I266 E270 | I266-N268 PolarHBondContact O-N 2.81Å; N268-E270 WeakPolarHBondContact OD1-CB 3.48Å; N268-E270 WeakPolarHBondContact OD1-CG 3.43Å; N268-E270 PolarHBondContact OD1-N 3.26Å | ||
| 269 | N | 76.2 | Confident | 76.9 | Confident | 137 Ų | 137 | 135.3 Ų | 135.3 | 73% | 0.733 | 69% | 0.691 | S | S | * | * | trans | -83 | 5 | 174.4 | -69.8 | -21.2 | 0 | 0 | 0 | 112 | Q267 P271 | Q267-N269 PolarHBondContact O-N 3.05Å; N269-P271 WeakPolarHBondContact O-CD 3.46Å | ||
| 270 | E | 80 | Confident | 77 | Confident | 149 Ų | 149 | 133.8 Ų | 133.8 | 70% | 0.696 | 67% | 0.673 | S | S | * | * | S | Bend | trans | -68.1 | 123.2 | 173.7 | -70.6 | -176.8 | 149.8 | 0 | 0 | 110.3 | N268 F272 | N268-E270 WeakPolarHBondContact OD1-CB 3.48Å; N268-E270 WeakPolarHBondContact OD1-CG 3.43Å; N268-E270 PolarHBondContact OD1-N 3.26Å; E270-F272 PolarHBondContact O-N 3.12Å |
| 271 | P | 79.5 | Confident | 77.3 | Confident | 123 Ų | 123 | 130.5 Ų | 130.5 | 80% | 0.799 | 66% | 0.664 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 124.5 | 174.8 | -18.7 | 30.4 | 0 | 0 | 0 | 110 | N269 Q273 | N269-P271 WeakPolarHBondContact O-CD 3.46Å; P271-Q273 PolarHBondContact O-N 3.12Å |
| 272 | F | 79.9 | Confident | 77.7 | Confident | 167 Ų | 167 | 132.7 Ų | 132.7 | 73% | 0.732 | 66% | 0.657 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 123.9 | 172.6 | 177.7 | -113.1 | 0 | 0 | 0 | 109.8 | E270 K274 | E270-F272 PolarHBondContact O-N 3.12Å; F272-K274 VanDerWaalsContact C-N 3.34Å; F272-K274 HydrophobicContact CD1-CB 4.4Å; F272-K274 HydrophobicContact CD1-CD 4.42Å; F272-K274 HydrophobicContact CD1-CG 3.39Å; F272-K274 HydrophobicContact CE1-CG 3.89Å; F272-K274 HydrophobicContact CG-CG 4.42Å; F272-K274 PolarHBondContact O-N 3.41Å |
| 273 | Q | 81.5 | Confident | 78.3 | Confident | 169 Ų | 169 | 129.5 Ų | 129.5 | 79% | 0.79 | 64% | 0.64 | S | S | * | * | trans | -71.8 | 88.8 | 177.6 | -165.6 | 162.1 | -2.1 | 0 | 0 | 109.5 | P271 D275 | P271-Q273 PolarHBondContact O-N 3.12Å; Q273-D275 PolarHBondContact O-N 3.03Å | ||
| 274 | K | 78.5 | Confident | 78.8 | Confident | 144 Ų | 144 | 124.3 Ų | 124.3 | 63% | 0.626 | 64% | 0.641 | S | S | * | * | trans | -75.5 | -5.6 | -175 | -73.2 | 175.5 | -175.2 | 178.9 | 0 | 114.4 | F272 T276 | F272-K274 VanDerWaalsContact C-N 3.34Å; F272-K274 HydrophobicContact CD1-CB 4.4Å; F272-K274 HydrophobicContact CD1-CD 4.42Å; F272-K274 HydrophobicContact CD1-CG 3.39Å; F272-K274 HydrophobicContact CE1-CG 3.89Å; F272-K274 HydrophobicContact CG-CG 4.42Å; F272-K274 PolarHBondContact O-N 3.41Å; K274-T276 PolarHBondContact O-N 2.85Å | ||
| 275 | D | 83.9 | Confident | 79.2 | Confident | 81 Ų | 81 | 127.4 Ų | 127.4 | 43% | 0.433 | 64% | 0.64 | S | S | . | * | trans | -83.7 | 105 | -173.3 | -63.6 | -33.3 | 0 | 0 | 0 | 110.2 | Q273 R279 I280 | Q273-D275 PolarHBondContact O-N 3.03Å; D275-R279 IonicContact OD1-CZ 3.63Å; D275-R279 VanDerWaalsContact OD1-CZ 3.26Å; D275-R279 IonicContact OD1-NE 3.03Å; D275-R279 PolarHBondContact OD1-NE 2.71Å; D275-R279 IonicContact OD1-NH2 3.7Å; D275-R279 PolarHBondContact OD1-NH2 3.18Å; D275-I280 HydrophobicContact CB-CD1 3.95Å; D275-I280 HydrophobicContact CB-CG1 4.02Å | ||
| 276 | T | 83.4 | Confident | 79.1 | Confident | 82 Ų | 82 | 134.2 Ų | 134.2 | 50% | 0.503 | 66% | 0.662 | S | S | . | * | trans | -84.8 | 153.6 | 168.4 | 63.3 | 0 | 0 | 0 | 0 | 109.4 | K274 H278 R279 I280 | K274-T276 PolarHBondContact O-N 2.85Å; T276-H278 PolarHBondContact O-N 2.99Å; T276-R279 WeakPolarHBondContact O-CA 3.44Å; T276-R279 WeakPolarHBondContact O-CB 3.33Å; T276-R279 PolarHBondContact O-N 2.99Å; T276-R279 PolarHBondContact OG1-N 3.07Å; T276-I280 PolarHBondContact O-N 2.92Å; T276-I280 VanDerWaalsContact O-N 3.14Å | ||
| 277 | T | 85 | Confident | 78.9 | Confident | 108 Ų | 108 | 134 Ų | 134 | 66% | 0.663 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -49.1 | -44.9 | 176.9 | 51.1 | 0 | 0 | 0 | 0 | 111.5 | R279 I280 D281 | T277-R279 VanDerWaalsContact C-N 3.33Å; T277-R279 PolarHBondContact O-N 3.32Å; T277-I280 PolarHBondContact O-N 2.81Å; T277-D281 WeakPolarHBondContact O-CB 3.33Å; T277-D281 PolarHBondContact O-N 2.83Å |
| 278 | H | 85.6 | Confident | 78.5 | Confident | 122 Ų | 122 | 132 Ų | 132 | 57% | 0.565 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -58.7 | -38.9 | 175.9 | -177.3 | -79.7 | 0 | 0 | 0 | 113.8 | T276 Y282 | T276-H278 PolarHBondContact O-N 2.99Å; H278-Y282 AromaticContact CD2-CD2 3.63Å; H278-Y282 AromaticContact NE2-CD2 3.9Å; H278-Y282 WeakPolarHBondContact O-CB 3.42Å; H278-Y282 PolarHBondContact O-N 3.09Å |
| 279 | R | 83.9 | Confident | 77.3 | Confident | 153 Ų | 153 | 132.7 Ų | 132.7 | 58% | 0.577 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -71.8 | -31.3 | -179.5 | -162 | 175.6 | 107.7 | 105.1 | -0.6 | 112.2 | D275 T276 T277 | D275-R279 IonicContact OD1-CZ 3.63Å; D275-R279 VanDerWaalsContact OD1-CZ 3.26Å; D275-R279 IonicContact OD1-NE 3.03Å; D275-R279 PolarHBondContact OD1-NE 2.71Å; D275-R279 IonicContact OD1-NH2 3.7Å; D275-R279 PolarHBondContact OD1-NH2 3.18Å; T276-R279 WeakPolarHBondContact O-CA 3.44Å; T276-R279 WeakPolarHBondContact O-CB 3.33Å; T276-R279 PolarHBondContact O-N 2.99Å; T276-R279 PolarHBondContact OG1-N 3.07Å; T277-R279 VanDerWaalsContact C-N 3.33Å; T277-R279 PolarHBondContact O-N 3.32Å |
| 280 | I | 82.9 | Confident | 76 | Confident | 101 Ų | 101 | 136.7 Ų | 136.7 | 52% | 0.518 | 67% | 0.669 | S | S | . | * | H | α-helix | trans | -76.3 | -46.8 | 175.8 | -62.3 | 169.4 | 0 | 0 | 0 | 110.3 | D275 T276 T277 | D275-I280 HydrophobicContact CB-CD1 3.95Å; D275-I280 HydrophobicContact CB-CG1 4.02Å; T276-I280 PolarHBondContact O-N 2.92Å; T276-I280 VanDerWaalsContact O-N 3.14Å; T277-I280 PolarHBondContact O-N 2.81Å |
| 281 | D | 86.2 | Confident | 74.4 | Confident | 101 Ų | 101 | 135.6 Ų | 135.6 | 54% | 0.54 | 67% | 0.672 | S | S | . | * | H | α-helix | trans | -75.2 | -38.9 | -171.6 | -63.4 | -21.8 | 0 | 0 | 0 | 112.3 | T277 | T277-D281 WeakPolarHBondContact O-CB 3.33Å; T277-D281 PolarHBondContact O-N 2.83Å |
| 282 | Y | 83.7 | Confident | 72.7 | Confident | 171 Ų | 171 | 132.9 Ų | 132.9 | 67% | 0.671 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.2 | 57.7 | -176.3 | -59.9 | -85.1 | 0 | 0 | 0 | 112.2 | H278 | H278-Y282 AromaticContact CD2-CD2 3.63Å; H278-Y282 AromaticContact NE2-CD2 3.9Å; H278-Y282 WeakPolarHBondContact O-CB 3.42Å; H278-Y282 PolarHBondContact O-N 3.09Å |
| 283 | K | 82.1 | Confident | 71.1 | Confident | 112 Ų | 112 | 130.7 Ų | 130.7 | 49% | 0.487 | 66% | 0.663 | S | S | . | * | trans | -75 | 149.3 | 168.4 | 63.8 | -175.3 | 178.7 | -178.8 | 0 | 111.1 | W285 | K283-W285 HydrophobicContact CD-CH2 4.38Å; K283-W285 HydrophobicContact CD-CZ2 4.33Å; K283-W285 HydrophobicContact CG-CD2 4.24Å; K283-W285 HydrophobicContact CG-CZ2 4.08Å; K283-W285 PolarHBondContact O-N 3.01Å | ||
| 284 | A | 81.1 | Confident | 69.5 | Low | 103 Ų | 103 | 129.6 Ų | 129.6 | 85% | 0.851 | 66% | 0.661 | S | S | * | * | trans | -65.5 | 104.6 | 168.9 | 0 | 0 | 0 | 0 | 0 | 108 | E286 | A284-E286 PolarHBondContact O-N 2.86Š| ||
| 285 | W | 75.3 | Confident | 67.9 | Low | 177 Ų | 177 | 127 Ų | 127 | 67% | 0.67 | 66% | 0.66 | S | S | * | * | trans | -70.4 | 127.9 | 171.8 | -62.3 | 96.3 | 0 | 0 | 0 | 107.6 | K283 L287 | K283-W285 HydrophobicContact CD-CH2 4.38Å; K283-W285 HydrophobicContact CD-CZ2 4.33Å; K283-W285 HydrophobicContact CG-CD2 4.24Å; K283-W285 HydrophobicContact CG-CZ2 4.08Å; K283-W285 PolarHBondContact O-N 3.01Å; W285-L287 VanDerWaalsContact C-N 3.33Å; W285-L287 PolarHBondContact O-N 3.34Å | ||
| 286 | E | 64.5 | Low | 65.8 | Low | 182 Ų | 182 | 126.8 Ų | 126.8 | 85% | 0.85 | 67% | 0.671 | S | S | * | * | trans | -55 | 106 | 165.2 | -76.9 | 179.6 | 170.4 | 0 | 0 | 106.5 | A284 T288 | A284-E286 PolarHBondContact O-N 2.86Å; E286-T288 PolarHBondContact O-N 3.28Å | ||
| 287 | L | 63.3 | Low | 63.9 | Low | 158 Ų | 158 | 129.5 Ų | 129.5 | 83% | 0.827 | 68% | 0.682 | S | S | * | * | trans | -62 | 95.7 | 157.6 | -72.8 | 167.4 | 0 | 0 | 0 | 103.2 | W285 D289 | W285-L287 VanDerWaalsContact C-N 3.33Å; W285-L287 PolarHBondContact O-N 3.34Å; L287-D289 PolarHBondContact O-N 2.77Å | ||
| 288 | T | 58.2 | Low | 62 | Low | 116 Ų | 116 | 132.3 Ų | 132.3 | 71% | 0.712 | 69% | 0.687 | S | S | * | * | trans | -50.2 | 107.4 | 158.4 | 43.5 | 0 | 0 | 0 | 0 | 104 | E286 R290 | E286-T288 PolarHBondContact O-N 3.28Å; T288-R290 VanDerWaalsContact C-N 3.34Å; T288-R290 PolarHBondContact O-N 2.85Å | ||
| 289 | D | 49.7 | Very low | 60.1 | Low | 131 Ų | 131 | 130.9 Ų | 130.9 | 70% | 0.701 | 70% | 0.696 | S | S | * | * | trans | -44.8 | 111.8 | 168.2 | -80.4 | -36.2 | 0 | 0 | 0 | 104.1 | L287 T291 | L287-D289 PolarHBondContact O-N 2.77Å; D289-T291 HydrophobicContact CB-CG2 3.86Å; D289-T291 PolarHBondContact O-N 3.23Å; D289-T291 PolarHBondContact O-OG1 3.24Å; D289-T291 VanDerWaalsContact O-OG1 3.14Å | ||
| 290 | R | 47.9 | Very low | 58.5 | Low | 221 Ų | 221 | 128.4 Ų | 128.4 | 83% | 0.834 | 70% | 0.703 | S | S | * | * | trans | -69.5 | 68.1 | 165.7 | -88 | -177.3 | 170.7 | 171.4 | -2.5 | 105.5 | T288 A292 | T288-R290 VanDerWaalsContact C-N 3.34Å; T288-R290 PolarHBondContact O-N 2.85Å; R290-A292 PolarHBondContact O-N 3.23Å | ||
| 291 | T | 45.5 | Very low | 57 | Low | 126 Ų | 126 | 129.5 Ų | 129.5 | 77% | 0.773 | 71% | 0.714 | S | S | * | * | trans | -75.4 | 50.8 | 158.6 | 43.6 | 0 | 0 | 0 | 0 | 107.9 | D289 | D289-T291 HydrophobicContact CB-CG2 3.86Å; D289-T291 PolarHBondContact O-N 3.23Å; D289-T291 PolarHBondContact O-OG1 3.24Å; D289-T291 VanDerWaalsContact O-OG1 3.14Å | ||
| 292 | A | 44.8 | Very low | 55.7 | Low | 66 Ų | 66 | 133.1 Ų | 133.1 | 55% | 0.545 | 72% | 0.722 | S | S | . | * | S | Bend | trans | -121.8 | 112.9 | 148 | 0 | 0 | 0 | 0 | 0 | 103.3 | R290 I294 | R290-A292 PolarHBondContact O-N 3.23Å; A292-I294 VanDerWaalsContact C-N 3.33Å; A292-I294 PolarHBondContact O-N 2.87Å |
| 293 | P | 45.2 | Very low | 54.7 | Low | 121 Ų | 121 | 130 Ų | 130 | 79% | 0.786 | 72% | 0.723 | S | S | * | * | trans | -58.7 | 109.3 | 168.1 | 26.1 | -29.3 | 0 | 0 | 0 | 104.5 | S295 | P293-S295 PolarHBondContact O-N 3.48Š| ||
| 294 | I | 49.2 | Very low | 54 | Low | 146 Ų | 146 | 132.5 Ų | 132.5 | 75% | 0.749 | 74% | 0.736 | S | S | * | * | trans | -54.9 | 109.3 | 157.9 | -65.1 | 174.2 | 0 | 0 | 0 | 102 | A292 A296 | A292-I294 VanDerWaalsContact C-N 3.33Å; A292-I294 PolarHBondContact O-N 2.87Å; I294-A296 PolarHBondContact O-N 3.23Å | ||
| 295 | S | 45.2 | Very low | 53.4 | Low | 88 Ų | 88 | 132.1 Ų | 132.1 | 62% | 0.615 | 73% | 0.725 | S | S | * | * | trans | -65.5 | 72.5 | 178.7 | 50.2 | 0 | 0 | 0 | 0 | 107.9 | P293 N297 | P293-S295 PolarHBondContact O-N 3.48Å; S295-N297 PolarHBondContact O-N 3.34Å | ||
| 296 | A | 40 | Very low | 52.9 | Low | 78 Ų | 78 | 132.9 Ų | 132.9 | 65% | 0.645 | 74% | 0.741 | S | S | * | * | trans | -68.7 | 72.7 | 149.1 | 0 | 0 | 0 | 0 | 0 | 105.6 | I294 H298 | I294-A296 PolarHBondContact O-N 3.23Å; A296-H298 PolarHBondContact O-N 3.26Å | ||
| 297 | N | 43.3 | Very low | 52.9 | Low | 139 Ų | 139 | 126.6 Ų | 126.6 | 74% | 0.743 | 73% | 0.725 | S | S | * | * | trans | -64.9 | 61 | 159 | -77 | -29.6 | 0 | 0 | 0 | 108 | S295 | S295-N297 PolarHBondContact O-N 3.34Š| ||
| 298 | H | 44.9 | Very low | 53 | Low | 166 Ų | 166 | 129.2 Ų | 129.2 | 77% | 0.769 | 73% | 0.73 | S | S | * | * | trans | -142.3 | 55.6 | 166 | -66.8 | -67.1 | 0 | 0 | 0 | 106.7 | A296 S300 | A296-H298 PolarHBondContact O-N 3.26Å; H298-S300 PolarHBondContact O-N 2.89Å | ||
| 299 | A | 45 | Very low | 53.6 | Low | 92 Ų | 92 | 131.2 Ų | 131.2 | 76% | 0.76 | 73% | 0.733 | S | S | * | * | trans | -63.4 | 75.6 | 142 | 0 | 0 | 0 | 0 | 0 | 106 | T301 | A299-T301 PolarHBondContact O-N 2.56Š| ||
| 300 | S | 50.3 | Low | 54.4 | Low | 102 Ų | 102 | 130 Ų | 130 | 71% | 0.713 | 73% | 0.734 | S | S | * | * | trans | -70.4 | 80.5 | 163.9 | 61.9 | 0 | 0 | 0 | 0 | 105.2 | H298 Y302 | H298-S300 PolarHBondContact O-N 2.89Å; S300-Y302 VanDerWaalsContact C-N 3.31Å; S300-Y302 PolarHBondContact O-N 2.98Å | ||
| 301 | T | 52.2 | Low | 55.4 | Low | 124 Ų | 124 | 123 Ų | 123 | 76% | 0.761 | 72% | 0.719 | S | S | * | * | trans | -51.3 | 104.8 | 162.6 | -59.2 | 0 | 0 | 0 | 0 | 105.4 | A299 P303 | A299-T301 PolarHBondContact O-N 2.56Å; T301-P303 WeakPolarHBondContact O-CD 3.2Å; T301-P303 VanDerWaalsContact O-N 3.11Å | ||
| 302 | Y | 58.2 | Low | 56.7 | Low | 176 Ų | 176 | 121.4 Ų | 121.4 | 69% | 0.69 | 71% | 0.706 | S | S | * | * | trans | -55.5 | 118.5 | 178.1 | 177.4 | -97.7 | 0 | 0 | 0 | 106.9 | S300 E304 | S300-Y302 VanDerWaalsContact C-N 3.31Å; S300-Y302 PolarHBondContact O-N 2.98Å; Y302-E304 PolarHBondContact O-N 3.11Å | ||
| 303 | P | 62.6 | Low | 58.2 | Low | 107 Ų | 107 | 122 Ų | 122 | 70% | 0.695 | 70% | 0.703 | S | S | * | * | trans | -67.5 | 112.9 | 175.4 | 26.9 | -28.5 | 0 | 0 | 0 | 106.2 | T301 | T301-P303 WeakPolarHBondContact O-CD 3.2Å; T301-P303 VanDerWaalsContact O-N 3.11Å | ||
| 304 | E | 67.9 | Low | 59.8 | Low | 164 Ų | 164 | 121.4 Ų | 121.4 | 77% | 0.766 | 70% | 0.697 | S | S | * | * | trans | -51.9 | 129.8 | 171.5 | -75.2 | -176.1 | 173.5 | 0 | 0 | 108.2 | Y302 L306 | Y302-E304 PolarHBondContact O-N 3.11Å; E304-L306 PolarHBondContact O-N 3.45Å | ||
| 305 | P | 68.4 | Low | 61.2 | Low | 94 Ų | 94 | 121.7 Ų | 121.7 | 61% | 0.61 | 69% | 0.69 | S | S | * | * | trans | -57.7 | 119.4 | -180 | 20.7 | -30.7 | 0 | 0 | 0 | 109.1 | G307 | P305-G307 PolarHBondContact O-N 3.14Š| ||
| 306 | L | 64.9 | Low | 62.9 | Low | 193 Ų | 193 | 121.6 Ų | 121.6 | 100% | 1.01 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -68.4 | 29 | 177.4 | -74.9 | 169.2 | 0 | 0 | 0 | 113.4 | E304 | E304-L306 PolarHBondContact O-N 3.45Š|
| 307 | G | 64.9 | Low | 64.7 | Low | 51 Ų | 51 | 123.5 Ų | 123.5 | 53% | 0.526 | 68% | 0.676 | S | S | . | * | S | Bend | trans | -128.4 | 120.2 | 179 | 0 | 0 | 0 | 0 | 0 | 110 | P305 M309 | P305-G307 PolarHBondContact O-N 3.14Å; G307-M309 PolarHBondContact O-N 2.88Å; G307-M309 VanDerWaalsContact O-N 3.12Å |
| 308 | K | 65.8 | Low | 66.3 | Low | 212 Ų | 212 | 122.3 Ų | 122.3 | 92% | 0.922 | 67% | 0.669 | S | S | * | * | trans | -62.4 | 115.3 | 165.1 | -68.9 | -171.9 | 178 | -176 | 0 | 107.5 | C310 | K308-C310 PolarHBondContact O-N 3.18Š| ||
| 309 | M | 70.3 | Confident | 67.8 | Low | 158 Ų | 158 | 122 Ų | 122 | 78% | 0.778 | 66% | 0.662 | S | S | * | * | trans | -62.6 | 129.8 | 173 | 100.4 | -178 | -140.6 | 0 | 0 | 108.2 | G307 S311 | G307-M309 PolarHBondContact O-N 2.88Å; G307-M309 VanDerWaalsContact O-N 3.12Å; M309-S311 VanDerWaalsContact C-N 3.26Å; M309-S311 WeakPolarHBondContact CE-OG 3.33Å; M309-S311 VanDerWaalsContact CG-OG 3.28Å; M309-S311 WeakPolarHBondContact CG-OG 3.42Å; M309-S311 PolarHBondContact O-N 2.73Å; M309-S311 PolarHBondContact O-OG 2.88Å | ||
| 310 | C | 65.9 | Low | 69.1 | Low | 107 Ų | 107 | 122.5 Ų | 122.5 | 72% | 0.723 | 65% | 0.651 | S | S | * | * | trans | -71.2 | 86.5 | 173.2 | -87.8 | 0 | 0 | 0 | 0 | 108.8 | K308 D312 | K308-C310 PolarHBondContact O-N 3.18Å; C310-D312 PolarHBondContact O-N 2.7Å | ||
| 311 | S | 69.5 | Low | 70 | Confident | 74 Ų | 74 | 123.5 Ų | 123.5 | 52% | 0.517 | 66% | 0.656 | S | S | . | * | trans | -73.9 | -6.1 | 174.3 | -51.2 | 0 | 0 | 0 | 0 | 113 | M309 T313 | M309-S311 VanDerWaalsContact C-N 3.26Å; M309-S311 WeakPolarHBondContact CE-OG 3.33Å; M309-S311 VanDerWaalsContact CG-OG 3.28Å; M309-S311 WeakPolarHBondContact CG-OG 3.42Å; M309-S311 PolarHBondContact O-N 2.73Å; M309-S311 PolarHBondContact O-OG 2.88Å; S311-T313 PolarHBondContact O-N 2.92Å | ||
| 312 | D | 71.4 | Confident | 70.4 | Confident | 92 Ų | 92 | 126.1 Ų | 126.1 | 49% | 0.492 | 66% | 0.657 | S | S | . | * | trans | -78.4 | 105.5 | -178.2 | -62.6 | -35.7 | 0 | 0 | 0 | 110.6 | C310 N316 K317 | C310-D312 PolarHBondContact O-N 2.7Å; D312-N316 HydrophobicContact CB-CB 4.31Å; D312-K317 HydrophobicContact CB-CG 4.1Å | ||
| 313 | T | 76.4 | Confident | 70.3 | Confident | 79 Ų | 79 | 121.2 Ų | 121.2 | 49% | 0.485 | 66% | 0.66 | S | S | . | * | trans | -62.1 | 157 | 166.4 | 68.3 | 0 | 0 | 0 | 0 | 110.2 | S311 Y315 N316 K317 | S311-T313 PolarHBondContact O-N 2.92Å; T313-Y315 PolarHBondContact O-N 2.81Å; T313-Y315 VanDerWaalsContact O-N 3.12Å; T313-N316 WeakPolarHBondContact O-CB 3.4Å; T313-N316 PolarHBondContact O-N 2.79Å; T313-N316 PolarHBondContact OG1-N 2.72Å; T313-N316 PolarHBondContact OG1-OD1 3.36Å; T313-N316 VanDerWaalsContact OG1-OD1 3.13Å; T313-K317 PolarHBondContact O-N 2.86Å | ||
| 314 | T | 79.7 | Confident | 69.8 | Low | 108 Ų | 108 | 123.8 Ų | 123.8 | 66% | 0.663 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -51 | -37.7 | 175.5 | 47.2 | 0 | 0 | 0 | 0 | 111.4 | N316 K317 D318 | T314-N316 PolarHBondContact O-N 2.96Å; T314-K317 PolarHBondContact O-N 2.73Å; T314-K317 VanDerWaalsContact O-N 3.14Å; T314-D318 VanDerWaalsContact O-CB 3.29Å; T314-D318 WeakPolarHBondContact O-CB 3.15Å; T314-D318 PolarHBondContact O-N 2.89Å; T314-D318 VanDerWaalsContact O-OD2 3.09Å |
| 315 | Y | 78.3 | Confident | 69.2 | Low | 152 Ų | 152 | 123.8 Ų | 123.8 | 60% | 0.596 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -56.2 | -44.8 | 173.8 | -173.8 | -93.5 | 0 | 0 | 0 | 113.8 | T313 K317 D318 Y319 | T313-Y315 PolarHBondContact O-N 2.81Å; T313-Y315 VanDerWaalsContact O-N 3.12Å; Y315-K317 VanDerWaalsContact C-N 3.28Å; Y315-K317 PolarHBondContact O-N 2.86Å; Y315-D318 PolarHBondContact O-N 3.3Å; Y315-Y319 AromaticContact CD2-CD2 3.38Å; Y315-Y319 HydrophobicContact CD2-CD2 3.38Å; Y315-Y319 AromaticContact CD2-CE2 3.72Å; Y315-Y319 HydrophobicContact CD2-CE2 3.72Å; Y315-Y319 HydrophobicContact CD2-CG 4.23Å; Y315-Y319 AromaticContact CE2-CD2 3.58Å; Y315-Y319 HydrophobicContact CE2-CD2 3.58Å; Y315-Y319 AromaticContact CE2-CE2 3.99Å; Y315-Y319 HydrophobicContact CE2-CE2 3.99Å; Y315-Y319 HydrophobicContact CE2-CG 4.01Å; Y315-Y319 AromaticContact CG-CD2 3.98Å; Y315-Y319 HydrophobicContact CG-CD2 3.98Å; Y315-Y319 WeakPolarHBondContact O-CB 3.42Å; Y315-Y319 WeakPolarHBondContact O-CD2 3.39Å; Y315-Y319 PolarHBondContact O-N 3.03Å |
| 316 | N | 80.5 | Confident | 68.1 | Low | 86 Ų | 86 | 127 Ų | 127 | 46% | 0.46 | 68% | 0.679 | S | S | . | * | H | α-helix | trans | -67.6 | -28.4 | 179.5 | -70.1 | 27.2 | 0 | 0 | 0 | 112.8 | D312 T313 T314 | D312-N316 HydrophobicContact CB-CB 4.31Å; T313-N316 WeakPolarHBondContact O-CB 3.4Å; T313-N316 PolarHBondContact O-N 2.79Å; T313-N316 PolarHBondContact OG1-N 2.72Å; T313-N316 PolarHBondContact OG1-OD1 3.36Å; T313-N316 VanDerWaalsContact OG1-OD1 3.13Å; T314-N316 PolarHBondContact O-N 2.96Å |
| 317 | K | 78.4 | Confident | 67.3 | Low | 117 Ų | 117 | 128.4 Ų | 128.4 | 51% | 0.509 | 67% | 0.671 | S | S | . | * | H | α-helix | trans | -81.9 | -36.3 | 177.2 | -64.8 | -176.3 | -179.4 | 178.3 | 0 | 112.1 | D312 T313 T314 Y315 | D312-K317 HydrophobicContact CB-CG 4.1Å; T313-K317 PolarHBondContact O-N 2.86Å; T314-K317 PolarHBondContact O-N 2.73Å; T314-K317 VanDerWaalsContact O-N 3.14Å; Y315-K317 VanDerWaalsContact C-N 3.28Å; Y315-K317 PolarHBondContact O-N 2.86Å |
| 318 | D | 77.9 | Confident | 66.3 | Low | 114 Ų | 114 | 137.9 Ų | 137.9 | 61% | 0.61 | 69% | 0.691 | S | S | * | * | H | α-helix | trans | -88.6 | -28.1 | -171.8 | -61.9 | -23.2 | 0 | 0 | 0 | 112.4 | T314 Y315 | T314-D318 VanDerWaalsContact O-CB 3.29Å; T314-D318 WeakPolarHBondContact O-CB 3.15Å; T314-D318 PolarHBondContact O-N 2.89Å; T314-D318 VanDerWaalsContact O-OD2 3.09Å; Y315-D318 PolarHBondContact O-N 3.3Å |
| 319 | Y | 76.2 | Confident | 65.1 | Low | 159 Ų | 159 | 132 Ų | 132 | 62% | 0.624 | 68% | 0.681 | S | S | * | * | trans | -116 | 58.8 | -176.4 | -61.1 | -83.9 | 0 | 0 | 0 | 112.4 | Y315 | Y315-Y319 AromaticContact CD2-CD2 3.38Å; Y315-Y319 HydrophobicContact CD2-CD2 3.38Å; Y315-Y319 AromaticContact CD2-CE2 3.72Å; Y315-Y319 HydrophobicContact CD2-CE2 3.72Å; Y315-Y319 HydrophobicContact CD2-CG 4.23Å; Y315-Y319 AromaticContact CE2-CD2 3.58Å; Y315-Y319 HydrophobicContact CE2-CD2 3.58Å; Y315-Y319 AromaticContact CE2-CE2 3.99Å; Y315-Y319 HydrophobicContact CE2-CE2 3.99Å; Y315-Y319 HydrophobicContact CE2-CG 4.01Å; Y315-Y319 AromaticContact CG-CD2 3.98Å; Y315-Y319 HydrophobicContact CG-CD2 3.98Å; Y315-Y319 WeakPolarHBondContact O-CB 3.42Å; Y315-Y319 WeakPolarHBondContact O-CD2 3.39Å; Y315-Y319 PolarHBondContact O-N 3.03Å | ||
| 320 | I | 71.6 | Confident | 64 | Low | 103 Ų | 103 | 132.1 Ų | 132.1 | 53% | 0.528 | 68% | 0.683 | S | S | . | * | trans | -75.8 | 128 | 170.8 | -51.2 | 168 | 0 | 0 | 0 | 107.7 | F322 | I320-F322 WeakPolarHBondContact O-CD2 3.46Å; I320-F322 PolarHBondContact O-N 3.19Å | ||
| 321 | P | 69 | Low | 62.5 | Low | 124 Ų | 124 | 134.9 Ų | 134.9 | 81% | 0.805 | 69% | 0.686 | S | S | * | * | trans | -64.9 | 98.1 | 176.8 | 24.6 | -31.3 | 0 | 0 | 0 | 109.5 | G323 | P321-G323 PolarHBondContact O-N 3.34Š| ||
| 322 | F | 61.3 | Low | 61.4 | Low | 178 Ų | 178 | 140.5 Ų | 140.5 | 78% | 0.781 | 70% | 0.704 | S | S | * | * | trans | -63.7 | 122 | 170.6 | -78.8 | -84.7 | 0 | 0 | 0 | 108.6 | I320 L324 | I320-F322 WeakPolarHBondContact O-CD2 3.46Å; I320-F322 PolarHBondContact O-N 3.19Å; F322-L324 PolarHBondContact O-N 2.9Å | ||
| 323 | G | 55.3 | Low | 59.9 | Low | 73 Ų | 73 | 141.9 Ų | 141.9 | 75% | 0.753 | 72% | 0.715 | S | S | * | * | trans | -55.1 | 113.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | P321 Q325 | P321-G323 PolarHBondContact O-N 3.34Å; G323-Q325 PolarHBondContact O-N 2.83Å | ||
| 324 | L | 53.2 | Low | 58 | Low | 162 Ų | 162 | 143.4 Ų | 143.4 | 85% | 0.848 | 72% | 0.72 | S | S | * | * | trans | -60.6 | 108.5 | 178.9 | -80 | 156.9 | 0 | 0 | 0 | 109.3 | F322 N326 | F322-L324 PolarHBondContact O-N 2.9Å; L324-N326 PolarHBondContact O-N 3.2Å | ||
| 325 | Q | 53.5 | Low | 56.1 | Low | 163 Ų | 163 | 145.9 Ų | 145.9 | 76% | 0.762 | 72% | 0.722 | S | S | * | * | trans | -62.2 | 106.6 | 162 | -79.4 | -160 | -14.1 | 0 | 0 | 107.9 | G323 R327 | G323-Q325 PolarHBondContact O-N 2.83Å; Q325-R327 VanDerWaalsContact C-N 3.32Å; Q325-R327 PolarHBondContact O-N 3.12Å | ||
| 326 | N | 45.3 | Very low | 54.2 | Low | 162 Ų | 162 | 147 Ų | 147 | 87% | 0.866 | 74% | 0.737 | S | S | * | * | trans | -57 | 92 | 171 | -85 | -31.5 | 0 | 0 | 0 | 110.2 | L324 | L324-N326 PolarHBondContact O-N 3.2Š| ||
| 327 | R | 48.2 | Very low | 52.3 | Low | 222 Ų | 222 | 146 Ų | 146 | 84% | 0.838 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -94.9 | 122.6 | 162.5 | -77.7 | -164.3 | -173.2 | -118 | 3.2 | 109.2 | Q325 | Q325-R327 VanDerWaalsContact C-N 3.32Å; Q325-R327 PolarHBondContact O-N 3.12Å |
| 328 | R | 44.6 | Very low | 50.5 | Low | 251 Ų | 251 | 151.8 Ų | 151.8 | 95% | 0.947 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 148.6 | 177.2 | -70 | 179.1 | 173.6 | 172.8 | -2.4 | 111.2 | ||
| 329 | A | 41 | Very low | 48.8 | Very low | 88 Ų | 88 | 150.1 Ų | 150.1 | 73% | 0.727 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 158.5 | -164.4 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||
| 330 | I | 47 | Very low | 47.4 | Very low | 160 Ų | 160 | 148.1 Ų | 148.1 | 82% | 0.821 | 78% | 0.778 | S | S | * | * | trans | -140.4 | 117.7 | 146.1 | -57.4 | -179.7 | 0 | 0 | 0 | 107.9 | ||||
| 331 | H | 34.6 | Very low | 46.3 | Very low | 166 Ų | 166 | 152.2 Ų | 152.2 | 77% | 0.769 | 80% | 0.795 | S | S | * | * | trans | -73.6 | 126.3 | 167.9 | -97.3 | -92.4 | 0 | 0 | 0 | 109.9 | ||||
| 332 | Q | 46.8 | Very low | 45.7 | Very low | 191 Ų | 191 | 153.1 Ų | 153.1 | 89% | 0.893 | 79% | 0.793 | S | S | * | * | trans | -146.2 | 114.9 | 145.1 | -70.8 | -165.6 | -19.5 | 0 | 0 | 109.1 | ||||
| 333 | V | 38.1 | Very low | 45.6 | Very low | 121 Ų | 121 | 149.8 Ų | 149.8 | 73% | 0.733 | 79% | 0.789 | S | S | * | * | trans | -81 | 123.7 | 173.3 | 174.4 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 334 | D | 37.9 | Very low | 46.2 | Very low | 111 Ų | 111 | 151.9 Ų | 151.9 | 59% | 0.594 | 79% | 0.789 | S | S | * | * | trans | -175.7 | 120.9 | 135.9 | -100 | -12.9 | 0 | 0 | 0 | 112.4 | ||||
| 335 | K | 38.5 | Very low | 46.9 | Very low | 160 Ų | 160 | 153.3 Ų | 153.3 | 70% | 0.696 | 79% | 0.789 | S | S | * | * | trans | 64.7 | 135.7 | 131.3 | -60.3 | 167.4 | -174 | 138.6 | 0 | 119.7 | ||||
| 336 | I | 40.4 | Very low | 47.4 | Very low | 177 Ų | 177 | 154 Ų | 154 | 91% | 0.908 | 79% | 0.792 | S | S | * | * | trans | 86.2 | 119.8 | 164.4 | -45 | 149.1 | 0 | 0 | 0 | 112.3 | ||||
| 337 | G | 38.7 | Very low | 48.6 | Very low | 64 Ų | 64 | 148.1 Ų | 148.1 | 66% | 0.66 | 77% | 0.77 | S | S | * | * | cis | 165.5 | 155.2 | 9.3 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 338 | R | 42 | Very low | 49.7 | Very low | 239 Ų | 239 | 142.1 Ų | 142.1 | 90% | 0.902 | 76% | 0.757 | S | S | * | * | trans | 76.5 | 74.3 | 171.2 | -59.3 | -164 | -102.4 | -106.3 | 4.3 | 117.3 | V340 | R338-V340 PolarHBondContact O-N 2.83Š| ||
| 339 | G | 40.7 | Very low | 51.2 | Low | 79 Ų | 79 | 133 Ų | 133 | 81% | 0.814 | 73% | 0.732 | S | S | * | * | trans | -66.2 | 106.4 | 146.1 | 0 | 0 | 0 | 0 | 0 | 108.4 | E341 | G339-E341 PolarHBondContact O-N 2.93Å; G339-E341 VanDerWaalsContact O-N 3.08Å | ||
| 340 | V | 48.7 | Very low | 52.9 | Low | 116 Ų | 116 | 135.1 Ų | 135.1 | 70% | 0.703 | 73% | 0.732 | S | S | * | * | trans | -68.5 | 101.9 | 168.3 | 176.9 | 0 | 0 | 0 | 0 | 105.9 | R338 L342 | R338-V340 PolarHBondContact O-N 2.83Å; V340-L342 HydrophobicContact CG1-CD2 4.14Å; V340-L342 HydrophobicContact CG1-CG 4.3Å; V340-L342 PolarHBondContact O-N 2.98Å | ||
| 341 | E | 47.7 | Very low | 54.5 | Low | 189 Ų | 189 | 134.9 Ų | 134.9 | 88% | 0.883 | 72% | 0.721 | S | S | * | * | trans | -63.8 | 94.3 | 163.7 | -67.4 | -160 | 171.3 | 0 | 0 | 107.3 | G339 | G339-E341 PolarHBondContact O-N 2.93Å; G339-E341 VanDerWaalsContact O-N 3.08Å | ||
| 342 | L | 56.5 | Low | 56.5 | Low | 144 Ų | 144 | 133.9 Ų | 133.9 | 75% | 0.754 | 72% | 0.715 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 132.2 | 167.7 | -72.4 | 169.6 | 0 | 0 | 0 | 107.4 | V340 | V340-L342 HydrophobicContact CG1-CD2 4.14Å; V340-L342 HydrophobicContact CG1-CG 4.3Å; V340-L342 PolarHBondContact O-N 2.98Å |
| 343 | P | 59.9 | Low | 57.8 | Low | 108 Ų | 108 | 129.5 Ų | 129.5 | 70% | 0.701 | 70% | 0.698 | S | S | * | * | P | Polyproline II helix | trans | -53.1 | 149 | 174.3 | -23.4 | 32.1 | 0 | 0 | 0 | 110.7 | F345 | P343-F345 PolarHBondContact O-N 2.92Š|
| 344 | P | 66.5 | Low | 59.7 | Low | 117 Ų | 117 | 127.4 Ų | 127.4 | 76% | 0.76 | 69% | 0.688 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 128.3 | 176.3 | -19.7 | 29.7 | 0 | 0 | 0 | 109.8 | Q346 | P344-Q346 PolarHBondContact O-N 2.82Š|
| 345 | F | 68.4 | Low | 61.7 | Low | 192 Ų | 192 | 130.1 Ų | 130.1 | 84% | 0.842 | 69% | 0.691 | S | S | * | * | trans | -60.2 | 107.1 | 174.3 | 172.2 | -111.4 | 0 | 0 | 0 | 109.4 | P343 G347 | P343-F345 PolarHBondContact O-N 2.92Å; F345-G347 VanDerWaalsContact CE1-CA 3.5Å; F345-G347 PolarHBondContact O-N 2.81Å | ||
| 346 | Q | 64.4 | Low | 63.4 | Low | 177 Ų | 177 | 129.2 Ų | 129.2 | 83% | 0.827 | 68% | 0.684 | S | S | * | * | trans | -76 | 72.7 | 175.5 | -79.9 | 162.1 | -29.4 | 0 | 0 | 109.5 | P344 V348 | P344-Q346 PolarHBondContact O-N 2.82Å; Q346-V348 PolarHBondContact O-N 3.23Å | ||
| 347 | G | 70.7 | Confident | 64.9 | Low | 38 Ų | 38 | 127 Ų | 127 | 39% | 0.392 | 68% | 0.682 | S | S | . | * | trans | -75.8 | 46.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | F345 | F345-G347 VanDerWaalsContact CE1-CA 3.5Å; F345-G347 PolarHBondContact O-N 2.81Å | ||
| 348 | V | 70.4 | Confident | 66.6 | Low | 96 Ų | 96 | 131.6 Ų | 131.6 | 58% | 0.582 | 68% | 0.68 | S | S | * | * | trans | -106.3 | 102.7 | 177.1 | -135.4 | 0 | 0 | 0 | 0 | 107.8 | Q346 | Q346-V348 PolarHBondContact O-N 3.23Š| ||
| 349 | S | 75.5 | Confident | 67.8 | Low | 60 Ų | 60 | 126.7 Ų | 126.7 | 42% | 0.42 | 68% | 0.676 | S | S | . | * | trans | -85.3 | 145.1 | 169 | 59.7 | 0 | 0 | 0 | 0 | 110 | Y351 K352 D353 | S349-Y351 PolarHBondContact O-N 3.29Å; S349-K352 PolarHBondContact O-N 2.94Å; S349-K352 WeakPolarHBondContact OG-CB 3.38Å; S349-K352 PolarHBondContact OG-N 2.69Å; S349-D353 PolarHBondContact O-N 3.3Å | ||
| 350 | D | 77.9 | Confident | 69 | Low | 133 Ų | 133 | 130 Ų | 130 | 71% | 0.711 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -46.3 | -39.4 | 168.8 | 55.8 | -10.2 | 0 | 0 | 0 | 112.5 | D353 S354 | D350-D353 PolarHBondContact O-N 3.49Å; D350-S354 WeakPolarHBondContact O-CB 3.29Å; D350-S354 PolarHBondContact O-N 3.47Å; D350-S354 PolarHBondContact O-OG 3.43Å |
| 351 | Y | 79.8 | Confident | 69.8 | Low | 154 Ų | 154 | 132.4 Ų | 132.4 | 60% | 0.604 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -63 | -44.7 | 176 | -172.4 | -92.5 | 0 | 0 | 0 | 112.8 | S349 D353 S354 Y355 | S349-Y351 PolarHBondContact O-N 3.29Å; Y351-D353 VanDerWaalsContact C-N 3.29Å; Y351-D353 PolarHBondContact O-N 2.99Å; Y351-S354 PolarHBondContact O-N 2.86Å; Y351-Y355 HydrophobicContact CD1-CD2 4.42Å; Y351-Y355 AromaticContact CD2-CD2 3.6Å; Y351-Y355 HydrophobicContact CD2-CD2 3.6Å; Y351-Y355 AromaticContact CD2-CE2 3.66Å; Y351-Y355 HydrophobicContact CD2-CE2 3.66Å; Y351-Y355 HydrophobicContact CE1-CD2 4.35Å; Y351-Y355 AromaticContact CE2-CD2 3.52Å; Y351-Y355 HydrophobicContact CE2-CD2 3.52Å; Y351-Y355 AromaticContact CE2-CE2 3.56Å; Y351-Y355 HydrophobicContact CE2-CE2 3.56Å; Y351-Y355 HydrophobicContact CE2-CG 4.4Å; Y351-Y355 HydrophobicContact CG-CD2 4.06Å; Y351-Y355 AromaticContact CZ-CD2 3.92Å; Y351-Y355 WeakPolarHBondContact O-CD2 3.35Å; Y351-Y355 PolarHBondContact O-N 3.03Å |
| 352 | K | 76.8 | Confident | 70.4 | Confident | 145 Ų | 145 | 128.8 Ų | 128.8 | 63% | 0.63 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -67.4 | -31.7 | -178.5 | -170.1 | 175.1 | 178.9 | -178.7 | 0 | 112.1 | S349 | S349-K352 PolarHBondContact O-N 2.94Å; S349-K352 WeakPolarHBondContact OG-CB 3.38Å; S349-K352 PolarHBondContact OG-N 2.69Å |
| 353 | D | 74.5 | Confident | 70.5 | Confident | 100 Ų | 100 | 130.6 Ų | 130.6 | 54% | 0.535 | 68% | 0.675 | S | S | . | * | H | α-helix | trans | -81.7 | -32.3 | 176.6 | -117.8 | 2.4 | 0 | 0 | 0 | 113.1 | S349 D350 Y351 R356 | S349-D353 PolarHBondContact O-N 3.3Å; D350-D353 PolarHBondContact O-N 3.49Å; Y351-D353 VanDerWaalsContact C-N 3.29Å; Y351-D353 PolarHBondContact O-N 2.99Å; D353-R356 PolarHBondContact O-NE 3.09Å |
| 354 | S | 78.5 | Confident | 70.2 | Confident | 76 Ų | 76 | 131.7 Ų | 131.7 | 53% | 0.531 | 68% | 0.68 | S | S | . | * | H | α-helix | trans | -74.5 | -34.9 | 179.3 | -58.7 | 0 | 0 | 0 | 0 | 112.9 | D350 Y351 | D350-S354 WeakPolarHBondContact O-CB 3.29Å; D350-S354 PolarHBondContact O-N 3.47Å; D350-S354 PolarHBondContact O-OG 3.43Å; Y351-S354 PolarHBondContact O-N 2.86Å |
| 355 | Y | 78.8 | Confident | 69.8 | Low | 169 Ų | 169 | 135 Ų | 135 | 66% | 0.663 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114 | 50.1 | -174.5 | -63.7 | -81.8 | 0 | 0 | 0 | 113 | Y351 | Y351-Y355 HydrophobicContact CD1-CD2 4.42Å; Y351-Y355 AromaticContact CD2-CD2 3.6Å; Y351-Y355 HydrophobicContact CD2-CD2 3.6Å; Y351-Y355 AromaticContact CD2-CE2 3.66Å; Y351-Y355 HydrophobicContact CD2-CE2 3.66Å; Y351-Y355 HydrophobicContact CE1-CD2 4.35Å; Y351-Y355 AromaticContact CE2-CD2 3.52Å; Y351-Y355 HydrophobicContact CE2-CD2 3.52Å; Y351-Y355 AromaticContact CE2-CE2 3.56Å; Y351-Y355 HydrophobicContact CE2-CE2 3.56Å; Y351-Y355 HydrophobicContact CE2-CG 4.4Å; Y351-Y355 HydrophobicContact CG-CD2 4.06Å; Y351-Y355 AromaticContact CZ-CD2 3.92Å; Y351-Y355 WeakPolarHBondContact O-CD2 3.35Å; Y351-Y355 PolarHBondContact O-N 3.03Å |
| 356 | R | 74.9 | Confident | 69 | Low | 141 Ų | 141 | 129 Ų | 129 | 53% | 0.532 | 67% | 0.674 | S | S | . | * | trans | -72.9 | 144.5 | 168.1 | 50.1 | -178.3 | 138.9 | 156.9 | -0.3 | 111.1 | D353 W358 | D353-R356 PolarHBondContact O-NE 3.09Å; R356-W358 HydrophobicContact CG-CD2 4.31Å; R356-W358 HydrophobicContact CG-CH2 4.31Å; R356-W358 HydrophobicContact CG-CZ2 3.75Å; R356-W358 PolarHBondContact O-N 3.05Å; R356-W358 PolarHBondContact O-NE1 3.16Å | ||
| 357 | C | 72.5 | Confident | 68.2 | Low | 131 Ų | 131 | 127.5 Ų | 127.5 | 89% | 0.885 | 67% | 0.671 | S | S | * | * | trans | -64.5 | 106.9 | 171.5 | -172.6 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 358 | W | 72.9 | Confident | 67.1 | Low | 159 Ų | 159 | 128 Ų | 128 | 60% | 0.602 | 68% | 0.677 | S | S | * | * | trans | -78 | 130.9 | 173.8 | -63.3 | 100.1 | 0 | 0 | 0 | 108.7 | R356 I360 | R356-W358 HydrophobicContact CG-CD2 4.31Å; R356-W358 HydrophobicContact CG-CH2 4.31Å; R356-W358 HydrophobicContact CG-CZ2 3.75Å; R356-W358 PolarHBondContact O-N 3.05Å; R356-W358 PolarHBondContact O-NE1 3.16Å; W358-I360 VanDerWaalsContact C-N 3.3Å; W358-I360 PolarHBondContact O-N 2.76Å | ||
| 359 | T | 67.7 | Low | 66 | Low | 136 Ų | 136 | 136.2 Ų | 136.2 | 83% | 0.834 | 70% | 0.697 | S | S | * | * | trans | -63.5 | 96.4 | 167.9 | -43.3 | 0 | 0 | 0 | 0 | 107.5 | E361 | T359-E361 PolarHBondContact O-N 3.33Å; T359-E361 VanDerWaalsContact O-N 3.15Å | ||
| 360 | I | 66.6 | Low | 64.8 | Low | 149 Ų | 149 | 140.6 Ų | 140.6 | 76% | 0.764 | 71% | 0.711 | S | S | * | * | trans | -71.3 | 107.1 | 172 | -58.7 | 171.7 | 0 | 0 | 0 | 105.4 | W358 | W358-I360 VanDerWaalsContact C-N 3.3Å; W358-I360 PolarHBondContact O-N 2.76Å | ||
| 361 | E | 64.1 | Low | 63.5 | Low | 167 Ų | 167 | 138.8 Ų | 138.8 | 78% | 0.78 | 72% | 0.715 | S | S | * | * | trans | -56.1 | 124.7 | 166.6 | -69.6 | -174 | 166.3 | 0 | 0 | 107.4 | T359 Q363 | T359-E361 PolarHBondContact O-N 3.33Å; T359-E361 VanDerWaalsContact O-N 3.15Å; E361-Q363 PolarHBondContact O-N 3.19Å | ||
| 362 | P | 61.9 | Low | 62.5 | Low | 113 Ų | 113 | 138 Ų | 138 | 73% | 0.734 | 73% | 0.726 | S | S | * | * | trans | -57.5 | 121.8 | 178.1 | 23 | -30.6 | 0 | 0 | 0 | 107.2 | V364 | P362-V364 PolarHBondContact O-N 3.1Š| ||
| 363 | Q | 58.1 | Low | 62.1 | Low | 182 Ų | 182 | 139.7 Ų | 139.7 | 85% | 0.85 | 73% | 0.729 | S | S | * | * | trans | -50.8 | 106.6 | 170.9 | -78.7 | -97.3 | -32.4 | 0 | 0 | 107.3 | E361 K365 | E361-Q363 PolarHBondContact O-N 3.19Å; Q363-K365 PolarHBondContact O-N 3.07Å | ||
| 364 | V | 53.6 | Low | 61.9 | Low | 131 Ų | 131 | 140.6 Ų | 140.6 | 79% | 0.794 | 74% | 0.739 | S | S | * | * | trans | -63.7 | 96.1 | 165.7 | -178.1 | 0 | 0 | 0 | 0 | 104 | P362 G366 | P362-V364 PolarHBondContact O-N 3.1Å; V364-G366 PolarHBondContact O-N 2.93Å | ||
| 365 | K | 57.5 | Low | 61.7 | Low | 185 Ų | 185 | 143.3 Ų | 143.3 | 80% | 0.804 | 75% | 0.746 | S | S | * | * | trans | -53 | 104.9 | 159.7 | -81.9 | -178 | 176.2 | 179.9 | 0 | 104.2 | Q363 L367 | Q363-K365 PolarHBondContact O-N 3.07Å; K365-L367 VanDerWaalsContact C-N 3.27Å; K365-L367 PolarHBondContact O-N 3.05Å | ||
| 366 | G | 51.2 | Low | 61.3 | Low | 66 Ų | 66 | 139 Ų | 139 | 68% | 0.68 | 74% | 0.739 | S | S | * | * | trans | -54.9 | 104.3 | 166.8 | 0 | 0 | 0 | 0 | 0 | 105.3 | V364 G368 | V364-G366 PolarHBondContact O-N 2.93Å; G366-G368 VanDerWaalsContact C-N 3.27Å; G366-G368 PolarHBondContact O-N 2.83Å | ||
| 367 | L | 48.1 | Very low | 61.4 | Low | 147 Ų | 147 | 140.6 Ų | 140.6 | 77% | 0.77 | 76% | 0.756 | S | S | * | * | trans | -53.8 | 109 | 159.4 | -96.8 | 84.4 | 0 | 0 | 0 | 103.3 | K365 | K365-L367 VanDerWaalsContact C-N 3.27Å; K365-L367 PolarHBondContact O-N 3.05Å | ||
| 368 | G | 47.2 | Very low | 61.7 | Low | 49 Ų | 49 | 140.1 Ų | 140.1 | 51% | 0.505 | 75% | 0.749 | S | S | . | * | trans | -48 | 155.5 | 160.4 | 0 | 0 | 0 | 0 | 0 | 107.7 | G366 E370 | G366-G368 VanDerWaalsContact C-N 3.27Å; G366-G368 PolarHBondContact O-N 2.83Å; G368-E370 PolarHBondContact O-N 3.04Å | ||
| 369 | R | 48.7 | Very low | 61.9 | Low | 268 Ų | 268 | 141 Ų | 141 | 100% | 1.011 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -56.4 | 75.5 | 179.9 | -66.9 | 175.6 | 174.2 | -179.9 | -2.8 | 111.3 | ||
| 370 | E | 49.2 | Very low | 62.6 | Low | 152 Ų | 152 | 143.5 Ų | 143.5 | 71% | 0.71 | 76% | 0.756 | S | S | * | * | trans | -107.1 | 110.1 | 174.5 | -79.4 | -178.6 | 155.7 | 0 | 0 | 103.9 | G368 T372 | G368-E370 PolarHBondContact O-N 3.04Å; E370-T372 PolarHBondContact O-N 3.11Å | ||
| 371 | A | 51.1 | Low | 63.2 | Low | 95 Ų | 95 | 145.3 Ų | 145.3 | 79% | 0.785 | 76% | 0.762 | S | S | * | * | trans | -6.2 | 104 | -178.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | Y373 | A371-Y373 PolarHBondContact O-N 3Š| ||
| 372 | T | 59.6 | Low | 63.9 | Low | 137 Ų | 137 | 139.4 Ų | 139.4 | 84% | 0.84 | 75% | 0.745 | S | S | * | * | trans | -54.5 | 106.2 | 163 | -27 | 0 | 0 | 0 | 0 | 106.3 | E370 T374 | E370-T372 PolarHBondContact O-N 3.11Å; T372-T374 PolarHBondContact O-N 3.5Å | ||
| 373 | Y | 67.6 | Low | 64.8 | Low | 180 Ų | 180 | 141.1 Ų | 141.1 | 71% | 0.706 | 74% | 0.741 | S | S | * | * | trans | -60.9 | 106.5 | -179 | 171.9 | -99.9 | 0 | 0 | 0 | 108.5 | A371 I375 P376 | A371-Y373 PolarHBondContact O-N 3Å; Y373-I375 HydrophobicContact CD1-CG1 4.4Å; Y373-I375 HydrophobicContact CE1-CG1 3.93Å; Y373-P376 WeakPolarHBondContact OH-CD 3.39Å | ||
| 374 | T | 71.2 | Confident | 66.1 | Low | 119 Ų | 119 | 135.7 Ų | 135.7 | 73% | 0.73 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -80.2 | 118 | 168 | 39.1 | 0 | 0 | 0 | 0 | 108.1 | T372 P376 | T372-T374 PolarHBondContact O-N 3.5Å; T374-P376 WeakPolarHBondContact O-CD 3.36Å |
| 375 | I | 72.4 | Confident | 67.5 | Low | 133 Ų | 133 | 134.1 Ų | 134.1 | 68% | 0.682 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 122.7 | 171.2 | -59.4 | 166.9 | 0 | 0 | 0 | 107.5 | Y373 I377 | Y373-I375 HydrophobicContact CD1-CG1 4.4Å; Y373-I375 HydrophobicContact CE1-CG1 3.93Å; I375-I377 PolarHBondContact O-N 2.87Å; I375-I377 VanDerWaalsContact O-N 3.12Å |
| 376 | P | 71.1 | Confident | 68.7 | Low | 80 Ų | 80 | 129.4 Ų | 129.4 | 52% | 0.519 | 70% | 0.701 | S | S | . | * | P | Polyproline II helix | trans | -57.6 | 120.2 | 173.6 | -20.2 | 30.2 | 0 | 0 | 0 | 109.1 | Y373 T374 V378 | Y373-P376 WeakPolarHBondContact OH-CD 3.39Å; T374-P376 WeakPolarHBondContact O-CD 3.36Å; P376-V378 PolarHBondContact O-N 3.06Å |
| 377 | I | 77.4 | Confident | 70.3 | Confident | 173 Ų | 173 | 129.6 Ų | 129.6 | 89% | 0.887 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -67 | -21.3 | 174.3 | -58.5 | 168 | 0 | 0 | 0 | 110 | I375 K379 | I375-I377 PolarHBondContact O-N 2.87Å; I375-I377 VanDerWaalsContact O-N 3.12Å; I377-K379 PolarHBondContact O-N 3.1Å |
| 378 | V | 78.6 | Confident | 72 | Confident | 121 Ų | 121 | 126.7 Ų | 126.7 | 73% | 0.733 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -77.2 | 119.2 | 175.2 | -173.9 | 0 | 0 | 0 | 0 | 109.3 | P376 | P376-V378 PolarHBondContact O-N 3.06Š|
| 379 | K | 77.3 | Confident | 73.7 | Confident | 179 Ų | 179 | 130.9 Ų | 130.9 | 78% | 0.778 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 137.2 | 175.1 | -65.1 | 179.7 | 179.9 | 177.6 | 0 | 109.5 | I377 E381 | I377-K379 PolarHBondContact O-N 3.1Å; K379-E381 PolarHBondContact O-N 2.82Å |
| 380 | F | 81.7 | Confident | 75.1 | Confident | 187 Ų | 187 | 127.1 Ų | 127.1 | 82% | 0.82 | 67% | 0.671 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 116.8 | 173.3 | 175.9 | -105.1 | 0 | 0 | 0 | 109.9 | G382 | F380-G382 WeakPolarHBondContact CE1-O 3.18Š|
| 381 | E | 79 | Confident | 76.5 | Confident | 188 Ų | 188 | 123.7 Ų | 123.7 | 88% | 0.879 | 66% | 0.66 | S | S | * | * | trans | -96.3 | 22.6 | -178.5 | -62.9 | -169.7 | 161.8 | 0 | 0 | 113.5 | K379 K383 | K379-E381 PolarHBondContact O-N 2.82Å; E381-K383 PolarHBondContact O-N 2.73Å | ||
| 382 | G | 80.2 | Confident | 77.9 | Confident | 42 Ų | 42 | 124 Ų | 124 | 43% | 0.433 | 65% | 0.653 | S | S | . | * | trans | -84.6 | 110.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | F380 | F380-G382 WeakPolarHBondContact CE1-O 3.18Š| ||
| 383 | K | 80.3 | Confident | 78.6 | Confident | 150 Ų | 150 | 124.8 Ų | 124.8 | 65% | 0.652 | 65% | 0.648 | S | S | * | * | trans | -91.8 | 142.4 | 161.9 | -66.3 | -179.2 | -176.9 | 176.1 | 0 | 109.2 | E381 D388 | E381-K383 PolarHBondContact O-N 2.73Å; K383-D388 WeakPolarHBondContact CB-OD1 3.5Å; K383-D388 WeakPolarHBondContact CD-OD1 3.16Å | ||
| 384 | S | 84.7 | Confident | 78.5 | Confident | 68 Ų | 68 | 123.1 Ų | 123.1 | 48% | 0.476 | 65% | 0.65 | S | S | . | * | trans | -70.6 | 148.6 | 173.4 | 63.7 | 0 | 0 | 0 | 0 | 109.7 | T386 S387 D388 | S384-T386 PolarHBondContact O-N 3Å; S384-T386 VanDerWaalsContact O-N 3.16Å; S384-S387 WeakPolarHBondContact O-CA 3.37Å; S384-S387 WeakPolarHBondContact O-CB 3.48Å; S384-S387 PolarHBondContact O-N 2.78Å; S384-S387 WeakPolarHBondContact OG-CB 3.17Å; S384-S387 PolarHBondContact OG-N 3.01Å; S384-S387 VanDerWaalsContact OG-N 3.17Å; S384-D388 PolarHBondContact O-N 3.17Å | ||
| 385 | T | 84.3 | Confident | 78.2 | Confident | 98 Ų | 98 | 125.2 Ų | 125.2 | 60% | 0.601 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -54.1 | -36.3 | 175 | 51.4 | 0 | 0 | 0 | 0 | 111.3 | S387 D388 H389 | T385-S387 PolarHBondContact O-N 2.84Å; T385-D388 PolarHBondContact O-N 3.15Å; T385-H389 VanDerWaalsContact O-CB 3.28Å; T385-H389 WeakPolarHBondContact O-CB 3.28Å; T385-H389 PolarHBondContact O-CD2 3.35Å; T385-H389 VanDerWaalsContact O-CG 3.23Å; T385-H389 PolarHBondContact O-N 3.1Å |
| 386 | T | 81.9 | Confident | 77.5 | Confident | 86 Ų | 86 | 127.1 Ų | 127.1 | 53% | 0.528 | 66% | 0.657 | S | S | . | * | H | α-helix | trans | -63.1 | -41.5 | 174.3 | -36.7 | 0 | 0 | 0 | 0 | 112.4 | S384 D388 Y390 | S384-T386 PolarHBondContact O-N 3Å; S384-T386 VanDerWaalsContact O-N 3.16Å; T386-D388 VanDerWaalsContact C-N 3.35Å; T386-Y390 HydrophobicContact CG2-CD2 3.71Å; T386-Y390 HydrophobicContact CG2-CE2 4.17Å; T386-Y390 WeakPolarHBondContact O-CB 3.33Å; T386-Y390 WeakPolarHBondContact O-CD2 3.45Å; T386-Y390 PolarHBondContact O-N 2.85Å |
| 387 | S | 84.7 | Confident | 77.1 | Confident | 69 Ų | 69 | 133.6 Ų | 133.6 | 48% | 0.483 | 67% | 0.671 | S | S | . | * | H | α-helix | trans | -69.6 | -31.7 | 178.4 | -173.6 | 0 | 0 | 0 | 0 | 112.7 | S384 T385 | S384-S387 WeakPolarHBondContact O-CA 3.37Å; S384-S387 WeakPolarHBondContact O-CB 3.48Å; S384-S387 PolarHBondContact O-N 2.78Å; S384-S387 WeakPolarHBondContact OG-CB 3.17Å; S384-S387 PolarHBondContact OG-N 3.01Å; S384-S387 VanDerWaalsContact OG-N 3.17Å; T385-S387 PolarHBondContact O-N 2.84Å |
| 388 | D | 83.5 | Confident | 76.6 | Confident | 87 Ų | 87 | 129.8 Ų | 129.8 | 47% | 0.465 | 66% | 0.657 | S | S | . | * | H | α-helix | trans | -80.6 | -31.7 | 176.9 | -76.3 | -24.9 | 0 | 0 | 0 | 112.5 | K383 S384 T385 T386 | K383-D388 WeakPolarHBondContact CB-OD1 3.5Å; K383-D388 WeakPolarHBondContact CD-OD1 3.16Å; S384-D388 PolarHBondContact O-N 3.17Å; T385-D388 PolarHBondContact O-N 3.15Å; T386-D388 VanDerWaalsContact C-N 3.35Å |
| 389 | H | 82.1 | Confident | 76.2 | Confident | 136 Ų | 136 | 129 Ų | 129 | 63% | 0.63 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -87.4 | -31.6 | -178.1 | -67.8 | -47 | 0 | 0 | 0 | 114.5 | T385 | T385-H389 VanDerWaalsContact O-CB 3.28Å; T385-H389 WeakPolarHBondContact O-CB 3.28Å; T385-H389 PolarHBondContact O-CD2 3.35Å; T385-H389 VanDerWaalsContact O-CG 3.23Å; T385-H389 PolarHBondContact O-N 3.1Å |
| 390 | Y | 79.6 | Confident | 75.8 | Confident | 190 Ų | 190 | 128.2 Ų | 128.2 | 75% | 0.745 | 65% | 0.654 | S | S | * | * | trans | -108.3 | 65.7 | -174.7 | -66.2 | -88.9 | 0 | 0 | 0 | 111.8 | T386 | T386-Y390 HydrophobicContact CG2-CD2 3.71Å; T386-Y390 HydrophobicContact CG2-CE2 4.17Å; T386-Y390 WeakPolarHBondContact O-CB 3.33Å; T386-Y390 WeakPolarHBondContact O-CD2 3.45Å; T386-Y390 PolarHBondContact O-N 2.85Å | ||
| 391 | V | 78.5 | Confident | 75.4 | Confident | 80 Ų | 80 | 123.4 Ų | 123.4 | 49% | 0.485 | 64% | 0.643 | S | S | . | * | trans | -94.9 | 137.1 | 174.9 | -168.7 | 0 | 0 | 0 | 0 | 109.6 | H393 | V391-H393 PolarHBondContact O-N 2.8Š| ||
| 392 | P | 79.4 | Confident | 74.8 | Confident | 100 Ų | 100 | 124.1 Ų | 124.1 | 65% | 0.649 | 64% | 0.643 | S | S | * | * | trans | -57.9 | 111.5 | 174.8 | -22.5 | 32.2 | 0 | 0 | 0 | 111 | L394 | P392-L394 HydrophobicContact CB-CD1 4.07Å; P392-L394 HydrophobicContact CB-CG 4.21Å; P392-L394 PolarHBondContact O-N 3.4Å | ||
| 393 | H | 75.9 | Confident | 74.2 | Confident | 155 Ų | 155 | 130 Ų | 130 | 72% | 0.718 | 66% | 0.657 | S | S | * | * | trans | -76.5 | 64.1 | 171.2 | -61.1 | -62.8 | 0 | 0 | 0 | 110.3 | V391 N395 Y396 | V391-H393 PolarHBondContact O-N 2.8Å; H393-N395 PolarHBondContact O-N 2.92Å; H393-Y396 PolarHBondContact O-N 3.26Å | ||
| 394 | L | 64.9 | Low | 73.4 | Confident | 145 Ų | 145 | 128.7 Ų | 128.7 | 76% | 0.759 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.4 | 125.1 | 171 | -74 | 150.9 | 0 | 0 | 0 | 107.6 | P392 | P392-L394 HydrophobicContact CB-CD1 4.07Å; P392-L394 HydrophobicContact CB-CG 4.21Å; P392-L394 PolarHBondContact O-N 3.4Å |
| 395 | N | 64.1 | Low | 72.2 | Confident | 162 Ų | 162 | 132.8 Ų | 132.8 | 87% | 0.866 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 91.2 | 12.4 | -174.1 | -47 | -35.8 | 0 | 0 | 0 | 117.3 | H393 R397 | H393-N395 PolarHBondContact O-N 2.92Å; N395-R397 PolarHBondContact O-N 3.37Å |
| 396 | Y | 59 | Low | 71.1 | Confident | 174 Ų | 174 | 132.2 Ų | 132.2 | 68% | 0.682 | 69% | 0.689 | S | S | * | * | trans | -67.5 | 104.4 | 162.7 | -172.4 | -97.3 | 0 | 0 | 0 | 109.8 | H393 | H393-Y396 PolarHBondContact O-N 3.26Š| ||
| 397 | R | 61.6 | Low | 69.8 | Low | 216 Ų | 216 | 135.6 Ų | 135.6 | 82% | 0.815 | 70% | 0.699 | S | S | * | * | P | Polyproline II helix | trans | -84.3 | 120.4 | 165.9 | -67.8 | -173.9 | -176.9 | 177.6 | 1.8 | 107.3 | N395 | N395-R397 PolarHBondContact O-N 3.37Š|
| 398 | P | 67.9 | Low | 68.4 | Low | 92 Ų | 92 | 138.7 Ų | 138.7 | 60% | 0.597 | 72% | 0.715 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 139.1 | 171.9 | 21.9 | -30.5 | 0 | 0 | 0 | 108.7 | E400 | P398-E400 PolarHBondContact O-N 2.64Š|
| 399 | P | 68.8 | Low | 67.1 | Low | 105 Ų | 105 | 140 Ų | 140 | 68% | 0.682 | 73% | 0.726 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 117.8 | 178.3 | 19.9 | -29.6 | 0 | 0 | 0 | 108.6 | S401 | P399-S401 PolarHBondContact O-N 3.32Š|
| 400 | E | 68.8 | Low | 65.9 | Low | 163 Ų | 163 | 137.4 Ų | 137.4 | 76% | 0.762 | 73% | 0.728 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 133.7 | 175.5 | -73.3 | -179.5 | 177.9 | 0 | 0 | 108.1 | P398 F402 | P398-E400 PolarHBondContact O-N 2.64Å; E400-F402 WeakPolarHBondContact O-CD2 3.33Å; E400-F402 PolarHBondContact O-N 2.9Å |
| 401 | S | 74.5 | Confident | 65 | Low | 85 Ų | 85 | 134.3 Ų | 134.3 | 59% | 0.594 | 72% | 0.724 | S | S | * | * | trans | -64.7 | 113.6 | 178.7 | 62.8 | 0 | 0 | 0 | 0 | 108.8 | P399 K403 | P399-S401 PolarHBondContact O-N 3.32Å; S401-K403 PolarHBondContact O-N 3.28Å | ||
| 402 | F | 66.3 | Low | 64.6 | Low | 203 Ų | 203 | 139.7 Ų | 139.7 | 89% | 0.89 | 74% | 0.744 | S | S | * | * | trans | -70.3 | 17 | 167.4 | -70.5 | -87.6 | 0 | 0 | 0 | 112.8 | E400 | E400-F402 WeakPolarHBondContact O-CD2 3.33Å; E400-F402 PolarHBondContact O-N 2.9Å | ||
| 403 | K | 68.2 | Low | 64.1 | Low | 166 Ų | 166 | 140 Ų | 140 | 72% | 0.722 | 75% | 0.745 | S | S | * | * | S | Bend | trans | -66.9 | 127.2 | 168.9 | -80.8 | -174.6 | 174.8 | -179.7 | 0 | 107 | S401 H405 | S401-K403 PolarHBondContact O-N 3.28Å; K403-H405 PolarHBondContact O-N 3.15Å |
| 404 | P | 63.4 | Low | 64 | Low | 123 Ų | 123 | 138.5 Ų | 138.5 | 80% | 0.799 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 123.4 | 172.4 | 22.7 | -31.2 | 0 | 0 | 0 | 107.1 | G406 | P404-G406 PolarHBondContact O-N 2.86Š|
| 405 | H | 59.5 | Low | 64.7 | Low | 154 Ų | 154 | 140 Ų | 140 | 71% | 0.713 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 132.1 | 176 | -85.9 | 60.5 | 0 | 0 | 0 | 107 | K403 Q407 | K403-H405 PolarHBondContact O-N 3.15Å; H405-Q407 HydrophobicContact CB-CB 4.39Å; H405-Q407 PolarHBondContact O-N 3.4Å |
| 406 | G | 60.6 | Low | 65.3 | Low | 86 Ų | 86 | 138.5 Ų | 138.5 | 89% | 0.887 | 74% | 0.741 | S | S | * | * | S | Bend | trans | -65.2 | 24.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | P404 V408 | P404-G406 PolarHBondContact O-N 2.86Å; G406-V408 PolarHBondContact O-N 2.98Å |
| 407 | Q | 55.1 | Low | 66.2 | Low | 156 Ų | 156 | 134.8 Ų | 134.8 | 73% | 0.729 | 73% | 0.733 | S | S | * | * | trans | -71.8 | 111.2 | 166.7 | -154.5 | 172.1 | 17.5 | 0 | 0 | 106.1 | H405 T409 | H405-Q407 HydrophobicContact CB-CB 4.39Å; H405-Q407 PolarHBondContact O-N 3.4Å; Q407-T409 VanDerWaalsContact C-N 3.3Å; Q407-T409 PolarHBondContact O-N 2.92Å | ||
| 408 | V | 54.1 | Low | 67.1 | Low | 135 Ų | 135 | 126.8 Ų | 126.8 | 82% | 0.818 | 71% | 0.713 | S | S | * | * | trans | -51.7 | 101.5 | 170.7 | 180 | 0 | 0 | 0 | 0 | 106.4 | G406 A410 | G406-V408 PolarHBondContact O-N 2.98Å; V408-A410 VanDerWaalsContact C-N 3.27Å; V408-A410 PolarHBondContact O-N 2.82Å | ||
| 409 | T | 57.1 | Low | 67.7 | Low | 114 Ų | 114 | 126 Ų | 126 | 70% | 0.699 | 71% | 0.707 | S | S | * | * | trans | -70.3 | 99.1 | 171.4 | -53.7 | 0 | 0 | 0 | 0 | 103.6 | Q407 N411 | Q407-T409 VanDerWaalsContact C-N 3.3Å; Q407-T409 PolarHBondContact O-N 2.92Å; T409-N411 PolarHBondContact O-N 3.12Å | ||
| 410 | A | 57.6 | Low | 68.2 | Low | 81 Ų | 81 | 127 Ų | 127 | 67% | 0.669 | 71% | 0.706 | S | S | * | * | trans | -64.3 | 88.6 | 173.5 | 0 | 0 | 0 | 0 | 0 | 106.7 | V408 Q412 | V408-A410 VanDerWaalsContact C-N 3.27Å; V408-A410 PolarHBondContact O-N 2.82Å; A410-Q412 PolarHBondContact O-N 3.25Å | ||
| 411 | N | 60.4 | Low | 68.6 | Low | 126 Ų | 126 | 126.7 Ų | 126.7 | 67% | 0.674 | 70% | 0.699 | S | S | * | * | trans | -56.8 | 110 | 167.6 | -74.4 | -24 | 0 | 0 | 0 | 105.9 | T409 T413 | T409-N411 PolarHBondContact O-N 3.12Å; N411-T413 PolarHBondContact O-N 2.95Å; N411-T413 VanDerWaalsContact O-N 3.11Å | ||
| 412 | Q | 69.7 | Low | 68.7 | Low | 192 Ų | 192 | 130.4 Ų | 130.4 | 90% | 0.897 | 70% | 0.7 | S | S | * | * | trans | -70 | -0.4 | 179 | -66.2 | -175.1 | -10.4 | 0 | 0 | 112.4 | A410 P414 | A410-Q412 PolarHBondContact O-N 3.25Å; Q412-P414 WeakPolarHBondContact O-CD 3.44Å | ||
| 413 | T | 68.9 | Low | 69.3 | Low | 108 Ų | 108 | 126.7 Ų | 126.7 | 66% | 0.663 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -84.5 | 118.4 | 174 | 42.9 | 0 | 0 | 0 | 0 | 109.8 | N411 F415 | N411-T413 PolarHBondContact O-N 2.95Å; N411-T413 VanDerWaalsContact O-N 3.11Å; T413-F415 PolarHBondContact O-N 2.84Å |
| 414 | P | 74.2 | Confident | 69.8 | Low | 123 Ų | 123 | 124.7 Ų | 124.7 | 80% | 0.799 | 68% | 0.68 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 139.7 | 172.2 | -22.7 | 33.3 | 0 | 0 | 0 | 110.7 | Q412 D416 | Q412-P414 WeakPolarHBondContact O-CD 3.44Å; P414-D416 PolarHBondContact O-N 3.01Å |
| 415 | F | 78 | Confident | 70.5 | Confident | 175 Ų | 175 | 126.3 Ų | 126.3 | 77% | 0.768 | 67% | 0.671 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 122.7 | 174.3 | 176.8 | -112.6 | 0 | 0 | 0 | 109.7 | T413 D417 | T413-F415 PolarHBondContact O-N 2.84Å; F415-D417 HydrophobicContact CD1-CB 3.74Å; F415-D417 HydrophobicContact CE1-CB 3.52Å; F415-D417 WeakPolarHBondContact CE1-OD1 3.36Å; F415-D417 PolarHBondContact O-N 3.48Å |
| 416 | D | 78.6 | Confident | 71.3 | Confident | 131 Ų | 131 | 122.8 Ų | 122.8 | 70% | 0.701 | 66% | 0.661 | S | S | * | * | trans | -83.6 | 92.3 | 173.7 | -170.5 | 8.5 | 0 | 0 | 0 | 109.8 | P414 A418 | P414-D416 PolarHBondContact O-N 3.01Å; D416-A418 PolarHBondContact O-N 3.21Å; D416-A418 WeakPolarHBondContact OD1-CB 3.39Å; D416-A418 PolarHBondContact OD1-N 2.82Å | ||
| 417 | D | 77.6 | Confident | 72.1 | Confident | 96 Ų | 96 | 124.3 Ų | 124.3 | 51% | 0.513 | 66% | 0.655 | S | S | . | * | trans | -84.1 | 14.6 | 176.8 | -160 | 21.5 | 0 | 0 | 0 | 112.5 | F415 T419 | F415-D417 HydrophobicContact CD1-CB 3.74Å; F415-D417 HydrophobicContact CE1-CB 3.52Å; F415-D417 WeakPolarHBondContact CE1-OD1 3.36Å; F415-D417 PolarHBondContact O-N 3.48Å; D417-T419 PolarHBondContact O-N 3.27Å | ||
| 418 | A | 79.8 | Confident | 73.2 | Confident | 49 Ų | 49 | 124.2 Ų | 124.2 | 41% | 0.405 | 65% | 0.652 | S | S | . | * | trans | -74.8 | 95.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | D416 M423 | D416-A418 PolarHBondContact O-N 3.21Å; D416-A418 WeakPolarHBondContact OD1-CB 3.39Å; D416-A418 PolarHBondContact OD1-N 2.82Å; A418-M423 HydrophobicContact CB-CG 4.32Å; A418-M423 HydrophobicContact CB-SD 4.31Å | ||
| 419 | T | 80.1 | Confident | 74.2 | Confident | 74 Ų | 74 | 124.6 Ų | 124.6 | 45% | 0.454 | 65% | 0.645 | S | S | . | * | trans | -76.7 | 146.1 | 164.7 | 61.7 | 0 | 0 | 0 | 0 | 110.3 | D417 Y421 R422 M423 | D417-T419 PolarHBondContact O-N 3.27Å; T419-Y421 PolarHBondContact O-N 2.69Å; T419-Y421 VanDerWaalsContact O-N 3.14Å; T419-R422 PolarHBondContact O-N 2.93Å; T419-R422 WeakPolarHBondContact OG1-CB 3.24Å; T419-R422 PolarHBondContact OG1-N 3.47Å; T419-M423 PolarHBondContact O-N 3.12Å; T419-M423 VanDerWaalsContact O-N 3.12Å | ||
| 420 | L | 80.7 | Confident | 74.8 | Confident | 128 Ų | 128 | 126.1 Ų | 126.1 | 67% | 0.67 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -49.8 | -39.9 | 172.5 | -76.2 | 168.4 | 0 | 0 | 0 | 111.5 | R422 M423 E424 | L420-R422 PolarHBondContact O-N 3.07Å; L420-M423 PolarHBondContact O-N 3.02Å; L420-E424 WeakPolarHBondContact O-CB 3.48Å; L420-E424 WeakPolarHBondContact O-CG 3.4Å; L420-E424 PolarHBondContact O-N 2.82Å |
| 421 | Y | 76.7 | Confident | 75.6 | Confident | 155 Ų | 155 | 129.4 Ų | 129.4 | 61% | 0.608 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -61 | -45.9 | 176.8 | -170.9 | -92 | 0 | 0 | 0 | 112.6 | T419 M423 E424 Y425 | T419-Y421 PolarHBondContact O-N 2.69Å; T419-Y421 VanDerWaalsContact O-N 3.14Å; Y421-M423 VanDerWaalsContact C-N 3.26Å; Y421-M423 PolarHBondContact O-N 3.14Å; Y421-E424 PolarHBondContact O-N 3.12Å; Y421-Y425 AromaticContact CD2-CD2 3.51Å; Y421-Y425 HydrophobicContact CD2-CD2 3.51Å; Y421-Y425 AromaticContact CD2-CE2 3.72Å; Y421-Y425 HydrophobicContact CD2-CE2 3.72Å; Y421-Y425 HydrophobicContact CD2-CG 4.23Å; Y421-Y425 HydrophobicContact CE1-CG 4.38Å; Y421-Y425 HydrophobicContact CE2-CD1 4.27Å; Y421-Y425 AromaticContact CE2-CD2 3.5Å; Y421-Y425 HydrophobicContact CE2-CD2 3.5Å; Y421-Y425 HydrophobicContact CE2-CE1 4.37Å; Y421-Y425 AromaticContact CE2-CE2 3.64Å; Y421-Y425 HydrophobicContact CE2-CE2 3.64Å; Y421-Y425 AromaticContact CE2-CG 3.84Å; Y421-Y425 HydrophobicContact CE2-CG 3.84Å; Y421-Y425 HydrophobicContact CG-CD2 4.07Å; Y421-Y425 AromaticContact CZ-CG 3.92Å; Y421-Y425 WeakPolarHBondContact O-CB 3.36Å; Y421-Y425 PolarHBondContact O-N 3.21Å |
| 422 | R | 77.1 | Confident | 76.4 | Confident | 163 Ų | 163 | 127 Ų | 127 | 62% | 0.615 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -64.5 | -30.4 | 178.4 | -173.3 | 176.1 | 174.3 | 125.8 | 1.7 | 112.4 | T419 L420 | T419-R422 PolarHBondContact O-N 2.93Å; T419-R422 WeakPolarHBondContact OG1-CB 3.24Å; T419-R422 PolarHBondContact OG1-N 3.47Å; L420-R422 PolarHBondContact O-N 3.07Å |
| 423 | M | 77.6 | Confident | 77 | Confident | 126 Ų | 126 | 118.7 Ų | 118.7 | 62% | 0.621 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -80.7 | -39.7 | 176.7 | -61.5 | -135.6 | -58.6 | 0 | 0 | 113 | A418 T419 L420 Y421 | A418-M423 HydrophobicContact CB-CG 4.32Å; A418-M423 HydrophobicContact CB-SD 4.31Å; T419-M423 PolarHBondContact O-N 3.12Å; T419-M423 VanDerWaalsContact O-N 3.12Å; L420-M423 PolarHBondContact O-N 3.02Å; Y421-M423 VanDerWaalsContact C-N 3.26Å; Y421-M423 PolarHBondContact O-N 3.14Å |
| 424 | E | 78.6 | Confident | 77.7 | Confident | 124 Ų | 124 | 115.3 Ų | 115.3 | 58% | 0.579 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -81.9 | -32.9 | -176.1 | -70.7 | -177.8 | 178.2 | 0 | 0 | 113.4 | L420 Y421 T426 | L420-E424 WeakPolarHBondContact O-CB 3.48Å; L420-E424 WeakPolarHBondContact O-CG 3.4Å; L420-E424 PolarHBondContact O-N 2.82Å; Y421-E424 PolarHBondContact O-N 3.12Å; E424-T426 PolarHBondContact O-N 3.5Å |
| 425 | Y | 77.6 | Confident | 78 | Confident | 156 Ų | 156 | 109.7 Ų | 109.7 | 61% | 0.612 | 55% | 0.547 | S | S | * | . | trans | -99.5 | 58.3 | -178.2 | -72.6 | -97.8 | 0 | 0 | 0 | 111.9 | Y421 | Y421-Y425 AromaticContact CD2-CD2 3.51Å; Y421-Y425 HydrophobicContact CD2-CD2 3.51Å; Y421-Y425 AromaticContact CD2-CE2 3.72Å; Y421-Y425 HydrophobicContact CD2-CE2 3.72Å; Y421-Y425 HydrophobicContact CD2-CG 4.23Å; Y421-Y425 HydrophobicContact CE1-CG 4.38Å; Y421-Y425 HydrophobicContact CE2-CD1 4.27Å; Y421-Y425 AromaticContact CE2-CD2 3.5Å; Y421-Y425 HydrophobicContact CE2-CD2 3.5Å; Y421-Y425 HydrophobicContact CE2-CE1 4.37Å; Y421-Y425 AromaticContact CE2-CE2 3.64Å; Y421-Y425 HydrophobicContact CE2-CE2 3.64Å; Y421-Y425 AromaticContact CE2-CG 3.84Å; Y421-Y425 HydrophobicContact CE2-CG 3.84Å; Y421-Y425 HydrophobicContact CG-CD2 4.07Å; Y421-Y425 AromaticContact CZ-CG 3.92Å; Y421-Y425 WeakPolarHBondContact O-CB 3.36Å; Y421-Y425 PolarHBondContact O-N 3.21Å | ||
| 426 | T | 77.2 | Confident | 78.1 | Confident | 81 Ų | 81 | 104.6 Ų | 104.6 | 50% | 0.497 | 53% | 0.533 | S | S | . | . | trans | -87.1 | 147.2 | 167.6 | 51.1 | 0 | 0 | 0 | 0 | 110.6 | E424 K428 | E424-T426 PolarHBondContact O-N 3.5Å; T426-K428 PolarHBondContact O-N 3.49Å | ||
| 427 | P | 77.8 | Confident | 78.2 | Confident | 117 Ų | 117 | 100.6 Ų | 100.6 | 76% | 0.76 | 51% | 0.511 | S | S | * | . | trans | -60.3 | 110.3 | 178.3 | 21.2 | -30.1 | 0 | 0 | 0 | 110.4 | ||||
| 428 | K | 77 | Confident | 78.3 | Confident | 155 Ų | 155 | 96.8 Ų | 96.8 | 67% | 0.674 | 49% | 0.491 | S | S | * | . | trans | -82.4 | 122.6 | 178.5 | -60 | -176.8 | -175.5 | 177.3 | 0 | 109 | T426 L430 | T426-K428 PolarHBondContact O-N 3.49Å; K428-L430 PolarHBondContact O-N 3.35Å; K428-L430 VanDerWaalsContact O-N 3.16Å | ||
| 429 | H | 75.9 | Confident | 78.1 | Confident | 143 Ų | 143 | 101.8 Ų | 101.8 | 66% | 0.662 | 51% | 0.511 | S | S | * | . | trans | -67.8 | 111.3 | 173.5 | -174.3 | -100.1 | 0 | 0 | 0 | 109.6 | E431 | H429-E431 IonicContact CE1-OE1 2.73Å; H429-E431 PolarHBondContact CE1-OE1 2.85Å; H429-E431 IonicContact ND1-OE1 2.92Å | ||
| 430 | L | 70.9 | Confident | 77.5 | Confident | 145 Ų | 145 | 101.3 Ų | 101.3 | 76% | 0.759 | 51% | 0.508 | S | S | * | . | trans | -100.2 | 110.8 | 175.3 | -60.8 | -179.5 | 0 | 0 | 0 | 108.9 | K428 | K428-L430 PolarHBondContact O-N 3.35Å; K428-L430 VanDerWaalsContact O-N 3.16Å | ||
| 431 | E | 74.4 | Confident | 77.1 | Confident | 151 Ų | 151 | 99.5 Ų | 99.5 | 71% | 0.706 | 52% | 0.52 | S | S | * | . | P | Polyproline II helix | trans | -60.1 | 128 | 173.6 | -74.5 | -69.6 | 162.6 | 0 | 0 | 110.5 | H429 | H429-E431 IonicContact CE1-OE1 2.73Å; H429-E431 PolarHBondContact CE1-OE1 2.85Å; H429-E431 IonicContact ND1-OE1 2.92Å |
| 432 | P | 77 | Confident | 77 | Confident | 75 Ų | 75 | 98.7 Ų | 98.7 | 49% | 0.487 | 53% | 0.526 | S | S | . | . | P | Polyproline II helix | trans | -56.7 | 140.7 | 177 | -23.3 | 32.2 | 0 | 0 | 0 | 111.6 | L437 | P432-L437 HydrophobicContact CB-CD1 4.35Å; P432-L437 HydrophobicContact CB-CD2 4.37Å; P432-L437 HydrophobicContact CB-CG 4.37Å |
| 433 | C | 81.7 | Confident | 77.1 | Confident | 17 Ų | 17 | 92.4 Ų | 92.4 | 12% | 0.115 | 51% | 0.507 | C | S | . | . | P | Polyproline II helix | trans | -58.5 | 128.8 | 176.8 | 177.6 | 0 | 0 | 0 | 0 | 110.1 | N15 C16 A435 S436 L437 | N15-C433 PolarHBondContact N-SG 3.04Å; N15-C433 VanDerWaalsContact N-SG 3.38Å; C16-C433 HydrophobicContact CB-CB 3.95Å; C16-C433 PolarHBondContact SG-SG 2.92Å; C433-A435 PolarHBondContact O-N 3.46Å; C433-A435 VanDerWaalsContact O-N 3.09Å; C433-S436 WeakPolarHBondContact O-CA 3.46Å; C433-S436 VanDerWaalsContact O-CB 3.25Å; C433-S436 WeakPolarHBondContact O-CB 3.29Å; C433-S436 PolarHBondContact O-N 2.82Å; C433-L437 PolarHBondContact O-N 3.02Å |
| 434 | P | 82.6 | Confident | 77.3 | Confident | 37 Ų | 37 | 93.7 Ų | 93.7 | 24% | 0.24 | 51% | 0.509 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -60.6 | -28.6 | -176.9 | 4.4 | -6.6 | 0 | 0 | 0 | 112.6 | I13 S436 L437 Y445 | I13-P434 HydrophobicContact CG2-CB 3.83Å; I13-P434 HydrophobicContact CG2-CG 4.38Å; I13-P434 WeakPolarHBondContact O-CG 3.47Å; P434-S436 VanDerWaalsContact C-N 3.34Å; P434-S436 PolarHBondContact O-N 2.67Å; P434-L437 PolarHBondContact O-N 3.36Å; P434-Y445 HydrophobicContact CB-CE2 4.12Å |
| 435 | A | 81.2 | Confident | 77.5 | Confident | 6 Ų | 6 | 90 Ų | 90 | 5% | 0.05 | 49% | 0.49 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.3 | -29.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | I10 I13 C14 H19 C433 L437 L438 | I10-A435 HydrophobicContact CG1-CB 4.38Å; I13-A435 HydrophobicContact CG2-CB 4.33Å; C14-A435 HydrophobicContact CB-CB 3.81Å; H19-A435 HydrophobicContact CB-CB 3.91Å; C433-A435 PolarHBondContact O-N 3.46Å; C433-A435 VanDerWaalsContact O-N 3.09Å; A435-L437 PolarHBondContact O-N 3.19Å; A435-L438 HydrophobicContact CB-CD1 4.19Å; A435-L438 WeakPolarHBondContact O-CD1 3.2Å; A435-L438 WeakPolarHBondContact O-CG 3.38Å; A435-L438 PolarHBondContact O-N 3.41Å |
| 436 | S | 80.3 | Confident | 77.8 | Confident | 67 Ų | 67 | 85.7 Ų | 85.7 | 47% | 0.469 | 48% | 0.48 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.9 | -25.8 | 175.3 | -172.6 | 0 | 0 | 0 | 0 | 111.8 | C433 P434 | C433-S436 WeakPolarHBondContact O-CA 3.46Å; C433-S436 VanDerWaalsContact O-CB 3.25Å; C433-S436 WeakPolarHBondContact O-CB 3.29Å; C433-S436 PolarHBondContact O-N 2.82Å; P434-S436 VanDerWaalsContact C-N 3.34Å; P434-S436 PolarHBondContact O-N 2.67Å |
| 437 | L | 81.2 | Confident | 78.1 | Confident | 47 Ų | 47 | 87.2 Ų | 87.2 | 25% | 0.246 | 48% | 0.477 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -84.2 | -9.9 | -178.3 | -63.5 | 174.8 | 0 | 0 | 0 | 112.5 | P432 C433 P434 A435 N439 T440 S443 | P432-L437 HydrophobicContact CB-CD1 4.35Å; P432-L437 HydrophobicContact CB-CD2 4.37Å; P432-L437 HydrophobicContact CB-CG 4.37Å; C433-L437 PolarHBondContact O-N 3.02Å; P434-L437 PolarHBondContact O-N 3.36Å; A435-L437 PolarHBondContact O-N 3.19Å; L437-N439 PolarHBondContact O-N 2.62Å; L437-N439 VanDerWaalsContact O-N 3.07Å; L437-T440 VanDerWaalsContact CA-OG1 3.25Å; L437-T440 WeakPolarHBondContact CA-OG1 3.46Å; L437-T440 CarbonylContact O-C 3.53Å; L437-T440 PolarHBondContact O-N 3.18Å; L437-T440 PolarHBondContact O-OG1 2.97Å; L437-S443 WeakPolarHBondContact O-CB 3.4Å |
| 438 | L | 79.4 | Confident | 78.3 | Confident | 16 Ų | 16 | 83.6 Ų | 83.6 | 8% | 0.084 | 46% | 0.455 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -56.7 | -31.4 | -171.4 | -67.2 | 170.4 | 0 | 0 | 0 | 114.5 | I10 I13 A435 Y445 Y458 | I10-L438 HydrophobicContact CD1-CD1 3.96Å; I10-L438 HydrophobicContact CG1-CD1 3.53Å; I13-L438 HydrophobicContact CD1-CD2 4.36Å; I13-L438 HydrophobicContact CG2-CD2 4.47Å; A435-L438 HydrophobicContact CB-CD1 4.19Å; A435-L438 WeakPolarHBondContact O-CD1 3.2Å; A435-L438 WeakPolarHBondContact O-CG 3.38Å; A435-L438 PolarHBondContact O-N 3.41Å; L438-Y445 HydrophobicContact CD2-CD2 4.33Å; L438-Y445 HydrophobicContact CD2-CG 4.29Å; L438-Y458 HydrophobicContact CB-CE1 4.07Å; L438-Y458 HydrophobicContact CD1-CD1 4.5Å; L438-Y458 HydrophobicContact CD1-CD2 4.31Å; L438-Y458 HydrophobicContact CD1-CE1 4.03Å; L438-Y458 HydrophobicContact CD1-CE2 3.81Å; L438-Y458 HydrophobicContact CD2-CD1 3.72Å; L438-Y458 HydrophobicContact CD2-CE1 3.81Å; L438-Y458 HydrophobicContact CD2-CG 4.14Å; L438-Y458 HydrophobicContact CG-CE1 4.18Å |
| 439 | N | 74.3 | Confident | 78.6 | Confident | 154 Ų | 154 | 80 Ų | 80 | 82% | 0.824 | 44% | 0.441 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.1 | -12.5 | -179 | -62.9 | -20.5 | 0 | 0 | 0 | 113.7 | L437 | L437-N439 PolarHBondContact O-N 2.62Å; L437-N439 VanDerWaalsContact O-N 3.07Å |
| 440 | T | 68.5 | Low | 78.9 | Confident | 65 Ų | 65 | 76.6 Ų | 76.6 | 40% | 0.399 | 43% | 0.43 | S | S | . | . | S | Bend | trans | -95.4 | 123.9 | 173.6 | 56.4 | 0 | 0 | 0 | 0 | 105.9 | L437 L442 S443 | L437-T440 VanDerWaalsContact CA-OG1 3.25Å; L437-T440 WeakPolarHBondContact CA-OG1 3.46Å; L437-T440 CarbonylContact O-C 3.53Å; L437-T440 PolarHBondContact O-N 3.18Å; L437-T440 PolarHBondContact O-OG1 2.97Å; T440-L442 PolarHBondContact O-N 3.36Å; T440-S443 PolarHBondContact O-N 2.94Å |
| 441 | G | 72.7 | Confident | 79.2 | Confident | 89 Ų | 89 | 71.6 Ų | 71.6 | 92% | 0.918 | 41% | 0.407 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.6 | 8.9 | -171.9 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||
| 442 | L | 74.4 | Confident | 79.2 | Confident | 139 Ų | 139 | 72.7 Ų | 72.7 | 73% | 0.728 | 42% | 0.417 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.6 | 2.3 | 171.8 | -54 | 176.2 | 0 | 0 | 0 | 113.9 | T440 | T440-L442 PolarHBondContact O-N 3.36Š|
| 443 | S | 78.5 | Confident | 79 | Confident | 30 Ų | 30 | 73 Ų | 73 | 21% | 0.21 | 42% | 0.418 | C | S | . | . | trans | -73.1 | 139.8 | -179.4 | 68 | 0 | 0 | 0 | 0 | 113 | L437 T440 Y445 | L437-S443 WeakPolarHBondContact O-CB 3.4Å; T440-S443 PolarHBondContact O-N 2.94Å; S443-Y445 PolarHBondContact O-N 2.76Å; S443-Y445 PolarHBondContact OG-O 2.82Å | ||
| 444 | K | 81.8 | Confident | 78.5 | Confident | 153 Ų | 153 | 73.4 Ų | 73.4 | 67% | 0.665 | 43% | 0.425 | S | S | * | . | S | Bend | trans | -79.3 | 1.8 | 168.3 | -62.4 | -176.9 | -178.2 | 178.9 | 0 | 112.9 | R460 A461 | K444-R460 WeakPolarHBondContact O-CA 3.41Å; K444-A461 PolarHBondContact O-N 2.85Å |
| 445 | Y | 83.5 | Confident | 78.3 | Confident | 46 Ų | 46 | 73 Ų | 73 | 18% | 0.18 | 42% | 0.42 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127 | 119.4 | -170 | -67.9 | -75.2 | 0 | 0 | 0 | 109.1 | L8 I13 P434 L438 S443 R459 R460 | L8-Y445 HydrophobicContact CD1-CE1 4.02Å; I13-Y445 HydrophobicContact CD1-CD1 4.1Å; I13-Y445 HydrophobicContact CD1-CD2 4.44Å; I13-Y445 HydrophobicContact CD1-CG 4.07Å; I13-Y445 HydrophobicContact CG1-CD1 4.42Å; I13-Y445 HydrophobicContact CG1-CE1 4.34Å; I13-Y445 HydrophobicContact CG1-CE2 4.47Å; I13-Y445 HydrophobicContact CG2-CD2 3.68Å; I13-Y445 HydrophobicContact CG2-CE2 3.6Å; I13-Y445 HydrophobicContact CG2-CG 4.37Å; P434-Y445 HydrophobicContact CB-CE2 4.12Å; L438-Y445 HydrophobicContact CD2-CD2 4.33Å; L438-Y445 HydrophobicContact CD2-CG 4.29Å; S443-Y445 PolarHBondContact O-N 2.76Å; S443-Y445 PolarHBondContact OG-O 2.82Å; Y445-R459 CarbonylContact C-O 3.57Å; Y445-R459 WeakPolarHBondContact CA-O 3.29Å; Y445-R460 HydrophobicContact CE1-CB 4.47Å |
| 446 | V | 82.8 | Confident | 78.3 | Confident | 67 Ų | 67 | 76.9 Ų | 76.9 | 41% | 0.406 | 44% | 0.437 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.4 | 134.1 | 177.9 | -178.8 | 0 | 0 | 0 | 0 | 108.2 | S448 Y458 R459 A461 | V446-S448 PolarHBondContact O-N 2.89Å; V446-Y458 CarbonylContact O-C 3.55Å; V446-Y458 VanDerWaalsContact O-CA 3.31Å; V446-Y458 WeakPolarHBondContact O-CA 3.46Å; V446-R459 HydrophobicContact CB-CG 4.41Å; V446-R459 PolarHBondContact N-O 3.37Å; V446-R459 PolarHBondContact O-N 3.12Å; V446-A461 HydrophobicContact CG2-CB 3.97Å |
| 447 | Y | 83.9 | Confident | 78.5 | Confident | 112 Ų | 112 | 74.9 Ų | 74.9 | 44% | 0.439 | 42% | 0.421 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -57.3 | 133.1 | 173.7 | 173.9 | -97.7 | 0 | 0 | 0 | 110.1 | T450 Q456 Y458 | Y447-T450 PolarHBondContact OH-N 3.21Å; Y447-T450 PolarHBondContact OH-OG1 2.84Å; Y447-Q456 HydrophobicContact CD2-CB 4.47Å; Y447-Q456 HydrophobicContact CE2-CB 4.2Å; Y447-Q456 HydrophobicContact CE2-CG 4.2Å; Y447-Y458 HydrophobicContact CD2-CE1 4.4Å |
| 448 | S | 83 | Confident | 78.6 | Confident | 42 Ų | 42 | 73 Ų | 73 | 29% | 0.294 | 41% | 0.411 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.5 | -58.5 | -177.5 | 60.1 | 0 | 0 | 0 | 0 | 111.9 | V446 I457 | V446-S448 PolarHBondContact O-N 2.89Å; S448-I457 PolarHBondContact N-O 3.24Å; S448-I457 VanDerWaalsContact OG-C 3.3Å; S448-I457 WeakPolarHBondContact OG-CG2 3.49Å; S448-I457 PolarHBondContact OG-O 3.04Å |
| 449 | E | 82.9 | Confident | 78.9 | Confident | 80 Ų | 80 | 79 Ų | 79 | 37% | 0.374 | 43% | 0.432 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -157.9 | 162 | -175 | 64.4 | -164.1 | 174.4 | 0 | 0 | 110 | K7 I457 | K7-E449 WeakPolarHBondContact CD-OE1 3.49Å; K7-E449 WeakPolarHBondContact CE-OE1 3.41Å; K7-E449 IonicContact NZ-OE1 3.26Å; K7-E449 PolarHBondContact NZ-OE1 2.95Å; K7-E449 IonicContact NZ-OE2 2.73Å; E449-I457 HydrophobicContact CG-CB 4.04Å; E449-I457 HydrophobicContact CG-CD1 3.94Å; E449-I457 HydrophobicContact CG-CG1 4.45Å; E449-I457 HydrophobicContact CG-CG2 4.5Å; E449-I457 PolarHBondContact N-O 2.79Å; E449-I457 WeakPolarHBondContact O-CB 3.46Å; E449-I457 PolarHBondContact O-N 2.9Å |
| 450 | T | 82 | Confident | 79.1 | Confident | 70 Ų | 70 | 79.1 Ų | 79.1 | 43% | 0.429 | 42% | 0.421 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103 | 121.7 | 165.5 | -64.7 | 0 | 0 | 0 | 0 | 107.2 | Y447 H455 | Y447-T450 PolarHBondContact OH-N 3.21Å; Y447-T450 PolarHBondContact OH-OG1 2.84Å; T450-H455 CarbonylContact C-O 3.55Å; T450-H455 VanDerWaalsContact CA-O 3.32Å; T450-H455 WeakPolarHBondContact CA-O 3.28Å |
| 451 | S | 77.3 | Confident | 79.2 | Confident | 40 Ų | 40 | 78 Ų | 78 | 28% | 0.28 | 42% | 0.419 | S | S | . | . | trans | -62.9 | 152.8 | 174.9 | -179.4 | 0 | 0 | 0 | 0 | 110.9 | T453 G454 H455 | S451-T453 PolarHBondContact O-N 3.05Å; S451-T453 PolarHBondContact OG-OG1 3.22Å; S451-G454 WeakPolarHBondContact O-CA 3.37Å; S451-G454 PolarHBondContact O-N 2.87Å; S451-H455 PolarHBondContact N-O 3.47Å | ||
| 452 | D | 75.2 | Confident | 78.7 | Confident | 174 Ų | 174 | 78.5 Ų | 78.5 | 93% | 0.93 | 41% | 0.408 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.3 | -22.7 | 174 | -58.1 | -25.5 | 0 | 0 | 0 | 113.6 | G454 | D452-G454 VanDerWaalsContact C-N 3.3Š|
| 453 | T | 71.9 | Confident | 77.6 | Confident | 83 Ų | 83 | 79.9 Ų | 79.9 | 51% | 0.509 | 42% | 0.416 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.1 | 10.8 | 175.8 | 66.5 | 0 | 0 | 0 | 0 | 113.6 | H23 S451 H455 | H23-T453 WeakPolarHBondContact CB-O 3.46Å; S451-T453 PolarHBondContact O-N 3.05Å; S451-T453 PolarHBondContact OG-OG1 3.22Å; T453-H455 PolarHBondContact OG1-CD2 3.13Å |
| 454 | G | 72.2 | Confident | 75.9 | Confident | 25 Ų | 25 | 82.9 Ų | 82.9 | 26% | 0.258 | 44% | 0.437 | S | S | . | . | S | Bend | trans | 78.6 | 16.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | S451 D452 | S451-G454 WeakPolarHBondContact O-CA 3.37Å; S451-G454 PolarHBondContact O-N 2.87Å; D452-G454 VanDerWaalsContact C-N 3.3Å |
| 455 | H | 76.8 | Confident | 74 | Confident | 28 Ų | 28 | 80.9 Ų | 80.9 | 13% | 0.13 | 44% | 0.443 | C | S | . | . | trans | -83.7 | 125 | 175.1 | -68.2 | -57.6 | 0 | 0 | 0 | 111.6 | C21 T450 S451 T453 I457 | C21-H455 PolarHBondContact SG-ND1 3.48Å; T450-H455 CarbonylContact C-O 3.55Å; T450-H455 VanDerWaalsContact CA-O 3.32Å; T450-H455 WeakPolarHBondContact CA-O 3.28Å; S451-H455 PolarHBondContact N-O 3.47Å; T453-H455 PolarHBondContact OG1-CD2 3.13Å; H455-I457 PolarHBondContact O-N 3.08Å | ||
| 456 | Q | 82.1 | Confident | 71.8 | Confident | 88 Ų | 88 | 84 Ų | 84 | 41% | 0.411 | 47% | 0.471 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.2 | 115.9 | 166.1 | -67.8 | -179.8 | -8.4 | 0 | 0 | 109.4 | C9 Y447 Y458 | C9-Q456 WeakPolarHBondContact CA-O 3.48Å; Y447-Q456 HydrophobicContact CD2-CB 4.47Å; Y447-Q456 HydrophobicContact CE2-CB 4.2Å; Y447-Q456 HydrophobicContact CE2-CG 4.2Å; Q456-Y458 HydrophobicContact CB-CE2 3.94Å; Q456-Y458 PolarHBondContact OE1-OH 3.35Å |
| 457 | I | 84 | Confident | 70 | Confident | 25 Ų | 25 | 86.6 Ų | 86.6 | 13% | 0.128 | 49% | 0.489 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.6 | 129.9 | -178 | -60.7 | 175.7 | 0 | 0 | 0 | 108.9 | K7 S448 E449 H455 | K7-I457 HydrophobicContact CB-CG2 3.52Å; K7-I457 HydrophobicContact CD-CG2 4.25Å; K7-I457 HydrophobicContact CG-CG2 3.94Å; S448-I457 PolarHBondContact N-O 3.24Å; S448-I457 VanDerWaalsContact OG-C 3.3Å; S448-I457 WeakPolarHBondContact OG-CG2 3.49Å; S448-I457 PolarHBondContact OG-O 3.04Å; E449-I457 HydrophobicContact CG-CB 4.04Å; E449-I457 HydrophobicContact CG-CD1 3.94Å; E449-I457 HydrophobicContact CG-CG1 4.45Å; E449-I457 HydrophobicContact CG-CG2 4.5Å; E449-I457 PolarHBondContact N-O 2.79Å; E449-I457 WeakPolarHBondContact O-CB 3.46Å; E449-I457 PolarHBondContact O-N 2.9Å; H455-I457 PolarHBondContact O-N 3.08Å |
| 458 | Y | 84.7 | Confident | 67.6 | Low | 8 Ų | 8 | 87.7 Ų | 87.7 | 3% | 0.031 | 51% | 0.508 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.6 | 145.8 | 175.3 | -56.6 | -101 | 0 | 0 | 0 | 110.9 | L8 I10 I13 L438 V446 Y447 Q456 | L8-Y458 PolarHBondContact N-O 2.8Å; L8-Y458 PolarHBondContact O-N 2.69Å; I10-Y458 HydrophobicContact CB-CE2 4.3Å; I10-Y458 HydrophobicContact CG1-CE2 4.25Å; I13-Y458 HydrophobicContact CD1-CD2 3.67Å; I13-Y458 HydrophobicContact CD1-CG 3.85Å; L438-Y458 HydrophobicContact CB-CE1 4.07Å; L438-Y458 HydrophobicContact CD1-CD1 4.5Å; L438-Y458 HydrophobicContact CD1-CD2 4.31Å; L438-Y458 HydrophobicContact CD1-CE1 4.03Å; L438-Y458 HydrophobicContact CD1-CE2 3.81Å; L438-Y458 HydrophobicContact CD2-CD1 3.72Å; L438-Y458 HydrophobicContact CD2-CE1 3.81Å; L438-Y458 HydrophobicContact CD2-CG 4.14Å; L438-Y458 HydrophobicContact CG-CE1 4.18Å; V446-Y458 CarbonylContact O-C 3.55Å; V446-Y458 VanDerWaalsContact O-CA 3.31Å; V446-Y458 WeakPolarHBondContact O-CA 3.46Å; Y447-Y458 HydrophobicContact CD2-CE1 4.4Å; Q456-Y458 HydrophobicContact CB-CE2 3.94Å; Q456-Y458 PolarHBondContact OE1-OH 3.35Å |
| 459 | R | 84.2 | Confident | 65.3 | Low | 141 Ų | 141 | 91.7 Ų | 91.7 | 53% | 0.532 | 53% | 0.526 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.6 | 146 | 170.8 | 63.5 | -178.1 | -179.8 | 166.1 | 1.6 | 109.5 | Y445 V446 A461 | Y445-R459 CarbonylContact C-O 3.57Å; Y445-R459 WeakPolarHBondContact CA-O 3.29Å; V446-R459 HydrophobicContact CB-CG 4.41Å; V446-R459 PolarHBondContact N-O 3.37Å; V446-R459 PolarHBondContact O-N 3.12Å; R459-A461 PolarHBondContact O-N 2.87Å |
| 460 | R | 79.4 | Confident | 63.1 | Low | 156 Ų | 156 | 95.8 Ų | 95.8 | 59% | 0.589 | 55% | 0.55 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -66.6 | 128.8 | 173.5 | -163.2 | 170.6 | 176.9 | 171.2 | -2.8 | 108.9 | K444 Y445 S462 | K444-R460 WeakPolarHBondContact O-CA 3.41Å; Y445-R460 HydrophobicContact CE1-CB 4.47Å; R460-S462 PolarHBondContact O-N 3.12Å |
| 461 | A | 70.9 | Confident | 61.1 | Low | 43 Ų | 43 | 100.3 Ų | 100.3 | 36% | 0.355 | 57% | 0.566 | S | S | . | * | P | Polyproline II helix | trans | -60.3 | 125.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 108.6 | K444 V446 R459 | K444-A461 PolarHBondContact O-N 2.85Å; V446-A461 HydrophobicContact CG2-CB 3.97Å; R459-A461 PolarHBondContact O-N 2.87Å |
| 462 | S | 61.6 | Low | 59.2 | Low | 99 Ų | 99 | 107.7 Ų | 107.7 | 69% | 0.692 | 59% | 0.59 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 133.3 | 173.1 | 47.9 | 0 | 0 | 0 | 0 | 109.4 | R460 S464 | R460-S462 PolarHBondContact O-N 3.12Å; S462-S464 VanDerWaalsContact C-N 3.28Å; S462-S464 PolarHBondContact O-N 3.31Å |
| 463 | D | 51.6 | Low | 57.4 | Low | 168 Ų | 168 | 104 Ų | 104 | 90% | 0.898 | 58% | 0.577 | S | S | * | * | S | Bend | trans | -64.1 | 80.3 | -179.6 | -59.7 | -50 | 0 | 0 | 0 | 111 | ||
| 464 | S | 42.4 | Very low | 56 | Low | 93 Ų | 93 | 108.9 Ų | 108.9 | 65% | 0.65 | 59% | 0.592 | S | S | * | * | trans | -155.9 | 52.5 | 177 | 69.7 | 0 | 0 | 0 | 0 | 112.9 | S462 | S462-S464 VanDerWaalsContact C-N 3.28Å; S462-S464 PolarHBondContact O-N 3.31Å | ||
| 465 | S | 41.9 | Very low | 54.5 | Low | 111 Ų | 111 | 115 Ų | 115 | 78% | 0.776 | 61% | 0.614 | S | S | * | * | trans | 174.9 | 95.7 | 150.6 | 47.7 | 0 | 0 | 0 | 0 | 109 | P467 | S465-P467 VanDerWaalsContact O-CD 3.25Å; S465-P467 WeakPolarHBondContact O-CD 3.44Å | ||
| 466 | S | 36.2 | Very low | 52.6 | Low | 111 Ų | 111 | 122.9 Ų | 122.9 | 78% | 0.776 | 65% | 0.65 | S | S | * | * | trans | -61.5 | 117 | 165.4 | 45.2 | 0 | 0 | 0 | 0 | 109.8 | T468 | S466-T468 PolarHBondContact O-N 2.91Š| ||
| 467 | P | 45.3 | Very low | 50.3 | Low | 121 Ų | 121 | 124 Ų | 124 | 79% | 0.786 | 66% | 0.658 | S | S | * | * | trans | -82.1 | 109.5 | 158.6 | 19.4 | -2.7 | 0 | 0 | 0 | 106.8 | S465 N469 | S465-P467 VanDerWaalsContact O-CD 3.25Å; S465-P467 WeakPolarHBondContact O-CD 3.44Å; P467-N469 PolarHBondContact O-N 2.88Å | ||
| 468 | T | 34.7 | Very low | 48.1 | Very low | 136 Ų | 136 | 130.5 Ų | 130.5 | 83% | 0.834 | 69% | 0.691 | S | S | * | * | trans | -56.2 | 102.4 | 160.3 | 44.9 | 0 | 0 | 0 | 0 | 108.6 | S466 | S466-T468 PolarHBondContact O-N 2.91Š| ||
| 469 | N | 34.5 | Very low | 45.7 | Very low | 125 Ų | 125 | 135.3 Ų | 135.3 | 67% | 0.668 | 72% | 0.722 | S | S | * | * | trans | -153.6 | 77.9 | 158.6 | -141.1 | -5.8 | 0 | 0 | 0 | 110.8 | P467 Q471 | P467-N469 PolarHBondContact O-N 2.88Å; N469-Q471 PolarHBondContact O-N 3.14Å; N469-Q471 VanDerWaalsContact O-N 3.11Å | ||
| 470 | D | 37 | Very low | 43.8 | Very low | 167 Ų | 167 | 134.4 Ų | 134.4 | 89% | 0.893 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80 | 29.1 | -179.8 | -125.7 | -0.5 | 0 | 0 | 0 | 112.6 | ||
| 471 | Q | 39.7 | Very low | 42.2 | Very low | 164 Ų | 164 | 132.1 Ų | 132.1 | 77% | 0.766 | 73% | 0.732 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.2 | 1.4 | -170.1 | -72.2 | -170.2 | -14.2 | 0 | 0 | 116 | N469 | N469-Q471 PolarHBondContact O-N 3.14Å; N469-Q471 VanDerWaalsContact O-N 3.11Å |
| 472 | Y | 36.7 | Very low | 41 | Very low | 195 Ų | 195 | 136.3 Ų | 136.3 | 77% | 0.765 | 75% | 0.748 | S | S | * | * | S | Bend | trans | -139.9 | 71 | -179.9 | -96.2 | -90.3 | 0 | 0 | 0 | 112.5 | ||
| 473 | S | 38.5 | Very low | 40.4 | Very low | 96 Ų | 96 | 139.8 Ų | 139.8 | 67% | 0.671 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -142.7 | 9.4 | 169.9 | 63.7 | 0 | 0 | 0 | 0 | 115.5 | ||
| 474 | K | 41.8 | Very low | 40.1 | Very low | 187 Ų | 187 | 136.8 Ų | 136.8 | 81% | 0.813 | 74% | 0.743 | S | S | * | * | S | Bend | trans | -110.3 | 8.7 | 179.3 | -79.5 | -174.6 | 177.5 | 178.1 | 0 | 116.4 | ||
| 475 | Q | 40.2 | Very low | 40.3 | Very low | 154 Ų | 154 | 140.4 Ų | 140.4 | 72% | 0.72 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -106 | 2.6 | -173.3 | -71.2 | -175.3 | -12 | 0 | 0 | 116.4 | ||
| 476 | H | 36.7 | Very low | 40.4 | Very low | 193 Ų | 193 | 141.5 Ų | 141.5 | 89% | 0.894 | 76% | 0.756 | S | S | * | * | S | Bend | trans | -130.4 | 19.5 | 171.4 | -92.2 | -60.8 | 0 | 0 | 0 | 114.6 | I478 | H476-I478 PolarHBondContact O-N 3.37Š|
| 477 | L | 34.8 | Very low | 41 | Very low | 110 Ų | 110 | 142 Ų | 142 | 58% | 0.576 | 75% | 0.754 | S | S | * | * | trans | -84.3 | 109.4 | 163.1 | -79.5 | 152.8 | 0 | 0 | 0 | 107.4 | T479 | L477-T479 PolarHBondContact O-N 3.41Š| ||
| 478 | I | 37 | Very low | 41 | Very low | 162 Ų | 162 | 140.8 Ų | 140.8 | 83% | 0.831 | 76% | 0.755 | S | S | * | * | trans | -69.1 | 78.9 | 161.9 | -57.9 | 173.8 | 0 | 0 | 0 | 105.8 | H476 I480 | H476-I478 PolarHBondContact O-N 3.37Å; I478-I480 HydrophobicContact CG2-CG1 4.41Å; I478-I480 PolarHBondContact O-N 2.94Å | ||
| 479 | T | 34.2 | Very low | 41.4 | Very low | 110 Ų | 110 | 145.3 Ų | 145.3 | 68% | 0.675 | 77% | 0.774 | S | S | * | * | trans | -75.5 | 100.4 | 170.5 | -57.3 | 0 | 0 | 0 | 0 | 106.1 | L477 P481 | L477-T479 PolarHBondContact O-N 3.41Å; T479-P481 WeakPolarHBondContact O-CD 3.35Å | ||
| 480 | I | 44.8 | Very low | 41.7 | Very low | 121 Ų | 121 | 146.3 Ų | 146.3 | 62% | 0.621 | 78% | 0.779 | S | S | * | * | trans | -67.6 | 118.5 | 167.2 | -57.6 | 173.4 | 0 | 0 | 0 | 106.1 | I478 N482 | I478-I480 HydrophobicContact CG2-CG1 4.41Å; I478-I480 PolarHBondContact O-N 2.94Å; I480-N482 PolarHBondContact O-N 2.83Å | ||
| 481 | P | 44.9 | Very low | 41.9 | Very low | 108 Ų | 108 | 145.2 Ų | 145.2 | 70% | 0.701 | 77% | 0.773 | S | S | * | * | trans | -71.8 | 105.5 | 175.6 | 28.2 | -29.1 | 0 | 0 | 0 | 108.2 | T479 E483 | T479-P481 WeakPolarHBondContact O-CD 3.35Å; P481-E483 VanDerWaalsContact C-N 3.29Å; P481-E483 PolarHBondContact O-N 3.38Å | ||
| 482 | N | 46.5 | Very low | 42.1 | Very low | 132 Ų | 132 | 144.2 Ų | 144.2 | 71% | 0.706 | 77% | 0.773 | S | S | * | * | trans | -84.5 | 78.2 | 163 | -77 | -23.9 | 0 | 0 | 0 | 107.7 | I480 | I480-N482 PolarHBondContact O-N 2.83Š| ||
| 483 | E | 49.9 | Very low | 42.4 | Very low | 172 Ų | 172 | 141.2 Ų | 141.2 | 80% | 0.804 | 77% | 0.774 | S | S | * | * | trans | -78.6 | 126.3 | 162.9 | -104.1 | -175.6 | 166 | 0 | 0 | 108.8 | P481 L485 | P481-E483 VanDerWaalsContact C-N 3.29Å; P481-E483 PolarHBondContact O-N 3.38Å; E483-L485 PolarHBondContact O-N 3.28Å | ||
| 484 | P | 44.2 | Very low | 42.6 | Very low | 104 Ų | 104 | 144 Ų | 144 | 68% | 0.675 | 78% | 0.78 | S | S | * | * | trans | -68.8 | 117.4 | 169.5 | 28 | -29.9 | 0 | 0 | 0 | 108.3 | T486 | P484-T486 VanDerWaalsContact C-N 3.28Å; P484-T486 PolarHBondContact O-N 3.05Å | ||
| 485 | L | 47.1 | Very low | 42.7 | Very low | 170 Ų | 170 | 141.1 Ų | 141.1 | 89% | 0.89 | 78% | 0.778 | S | S | * | * | trans | -62.4 | 91.6 | 167.8 | -78.1 | 160.5 | 0 | 0 | 0 | 108.6 | E483 V487 | E483-L485 PolarHBondContact O-N 3.28Å; L485-V487 PolarHBondContact O-N 3.03Å; L485-V487 VanDerWaalsContact O-N 3.1Å | ||
| 486 | T | 44.2 | Very low | 42.9 | Very low | 133 Ų | 133 | 140.2 Ų | 140.2 | 82% | 0.816 | 78% | 0.782 | S | S | * | * | trans | -66.3 | 102.6 | 162.3 | 41.7 | 0 | 0 | 0 | 0 | 107.8 | P484 A488 | P484-T486 VanDerWaalsContact C-N 3.28Å; P484-T486 PolarHBondContact O-N 3.05Å; T486-A488 PolarHBondContact O-N 3.02Å | ||
| 487 | V | 47.7 | Very low | 43.3 | Very low | 122 Ų | 122 | 136.2 Ų | 136.2 | 74% | 0.739 | 77% | 0.774 | S | S | * | * | trans | -66.7 | 108.7 | 167.1 | 178.2 | 0 | 0 | 0 | 0 | 107.1 | L485 N489 | L485-V487 PolarHBondContact O-N 3.03Å; L485-V487 VanDerWaalsContact O-N 3.1Å; V487-N489 PolarHBondContact O-N 2.82Å | ||
| 488 | A | 45.6 | Very low | 44 | Very low | 96 Ų | 96 | 138.3 Ų | 138.3 | 79% | 0.793 | 79% | 0.79 | S | S | * | * | trans | -68.5 | 121.2 | 162.6 | 0 | 0 | 0 | 0 | 0 | 107.9 | T486 | T486-A488 PolarHBondContact O-N 3.02Š| ||
| 489 | N | 42.6 | Very low | 44.7 | Very low | 230 Ų | 230 | 136.2 Ų | 136.2 | 100% | 1.23 | 79% | 0.786 | S | S | * | * | trans | -69.1 | 0 | 168.4 | -81.6 | -28.7 | 0 | 0 | 0 | 111.6 | V487 | V487-N489 PolarHBondContact O-N 2.82Š|
Retrieved 489 of 489 residues in 241.4 ms
(Link to these results)