| 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 | D | 50.5 | Low | 47.5 | Very low | 207 Ų | 207 | 120.8 Ų | 120.8 | 100% | 1.107 | 64% | 0.638 | S | S | * | * | 0 | -26.4 | 0 | -88.6 | -123.9 | 0 | 0 | 0 | 115.9 | |||||
| 2 | I | 39.8 | Very low | 47.5 | Very low | 178 Ų | 178 | 113.5 Ų | 113.5 | 91% | 0.913 | 60% | 0.597 | S | S | * | * | trans | -126.2 | 130.8 | 167.1 | -58.4 | 177.9 | 0 | 0 | 0 | 107.4 | ||||
| 3 | G | 46.2 | Very low | 47.3 | Very low | 66 Ų | 66 | 111.5 Ų | 111.5 | 68% | 0.68 | 58% | 0.58 | S | S | * | * | S | Bend | trans | 98.8 | 150.4 | -171.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | G5 | G3-G5 PolarHBondContact O-N 3.18Š|
| 4 | H | 42.3 | Very low | 47.1 | Very low | 180 Ų | 180 | 109.6 Ų | 109.6 | 83% | 0.833 | 58% | 0.575 | S | S | * | * | trans | -72.3 | 68.5 | -179.2 | -67.5 | 104.5 | 0 | 0 | 0 | 112.2 | V6 | H4-V6 PolarHBondContact O-N 3.39Š| ||
| 5 | G | 42.4 | Very low | 46.8 | Very low | 54 Ų | 54 | 107.2 Ų | 107.2 | 56% | 0.557 | 57% | 0.572 | S | S | * | * | trans | -69.2 | 127.2 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | G3 K7 | G3-G5 PolarHBondContact O-N 3.18Å; G5-K7 PolarHBondContact O-N 2.74Å | ||
| 6 | V | 51.1 | Low | 46.9 | Very low | 78 Ų | 78 | 106 Ų | 106 | 47% | 0.473 | 57% | 0.57 | S | S | . | * | trans | -69.3 | 66.5 | 177.6 | -164.5 | 0 | 0 | 0 | 0 | 111.7 | H4 W8 L9 L10 | H4-V6 PolarHBondContact O-N 3.39Å; V6-W8 PolarHBondContact O-N 3.32Å; V6-L9 HydrophobicContact CG1-CB 3.64Å; V6-L9 PolarHBondContact O-N 3.48Å; V6-L10 PolarHBondContact O-N 2.85Å | ||
| 7 | K | 51.1 | Low | 46.7 | Very low | 178 Ų | 178 | 109.8 Ų | 109.8 | 77% | 0.774 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -62.2 | -26.5 | -174.3 | -72.8 | 168.9 | 71.4 | 172 | 0 | 113.1 | G5 R11 | G5-K7 PolarHBondContact O-N 2.74Å; K7-R11 WeakPolarHBondContact O-CB 3.37Å; K7-R11 PolarHBondContact O-N 3.42Å; K7-R11 VanDerWaalsContact O-N 3.16Å |
| 8 | W | 45.5 | Very low | 46.3 | Very low | 91 Ų | 91 | 109.2 Ų | 109.2 | 35% | 0.345 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -71.4 | -52.2 | 178.2 | -176.9 | 101.6 | 0 | 0 | 0 | 111.3 | V6 L10 R11 F12 V339 I390 | V6-W8 PolarHBondContact O-N 3.32Å; W8-L10 VanDerWaalsContact C-N 3.29Å; W8-L10 PolarHBondContact O-N 2.75Å; W8-R11 WeakPolarHBondContact O-CA 3.46Å; W8-R11 WeakPolarHBondContact O-CB 3.14Å; W8-R11 PolarHBondContact O-N 3.44Å; W8-F12 HydrophobicContact CD2-CD2 4.04Å; W8-F12 AromaticContact CD2-CE2 3.96Å; W8-F12 HydrophobicContact CD2-CE2 3.96Å; W8-F12 AromaticContact CE2-CE2 3.57Å; W8-F12 HydrophobicContact CE3-CD2 4.36Å; W8-F12 HydrophobicContact CG-CD2 4.5Å; W8-F12 HydrophobicContact CG-CE2 4.24Å; W8-F12 HydrophobicContact CZ2-CD2 4.35Å; W8-F12 HydrophobicContact CZ2-CE2 4.01Å; W8-F12 AromaticContact NE1-CE2 3.6Å; W8-F12 VanDerWaalsContact O-CD2 3.3Å; W8-F12 WeakPolarHBondContact O-CD2 3.25Å; W8-F12 PolarHBondContact O-N 2.9Å; W8-V339 HydrophobicContact CH2-CB 3.8Å; W8-V339 HydrophobicContact CH2-CG1 3.41Å; W8-V339 VanDerWaalsContact CH2-CG1 3.41Å; W8-V339 HydrophobicContact CH2-CG2 4.25Å; W8-V339 HydrophobicContact CZ2-CB 4.5Å; W8-V339 HydrophobicContact CZ2-CG1 3.66Å; W8-I390 HydrophobicContact CH2-CG1 4.04Å; W8-I390 HydrophobicContact CZ3-CG1 4.21Å; W8-I390 HydrophobicContact CZ3-CG2 4.42Å |
| 9 | L | 52 | Low | 46.3 | Very low | 53 Ų | 53 | 112.5 Ų | 112.5 | 28% | 0.277 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -62.3 | -37.4 | 179.2 | -171.7 | 65.2 | 0 | 0 | 0 | 111.6 | V6 R11 F12 K13 | V6-L9 HydrophobicContact CG1-CB 3.64Å; V6-L9 PolarHBondContact O-N 3.48Å; L9-R11 VanDerWaalsContact C-N 3.31Å; L9-R11 PolarHBondContact O-N 2.91Å; L9-F12 PolarHBondContact O-N 3.26Å; L9-K13 VanDerWaalsContact O-CB 3.29Å; L9-K13 WeakPolarHBondContact O-CB 3.28Å; L9-K13 PolarHBondContact O-N 3.37Å |
| 10 | L | 49.3 | Very low | 46.1 | Very low | 95 Ų | 95 | 116.5 Ų | 116.5 | 50% | 0.497 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -65.1 | -33.1 | 174.3 | -131.5 | 73.2 | 0 | 0 | 0 | 112.7 | V6 W8 F12 V14 | V6-L10 PolarHBondContact O-N 2.85Å; W8-L10 VanDerWaalsContact C-N 3.29Å; W8-L10 PolarHBondContact O-N 2.75Å; L10-F12 VanDerWaalsContact C-N 3.26Å; L10-F12 PolarHBondContact O-N 3.2Å; L10-V14 WeakPolarHBondContact O-CB 3.37Å; L10-V14 VanDerWaalsContact O-CG2 3.25Å; L10-V14 WeakPolarHBondContact O-CG2 3.44Å; L10-V14 PolarHBondContact O-N 2.69Å |
| 11 | R | 52 | Low | 45.5 | Very low | 149 Ų | 149 | 118.7 Ų | 118.7 | 56% | 0.562 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -61.4 | -33.1 | 175.9 | -160 | -170.4 | -152.4 | 178.1 | 7.9 | 112.7 | K7 W8 L9 | K7-R11 WeakPolarHBondContact O-CB 3.37Å; K7-R11 PolarHBondContact O-N 3.42Å; K7-R11 VanDerWaalsContact O-N 3.16Å; W8-R11 WeakPolarHBondContact O-CA 3.46Å; W8-R11 WeakPolarHBondContact O-CB 3.14Å; W8-R11 PolarHBondContact O-N 3.44Å; L9-R11 VanDerWaalsContact C-N 3.31Å; L9-R11 PolarHBondContact O-N 2.91Å |
| 12 | F | 48 | Very low | 45.1 | Very low | 33 Ų | 33 | 112.4 Ų | 112.4 | 15% | 0.145 | 60% | 0.599 | C | S | . | * | H | α-helix | trans | -94.1 | -36.8 | 178.8 | -67.7 | -79.2 | 0 | 0 | 0 | 112.5 | W8 L9 L10 V14 S15 T16 | W8-F12 HydrophobicContact CD2-CD2 4.04Å; W8-F12 AromaticContact CD2-CE2 3.96Å; W8-F12 HydrophobicContact CD2-CE2 3.96Å; W8-F12 AromaticContact CE2-CE2 3.57Å; W8-F12 HydrophobicContact CE3-CD2 4.36Å; W8-F12 HydrophobicContact CG-CD2 4.5Å; W8-F12 HydrophobicContact CG-CE2 4.24Å; W8-F12 HydrophobicContact CZ2-CD2 4.35Å; W8-F12 HydrophobicContact CZ2-CE2 4.01Å; W8-F12 AromaticContact NE1-CE2 3.6Å; W8-F12 VanDerWaalsContact O-CD2 3.3Å; W8-F12 WeakPolarHBondContact O-CD2 3.25Å; W8-F12 PolarHBondContact O-N 2.9Å; L9-F12 PolarHBondContact O-N 3.26Å; L10-F12 VanDerWaalsContact C-N 3.26Å; L10-F12 PolarHBondContact O-N 3.2Å; F12-V14 VanDerWaalsContact C-N 3.27Å; F12-V14 PolarHBondContact O-N 2.71Å; F12-S15 WeakPolarHBondContact O-CA 3.14Å; F12-S15 WeakPolarHBondContact O-CB 3.47Å; F12-S15 PolarHBondContact O-N 3.41Å; F12-T16 PolarHBondContact O-N 2.82Å |
| 13 | K | 45 | Very low | 45.2 | Very low | 87 Ų | 87 | 107.4 Ų | 107.4 | 38% | 0.378 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -65.4 | -27 | 174.1 | -170.4 | 153.8 | 68.7 | 175.7 | 0 | 113 | L9 T16 | L9-K13 VanDerWaalsContact O-CB 3.29Å; L9-K13 WeakPolarHBondContact O-CB 3.28Å; L9-K13 PolarHBondContact O-N 3.37Å; K13-T16 PolarHBondContact O-OG1 2.78Å; K13-T16 VanDerWaalsContact O-OG1 3.12Å |
| 14 | V | 44.6 | Very low | 44.8 | Very low | 85 Ų | 85 | 112 Ų | 112 | 52% | 0.515 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -75.2 | -26.5 | 167.1 | 171.7 | 0 | 0 | 0 | 0 | 112 | L10 F12 Q17 N18 | L10-V14 WeakPolarHBondContact O-CB 3.37Å; L10-V14 VanDerWaalsContact O-CG2 3.25Å; L10-V14 WeakPolarHBondContact O-CG2 3.44Å; L10-V14 PolarHBondContact O-N 2.69Å; F12-V14 VanDerWaalsContact C-N 3.27Å; F12-V14 PolarHBondContact O-N 2.71Å; V14-Q17 PolarHBondContact O-N 2.76Å; V14-N18 WeakPolarHBondContact O-CB 3.29Å; V14-N18 PolarHBondContact O-N 3.21Å |
| 15 | S | 42.8 | Very low | 44.9 | Very low | 74 Ų | 74 | 109.3 Ų | 109.3 | 52% | 0.517 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -70.6 | -36.4 | 178.5 | -153.1 | 0 | 0 | 0 | 0 | 112.3 | F12 Q17 | F12-S15 WeakPolarHBondContact O-CA 3.14Å; F12-S15 WeakPolarHBondContact O-CB 3.47Å; F12-S15 PolarHBondContact O-N 3.41Å; S15-Q17 VanDerWaalsContact C-N 3.34Å |
| 16 | T | 47.1 | Very low | 44.8 | Very low | 88 Ų | 88 | 113.9 Ų | 113.9 | 54% | 0.54 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -72.9 | -24.4 | 175.7 | 54.8 | 0 | 0 | 0 | 0 | 113.3 | F12 K13 | F12-T16 PolarHBondContact O-N 2.82Å; K13-T16 PolarHBondContact O-OG1 2.78Å; K13-T16 VanDerWaalsContact O-OG1 3.12Å |
| 17 | Q | 44.4 | Very low | 44.4 | Very low | 170 Ų | 170 | 116.4 Ų | 116.4 | 79% | 0.794 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -92 | -20.8 | 175.2 | -69.4 | -161.7 | -12.3 | 0 | 0 | 114.6 | V14 S15 M19 | V14-Q17 PolarHBondContact O-N 2.76Å; S15-Q17 VanDerWaalsContact C-N 3.34Å; Q17-M19 VanDerWaalsContact C-N 3.25Å; Q17-M19 PolarHBondContact O-N 3.17Å |
| 18 | N | 40.1 | Very low | 43.9 | Very low | 100 Ų | 100 | 113.1 Ų | 113.1 | 54% | 0.535 | 61% | 0.61 | S | S | . | * | trans | -88.1 | 56.3 | 179.9 | -161.1 | -8.4 | 0 | 0 | 0 | 113.2 | V14 K20 | V14-N18 WeakPolarHBondContact O-CB 3.29Å; V14-N18 PolarHBondContact O-N 3.21Å; N18-K20 PolarHBondContact O-N 2.77Å | ||
| 19 | M | 45.4 | Very low | 44 | Very low | 172 Ų | 172 | 112.4 Ų | 112.4 | 85% | 0.847 | 62% | 0.616 | S | S | * | * | trans | -73.7 | 109.6 | 153.5 | -75.3 | -168.2 | -101.1 | 0 | 0 | 108.3 | Q17 | Q17-M19 VanDerWaalsContact C-N 3.25Å; Q17-M19 PolarHBondContact O-N 3.17Å | ||
| 20 | K | 43.5 | Very low | 43.9 | Very low | 192 Ų | 192 | 114 Ų | 114 | 84% | 0.835 | 63% | 0.63 | S | S | * | * | S | Bend | trans | 92.4 | 66.4 | 161.2 | -158.1 | 171 | 178.8 | 173.3 | 0 | 118.7 | N18 | N18-K20 PolarHBondContact O-N 2.77Š|
| 21 | M | 33 | Very low | 44.1 | Very low | 163 Ų | 163 | 115.6 Ų | 115.6 | 80% | 0.803 | 64% | 0.644 | S | S | * | * | -155 | 145.1 | 124.2 | -157.9 | 58.8 | 69.6 | 0 | 0 | 111 | |||||
| 22 | G | 40.5 | Very low | 44.4 | Very low | 74 Ų | 74 | 116.4 Ų | 116.4 | 76% | 0.763 | 65% | 0.654 | S | S | * | * | trans | -85.7 | 165 | -173.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 23 | G | 43.2 | Very low | 45.4 | Very low | 73 Ų | 73 | 120.2 Ų | 120.2 | 75% | 0.753 | 67% | 0.67 | S | S | * | * | trans | 115.8 | 91.7 | 158.2 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 24 | L | 37.7 | Very low | 46.7 | Very low | 163 Ų | 163 | 117 Ų | 117 | 85% | 0.853 | 66% | 0.659 | S | S | * | * | trans | 173 | 143 | 132.1 | -92.6 | 170.3 | 0 | 0 | 0 | 108.5 | R26 | L24-R26 PolarHBondContact O-N 2.97Š| ||
| 25 | P | 44.4 | Very low | 47.9 | Very low | 123 Ų | 123 | 118.3 Ų | 118.3 | 80% | 0.799 | 67% | 0.669 | S | S | * | * | trans | -77.5 | 86.5 | -177.2 | 32.2 | -33.7 | 0 | 0 | 0 | 110.4 | T27 | P25-T27 PolarHBondContact O-N 2.98Š| ||
| 26 | R | 40.6 | Very low | 49.4 | Very low | 151 Ų | 151 | 118.2 Ų | 118.2 | 57% | 0.57 | 67% | 0.668 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 133.5 | 158.8 | -77.6 | 173.5 | 64.4 | 142.9 | -11.5 | 107.2 | L24 T28 | L24-R26 PolarHBondContact O-N 2.97Å; R26-T28 PolarHBondContact O-N 2.88Å |
| 27 | T | 42.6 | Very low | 50.6 | Low | 130 Ų | 130 | 114.9 Ų | 114.9 | 80% | 0.798 | 65% | 0.648 | S | S | * | * | P | Polyproline II helix | trans | -48.6 | 119 | 173.5 | 53.6 | 0 | 0 | 0 | 0 | 107.9 | P25 P29 | P25-T27 PolarHBondContact O-N 2.98Å; T27-P29 WeakPolarHBondContact O-CD 3.47Å; T27-P29 VanDerWaalsContact O-N 3.12Å |
| 28 | T | 39.6 | Very low | 51.8 | Low | 110 Ų | 110 | 111.4 Ų | 111.4 | 68% | 0.675 | 64% | 0.64 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 122.5 | -177.8 | 46.3 | 0 | 0 | 0 | 0 | 108.2 | R26 T31 | R26-T28 PolarHBondContact O-N 2.88Å; T28-T31 HydrophobicContact CG2-CG2 4.39Å |
| 29 | P | 47.8 | Very low | 53.1 | Low | 75 Ų | 75 | 112.3 Ų | 112.3 | 49% | 0.487 | 64% | 0.643 | S | S | . | * | P | Polyproline II helix | trans | -53.8 | 149.6 | 161.4 | 27.6 | -33.5 | 0 | 0 | 0 | 107.1 | T27 T31 | T27-P29 WeakPolarHBondContact O-CD 3.47Å; T27-P29 VanDerWaalsContact O-N 3.12Å; P29-T31 PolarHBondContact O-N 3.41Å |
| 30 | P | 49.5 | Very low | 53.7 | Low | 86 Ų | 86 | 106.8 Ų | 106.8 | 56% | 0.558 | 62% | 0.621 | S | S | * | * | trans | -51.8 | 112.8 | -173.5 | 21.7 | -33.2 | 0 | 0 | 0 | 109.1 | Q32 | P30-Q32 PolarHBondContact O-N 2.92Š| ||
| 31 | T | 53.9 | Low | 54.1 | Low | 130 Ų | 130 | 100.5 Ų | 100.5 | 80% | 0.798 | 61% | 0.611 | S | S | * | * | S | Bend | trans | -69.4 | 5.2 | -169.7 | 54.7 | 0 | 0 | 0 | 0 | 113.1 | T28 P29 | T28-T31 HydrophobicContact CG2-CG2 4.39Å; P29-T31 PolarHBondContact O-N 3.41Å |
| 32 | Q | 59.3 | Low | 54.9 | Low | 166 Ų | 166 | 102.9 Ų | 102.9 | 78% | 0.776 | 62% | 0.617 | S | S | * | * | S | Bend | trans | -98.7 | 96.8 | 174.5 | -172.9 | 162 | 53.7 | 0 | 0 | 108.2 | P30 | P30-Q32 PolarHBondContact O-N 2.92Š|
| 33 | K | 67.9 | Low | 55.3 | Low | 112 Ų | 112 | 102.8 Ų | 102.8 | 49% | 0.487 | 62% | 0.616 | S | S | . | * | trans | -37.5 | 124.1 | 165.2 | 172 | 168.1 | 175.4 | 162 | 0 | 109.3 | Y386 | K33-Y386 HydrophobicContact CD-CE1 4.26Å; K33-Y386 WeakPolarHBondContact CE-OH 3.27Å; K33-Y386 HydrophobicContact CG-CE1 3.97Å; K33-Y386 WeakPolarHBondContact CG-OH 3.17Å | ||
| 34 | P | 71.8 | Confident | 55.3 | Low | 21 Ų | 21 | 106 Ų | 106 | 14% | 0.136 | 62% | 0.621 | C | S | . | * | P | Polyproline II helix | trans | -64.1 | 148.7 | -172.9 | 28.7 | -36.6 | 0 | 0 | 0 | 109.8 | S36 Y342 Y386 | P34-S36 PolarHBondContact O-N 3.44Å; P34-Y342 HydrophobicContact CB-CE2 4.48Å; P34-Y342 VanDerWaalsContact CD-CD2 3.49Å; P34-Y342 HydrophobicContact CG-CD2 3.58Å; P34-Y342 HydrophobicContact CG-CE2 3.57Å; P34-Y342 HydrophobicContact CG-CG 4.37Å; P34-Y386 HydrophobicContact CG-CD2 4.13Å; P34-Y386 HydrophobicContact CG-CE1 4.49Å; P34-Y386 HydrophobicContact CG-CE2 3.79Å; P34-Y386 PolarHBondContact O-OH 3.22Å |
| 35 | P | 71.6 | Confident | 56 | Low | 111 Ų | 111 | 107.2 Ų | 107.2 | 72% | 0.721 | 63% | 0.628 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 128.4 | -177.4 | 24.6 | -34 | 0 | 0 | 0 | 109.7 | N385 | P35-N385 PolarHBondContact O-ND2 3.14Š|
| 36 | S | 72.5 | Confident | 56.3 | Low | 73 Ų | 73 | 104.1 Ų | 104.1 | 51% | 0.51 | 62% | 0.618 | S | S | . | * | P | Polyproline II helix | trans | -58.8 | 140.9 | 175.9 | -55.5 | 0 | 0 | 0 | 0 | 109.9 | P34 | P34-S36 PolarHBondContact O-N 3.44Š|
| 37 | P | 73.4 | Confident | 56.7 | Low | 18 Ų | 18 | 108.4 Ų | 108.4 | 12% | 0.117 | 63% | 0.634 | C | S | . | * | P | Polyproline II helix | trans | -56.6 | 154.8 | 168.9 | 24.5 | -31.9 | 0 | 0 | 0 | 109.9 | M39 W370 P383 N385 | P37-M39 PolarHBondContact O-N 2.99Å; P37-W370 HydrophobicContact CG-CD2 4.26Å; P37-W370 HydrophobicContact CG-CG 4.4Å; P37-W370 HydrophobicContact CG-CZ2 4.26Å; P37-P383 HydrophobicContact CG-CB 3.43Å; P37-P383 VanDerWaalsContact CG-CB 3.43Å; P37-N385 WeakPolarHBondContact CD-OD1 3.46Å |
| 38 | P | 69 | Low | 56.8 | Low | 97 Ų | 97 | 110.7 Ų | 110.7 | 63% | 0.63 | 64% | 0.635 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 135.2 | 178.1 | 25.1 | -34.4 | 0 | 0 | 0 | 109.5 | S40 W370 | P38-S40 PolarHBondContact O-N 3.16Å; P38-W370 PolarHBondContact O-NE1 3.43Å |
| 39 | M | 67.6 | Low | 57 | Low | 118 Ų | 118 | 109.8 Ų | 109.8 | 58% | 0.581 | 63% | 0.633 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 136.5 | 175.4 | -63.1 | 176 | 82.8 | 0 | 0 | 109.1 | P37 G41 | P37-M39 PolarHBondContact O-N 2.99Å; M39-G41 PolarHBondContact O-N 3.43Å |
| 40 | S | 57.8 | Low | 57.4 | Low | 56 Ų | 56 | 112 Ų | 112 | 39% | 0.392 | 65% | 0.648 | S | S | . | * | trans | -67 | 58.8 | 175.5 | -45.4 | 0 | 0 | 0 | 0 | 112.3 | P38 K42 D368 | P38-S40 PolarHBondContact O-N 3.16Å; S40-K42 PolarHBondContact O-N 3.35Å; S40-D368 VanDerWaalsContact CB-OD2 3.26Å; S40-D368 WeakPolarHBondContact CB-OD2 3.34Å; S40-D368 PolarHBondContact OG-OD2 3.35Å | ||
| 41 | G | 52.9 | Low | 57.1 | Low | 61 Ų | 61 | 118.3 Ų | 118.3 | 63% | 0.629 | 66% | 0.662 | S | S | * | * | trans | -82.9 | 106.2 | -178.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | M39 G43 | M39-G41 PolarHBondContact O-N 3.43Å; G41-G43 PolarHBondContact O-N 2.98Å; G41-G43 VanDerWaalsContact O-N 3.11Å | ||
| 42 | K | 48.7 | Very low | 56.8 | Low | 212 Ų | 212 | 119.9 Ų | 119.9 | 92% | 0.922 | 65% | 0.653 | S | S | * | * | trans | -55.1 | 117.7 | 170.1 | -164.2 | 131.7 | 60.3 | -164.1 | 0 | 108.7 | S40 T44 | S40-K42 PolarHBondContact O-N 3.35Å; K42-T44 PolarHBondContact O-N 2.83Å | ||
| 43 | G | 48.4 | Very low | 56.6 | Low | 73 Ų | 73 | 118 Ų | 118 | 75% | 0.753 | 65% | 0.653 | S | S | * | * | trans | -62.8 | 128.2 | -152.9 | 0 | 0 | 0 | 0 | 0 | 115.7 | G41 | G41-G43 PolarHBondContact O-N 2.98Å; G41-G43 VanDerWaalsContact O-N 3.11Å | ||
| 44 | T | 43.5 | Very low | 56 | Low | 139 Ų | 139 | 120 Ų | 120 | 85% | 0.853 | 67% | 0.669 | S | S | * | * | trans | -108.2 | 102.3 | 146.9 | 48.1 | 0 | 0 | 0 | 0 | 108.4 | K42 G46 | K42-T44 PolarHBondContact O-N 2.83Å; T44-G46 PolarHBondContact O-N 3.29Å | ||
| 45 | L | 53 | Low | 55.4 | Low | 190 Ų | 190 | 125.3 Ų | 125.3 | 100% | 0.995 | 69% | 0.692 | S | S | * | * | trans | -70.6 | 91.9 | -178.7 | -169.3 | 80.2 | 0 | 0 | 0 | 110.2 | ||||
| 46 | G | 50.6 | Low | 54.8 | Low | 57 Ų | 57 | 125.8 Ų | 125.8 | 59% | 0.588 | 69% | 0.694 | S | S | * | * | trans | 143.2 | 109.4 | 161.9 | 0 | 0 | 0 | 0 | 0 | 116.1 | T44 | T44-G46 PolarHBondContact O-N 3.29Š| ||
| 47 | R | 48.6 | Very low | 54.3 | Low | 242 Ų | 242 | 128.5 Ų | 128.5 | 91% | 0.913 | 71% | 0.708 | S | S | * | * | S | Bend | 176.7 | -6.9 | 100 | -93.5 | 173.7 | -175 | -82.6 | -1.6 | 115.1 | |||
| 48 | H | 44.3 | Very low | 54.1 | Low | 177 Ų | 177 | 138.4 Ų | 138.4 | 82% | 0.819 | 74% | 0.743 | S | S | * | * | trans | -146.4 | 27.6 | -169.2 | 55.8 | -82.5 | 0 | 0 | 0 | 116.5 | ||||
| 49 | S | 44.2 | Very low | 53.6 | Low | 91 Ų | 91 | 138.8 Ų | 138.8 | 64% | 0.636 | 75% | 0.745 | S | S | * | * | trans | -70.9 | 131.7 | 167 | -47.6 | 0 | 0 | 0 | 0 | 110.4 | Y51 R52 | S49-Y51 PolarHBondContact O-N 3.3Å; S49-R52 PolarHBondContact O-N 2.97Å | ||
| 50 | P | 56.6 | Low | 53.4 | Low | 122 Ų | 122 | 138.8 Ų | 138.8 | 79% | 0.792 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -68.1 | -20.9 | -179.7 | 27.1 | -34.3 | 0 | 0 | 0 | 112.9 | R52 | P50-R52 PolarHBondContact O-N 2.66Š|
| 51 | Y | 42.6 | Very low | 53.9 | Low | 218 Ų | 218 | 142.7 Ų | 142.7 | 86% | 0.855 | 78% | 0.775 | S | S | * | * | trans | -93.8 | 62.3 | 171.1 | -57 | -73.5 | 0 | 0 | 0 | 111 | S49 T53 | S49-Y51 PolarHBondContact O-N 3.3Å; Y51-T53 PolarHBondContact O-N 2.78Å | ||
| 52 | R | 47.8 | Very low | 54.5 | Low | 164 Ų | 164 | 144.9 Ų | 144.9 | 62% | 0.619 | 78% | 0.776 | S | S | * | * | trans | -70.4 | 112 | 164.9 | -133.6 | -78 | -169.3 | 159.4 | 5.4 | 106.3 | S49 P50 L54 E55 | S49-R52 PolarHBondContact O-N 2.97Å; P50-R52 PolarHBondContact O-N 2.66Å; R52-L54 PolarHBondContact O-N 3.32Å; R52-L54 VanDerWaalsContact O-N 3.08Å; R52-E55 IonicContact CZ-OE1 3.9Å; R52-E55 IonicContact NH1-OE1 3.14Å; R52-E55 PolarHBondContact NH1-OE1 2.98Å; R52-E55 VanDerWaalsContact NH1-OE1 3.14Å; R52-E55 IonicContact NH2-OE1 3.63Å | ||
| 53 | T | 54.8 | Low | 55.1 | Low | 126 Ų | 126 | 138.9 Ų | 138.9 | 77% | 0.773 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -52.6 | 120.8 | 161.2 | 43.2 | 0 | 0 | 0 | 0 | 106.7 | Y51 E55 | Y51-T53 PolarHBondContact O-N 2.78Å; T53-E55 PolarHBondContact O-N 3.06Å |
| 54 | L | 55.9 | Low | 55.4 | Low | 154 Ų | 154 | 142.3 Ų | 142.3 | 81% | 0.806 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 129.1 | -178.1 | -65.8 | 176.3 | 0 | 0 | 0 | 107.4 | R52 | R52-L54 PolarHBondContact O-N 3.32Å; R52-L54 VanDerWaalsContact O-N 3.08Å |
| 55 | E | 58.7 | Low | 56 | Low | 133 Ų | 133 | 142.9 Ų | 142.9 | 62% | 0.621 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 133.4 | 174.2 | -159.8 | 161 | -90.4 | 0 | 0 | 107.7 | R52 T53 V57 | R52-E55 IonicContact CZ-OE1 3.9Å; R52-E55 IonicContact NH1-OE1 3.14Å; R52-E55 PolarHBondContact NH1-OE1 2.98Å; R52-E55 VanDerWaalsContact NH1-OE1 3.14Å; R52-E55 IonicContact NH2-OE1 3.63Å; T53-E55 PolarHBondContact O-N 3.06Å; E55-V57 PolarHBondContact O-N 3.06Å |
| 56 | P | 60.1 | Low | 55.7 | Low | 120 Ų | 120 | 143.8 Ų | 143.8 | 78% | 0.779 | 75% | 0.75 | S | S | * | * | trans | -52.8 | 107.4 | -175.7 | -29.1 | 35.8 | 0 | 0 | 0 | 110.2 | R58 | P56-R58 PolarHBondContact O-N 3.18Š| ||
| 57 | V | 61.8 | Low | 55.7 | Low | 130 Ų | 130 | 145.7 Ų | 145.7 | 79% | 0.788 | 75% | 0.75 | S | S | * | * | trans | -60.8 | 115.1 | -176.6 | 177.7 | 0 | 0 | 0 | 0 | 106.2 | E55 P59 | E55-V57 PolarHBondContact O-N 3.06Å; V57-P59 VanDerWaalsContact O-N 3.16Å | ||
| 58 | R | 68.6 | Low | 55.7 | Low | 226 Ų | 226 | 139.7 Ų | 139.7 | 85% | 0.853 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 126.3 | 177.7 | -99.3 | -175.3 | -74.6 | 145.9 | -3.7 | 107.8 | P56 | P56-R58 PolarHBondContact O-N 3.18Š|
| 59 | P | 59.5 | Low | 55.6 | Low | 106 Ų | 106 | 136.3 Ų | 136.3 | 69% | 0.688 | 74% | 0.738 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 142.7 | -179.2 | 23.8 | -33.3 | 0 | 0 | 0 | 109.1 | V57 V61 | V57-P59 VanDerWaalsContact O-N 3.16Å; P59-V61 PolarHBondContact O-N 2.87Å |
| 60 | P | 63.7 | Low | 55.7 | Low | 118 Ų | 118 | 137.8 Ų | 137.8 | 77% | 0.766 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -59 | 126.7 | -177.9 | 24.1 | -33.4 | 0 | 0 | 0 | 109.8 | V62 | P60-V62 PolarHBondContact O-N 3.38Å; P60-V62 VanDerWaalsContact O-N 3.13Å |
| 61 | V | 68.3 | Low | 55.1 | Low | 138 Ų | 138 | 137.9 Ų | 137.9 | 84% | 0.836 | 74% | 0.744 | S | S | * | * | trans | -71.5 | 107.9 | 173.3 | 179.2 | 0 | 0 | 0 | 0 | 107.5 | P59 P63 | P59-V61 PolarHBondContact O-N 2.87Å; V61-P63 WeakPolarHBondContact O-CD 3.47Å | ||
| 62 | V | 64.6 | Low | 55.5 | Low | 106 Ų | 106 | 137.8 Ų | 137.8 | 64% | 0.642 | 74% | 0.743 | S | S | * | * | trans | -69.8 | 124.7 | 173.1 | -179.1 | 0 | 0 | 0 | 0 | 108.2 | P60 | P60-V62 PolarHBondContact O-N 3.38Å; P60-V62 VanDerWaalsContact O-N 3.13Å | ||
| 63 | P | 61.4 | Low | 55.1 | Low | 87 Ų | 87 | 137 Ų | 137 | 57% | 0.565 | 75% | 0.751 | S | S | * | * | trans | -60.3 | 137.4 | 171.5 | -23.2 | 34.9 | 0 | 0 | 0 | 111 | V61 D65 Y66 | V61-P63 WeakPolarHBondContact O-CD 3.47Å; P63-D65 PolarHBondContact O-N 3.12Å; P63-Y66 PolarHBondContact O-N 3.4Å | ||
| 64 | N | 55.4 | Low | 54.4 | Low | 145 Ų | 145 | 138.4 Ų | 138.4 | 78% | 0.775 | 75% | 0.75 | S | S | * | * | G | 310 helix | trans | -64.4 | -9.3 | -176.6 | -82.2 | -38.8 | 0 | 0 | 0 | 114.1 | Y66 V67 | N64-Y66 PolarHBondContact O-N 3.12Å; N64-Y66 VanDerWaalsContact O-N 3.14Å; N64-V67 PolarHBondContact O-N 2.63Å |
| 65 | D | 56.5 | Low | 53.5 | Low | 151 Ų | 151 | 135.5 Ų | 135.5 | 81% | 0.807 | 75% | 0.748 | S | S | * | * | G | 310 helix | trans | -70 | -4.6 | -179.1 | -48.6 | -68.1 | 0 | 0 | 0 | 114 | P63 | P63-D65 PolarHBondContact O-N 3.12Š|
| 66 | Y | 46.8 | Very low | 52.8 | Low | 208 Ų | 208 | 134.8 Ų | 134.8 | 82% | 0.816 | 76% | 0.755 | S | S | * | * | G | 310 helix | trans | -101.5 | 12.4 | 178.8 | -119.6 | -85.7 | 0 | 0 | 0 | 115.1 | P63 N64 P68 | P63-Y66 PolarHBondContact O-N 3.4Å; N64-Y66 PolarHBondContact O-N 3.12Å; N64-Y66 VanDerWaalsContact O-N 3.14Å; Y66-P68 WeakPolarHBondContact O-CD 3.16Å |
| 67 | V | 49.9 | Very low | 51.6 | Low | 97 Ų | 97 | 135 Ų | 135 | 59% | 0.588 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -89.3 | 114.9 | 170.2 | -172.4 | 0 | 0 | 0 | 0 | 109.2 | N64 S69 | N64-V67 PolarHBondContact O-N 2.63Å; V67-S69 PolarHBondContact O-N 3.28Å; V67-S69 VanDerWaalsContact O-N 3.13Å |
| 68 | P | 47.6 | Very low | 50.6 | Low | 116 Ų | 116 | 137.2 Ų | 137.2 | 75% | 0.753 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 119.2 | 170.8 | -18.5 | 31.9 | 0 | 0 | 0 | 108.8 | Y66 | Y66-P68 WeakPolarHBondContact O-CD 3.16Š|
| 69 | S | 43.7 | Very low | 49.1 | Very low | 106 Ų | 106 | 134.7 Ų | 134.7 | 74% | 0.741 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 128 | -178.1 | -51.9 | 0 | 0 | 0 | 0 | 110.4 | V67 T71 | V67-S69 PolarHBondContact O-N 3.28Å; V67-S69 VanDerWaalsContact O-N 3.13Å; S69-T71 PolarHBondContact O-N 3.28Å; S69-T71 VanDerWaalsContact O-N 3.13Å |
| 70 | P | 45.4 | Very low | 48 | Very low | 123 Ų | 123 | 135.1 Ų | 135.1 | 80% | 0.799 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 121.7 | 176.1 | -25.2 | 34.6 | 0 | 0 | 0 | 110.2 | R72 | P70-R72 PolarHBondContact O-N 3.35Å; P70-R72 VanDerWaalsContact O-N 3.1Å |
| 71 | T | 44.5 | Very low | 48 | Very low | 124 Ų | 124 | 135 Ų | 135 | 76% | 0.761 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 117.4 | -175.7 | -50.1 | 0 | 0 | 0 | 0 | 110.7 | S69 N73 | S69-T71 PolarHBondContact O-N 3.28Å; S69-T71 VanDerWaalsContact O-N 3.13Å; T71-N73 PolarHBondContact O-N 3.5Å |
| 72 | R | 50 | Low | 46.4 | Very low | 216 Ų | 216 | 134.3 Ų | 134.3 | 82% | 0.815 | 76% | 0.76 | S | S | * | * | trans | -55.6 | 103.9 | 168.8 | 168.6 | -179.1 | 145.8 | -177.3 | -6 | 109.2 | P70 | P70-R72 PolarHBondContact O-N 3.35Å; P70-R72 VanDerWaalsContact O-N 3.1Å | ||
| 73 | N | 39.3 | Very low | 45.4 | Very low | 147 Ų | 147 | 140.9 Ų | 140.9 | 79% | 0.786 | 77% | 0.773 | S | S | * | * | trans | -125.9 | 139.2 | 168.3 | -104.1 | -17.1 | 0 | 0 | 0 | 110.5 | T71 | T71-N73 PolarHBondContact O-N 3.5Š| ||
| 74 | M | 40.1 | Very low | 44.5 | Very low | 156 Ų | 156 | 143.1 Ų | 143.1 | 77% | 0.768 | 79% | 0.785 | S | S | * | * | trans | -73.2 | 143.8 | -170.9 | -62.1 | -70.6 | -168.8 | 0 | 0 | 111.8 | ||||
| 75 | A | 36.8 | Very low | 43.7 | Very low | 92 Ų | 92 | 141 Ų | 141 | 76% | 0.76 | 79% | 0.788 | S | S | * | * | trans | -61.8 | 159.2 | 152.2 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 76 | P | 45.1 | Very low | 43.3 | Very low | 118 Ų | 118 | 139.2 Ų | 139.2 | 77% | 0.766 | 79% | 0.787 | S | S | * | * | cis | -144.4 | 165.8 | 31.9 | 41.5 | -23 | 0 | 0 | 0 | 117.6 | ||||
| 77 | S | 35.2 | Very low | 43.1 | Very low | 126 Ų | 126 | 135.5 Ų | 135.5 | 88% | 0.881 | 79% | 0.786 | S | S | * | * | 163.3 | 166.3 | 123.7 | 52.3 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 78 | Q | 41.3 | Very low | 42.8 | Very low | 176 Ų | 176 | 138.3 Ų | 138.3 | 82% | 0.822 | 80% | 0.798 | S | S | * | * | trans | -92.2 | 169.9 | -163.1 | -71.3 | -88.3 | 28.1 | 0 | 0 | 114.1 | ||||
| 79 | Q | 36 | Very low | 42.3 | Very low | 173 Ų | 173 | 140 Ų | 140 | 81% | 0.808 | 80% | 0.795 | S | S | * | * | trans | 105.4 | 88.5 | 152.4 | -57.4 | -177.8 | -21.3 | 0 | 0 | 119.6 | ||||
| 80 | S | 37.3 | Very low | 42 | Very low | 114 Ų | 114 | 144.8 Ų | 144.8 | 80% | 0.797 | 80% | 0.797 | S | S | * | * | 57.3 | 176.3 | 119.6 | -35.7 | 0 | 0 | 0 | 0 | 119.7 | |||||
| 81 | P | 62.2 | Low | 41.9 | Very low | 117 Ų | 117 | 146.6 Ų | 146.6 | 76% | 0.76 | 80% | 0.8 | S | S | * | * | -125.1 | -159.5 | -120.8 | 30.3 | -4.8 | 0 | 0 | 0 | 113.6 | |||||
| 82 | V | 35.8 | Very low | 41.6 | Very low | 123 Ų | 123 | 151.5 Ų | 151.5 | 75% | 0.745 | 81% | 0.805 | S | S | * | * | trans | 90.2 | 113.6 | 171.2 | -172.8 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 83 | R | 43.1 | Very low | 41.2 | Very low | 244 Ų | 244 | 146.5 Ų | 146.5 | 92% | 0.921 | 80% | 0.798 | S | S | * | * | -161.9 | 135.6 | 116.7 | -103.7 | 161.1 | -165.1 | -88.8 | -2 | 112.5 | |||||
| 84 | T | 42.5 | Very low | 41.1 | Very low | 133 Ų | 133 | 149.3 Ų | 149.3 | 82% | 0.816 | 80% | 0.8 | S | S | * | * | trans | -84.9 | 152.1 | 172.5 | 47.8 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 85 | A | 38.8 | Very low | 40.8 | Very low | 100 Ų | 100 | 146.5 Ų | 146.5 | 83% | 0.826 | 80% | 0.795 | S | S | * | * | trans | -177.7 | 128.4 | 138.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 86 | S | 48.8 | Very low | 40.9 | Very low | 115 Ų | 115 | 147.6 Ų | 147.6 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | trans | -88.2 | 141.2 | 163.1 | 45.9 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 87 | V | 41.8 | Very low | 40.4 | Very low | 130 Ų | 130 | 148.3 Ų | 148.3 | 79% | 0.788 | 81% | 0.805 | S | S | * | * | trans | -143.2 | 116.8 | 156 | 175.7 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 88 | N | 44.2 | Very low | 40.3 | Very low | 156 Ų | 156 | 145.2 Ų | 145.2 | 83% | 0.834 | 79% | 0.793 | S | S | * | * | trans | -81 | 131.8 | 161.2 | -90.6 | -45 | 0 | 0 | 0 | 109.9 | ||||
| 89 | Q | 37 | Very low | 40 | Very low | 150 Ų | 150 | 142.9 Ų | 142.9 | 70% | 0.701 | 80% | 0.796 | S | S | * | * | trans | -178.7 | 144.2 | 150.8 | -106.5 | 164.9 | 65.4 | 0 | 0 | 109 | ||||
| 90 | R | 37.4 | Very low | 40.3 | Very low | 207 Ų | 207 | 140 Ų | 140 | 78% | 0.781 | 80% | 0.796 | S | S | * | * | cis | 179.5 | 144.6 | -16.5 | -112.2 | -176.7 | -160.6 | 133.2 | -1.4 | 103.2 | ||||
| 91 | N | 43 | Very low | 40.2 | Very low | 162 Ų | 162 | 138.9 Ų | 138.9 | 87% | 0.866 | 80% | 0.801 | S | S | * | * | trans | -62.4 | 139.6 | 165.9 | -77 | -6 | 0 | 0 | 0 | 111 | ||||
| 92 | R | 38.3 | Very low | 38.8 | Very low | 226 Ų | 226 | 136.8 Ų | 136.8 | 85% | 0.853 | 80% | 0.801 | S | S | * | * | trans | -158.9 | 127.9 | 140.3 | -112.5 | 175 | -143.6 | -104.4 | 2.1 | 112.9 | ||||
| 93 | T | 41.4 | Very low | 38.9 | Very low | 111 Ų | 111 | 137 Ų | 137 | 68% | 0.681 | 81% | 0.808 | S | S | * | * | trans | -50 | 149.3 | 159.6 | -31.9 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 94 | Y | 37.2 | Very low | 38.9 | Very low | 207 Ų | 207 | 133.7 Ų | 133.7 | 81% | 0.812 | 80% | 0.803 | S | S | * | * | -176.5 | 134.8 | 117.3 | -89 | -58.5 | 0 | 0 | 0 | 114.3 | |||||
| 95 | S | 34.4 | Very low | 39.5 | Very low | 96 Ų | 96 | 132.7 Ų | 132.7 | 67% | 0.671 | 80% | 0.798 | S | S | * | * | trans | -25.3 | 151.7 | 170 | -46.1 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 96 | S | 37.7 | Very low | 39.4 | Very low | 115 Ų | 115 | 133.8 Ų | 133.8 | 80% | 0.804 | 80% | 0.8 | S | S | * | * | 76.1 | 112.5 | 128.3 | 59.9 | 0 | 0 | 0 | 0 | 123.2 | |||||
| 97 | S | 36 | Very low | 38.9 | Very low | 133 Ų | 133 | 133.8 Ų | 133.8 | 93% | 0.93 | 80% | 0.8 | S | S | * | * | 170.9 | 136.9 | 126.9 | -173.4 | 0 | 0 | 0 | 0 | 108.8 | |||||
| 98 | G | 31.7 | Very low | 38.8 | Very low | 61 Ų | 61 | 139.7 Ų | 139.7 | 63% | 0.629 | 81% | 0.808 | S | S | * | * | cis | 176.1 | 169.7 | -3.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 99 | S | 36 | Very low | 38.6 | Very low | 128 Ų | 128 | 137.8 Ų | 137.8 | 90% | 0.895 | 81% | 0.807 | S | S | * | * | trans | 68 | 149.5 | 171.3 | -65.8 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 100 | S | 41.8 | Very low | 38.6 | Very low | 113 Ų | 113 | 136.7 Ų | 136.7 | 79% | 0.79 | 82% | 0.816 | S | S | * | * | cis | -173 | 143.8 | -11.4 | 48.1 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 101 | G | 35.1 | Very low | 38.7 | Very low | 89 Ų | 89 | 132 Ų | 132 | 92% | 0.918 | 82% | 0.815 | S | S | * | * | trans | 81.8 | 153.1 | 165.5 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 102 | G | 33.4 | Very low | 38.5 | Very low | 73 Ų | 73 | 135.4 Ų | 135.4 | 75% | 0.753 | 82% | 0.815 | S | S | * | * | cis | 165.1 | 106.8 | -4.2 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 103 | S | 37.6 | Very low | 38.4 | Very low | 127 Ų | 127 | 133.7 Ų | 133.7 | 89% | 0.888 | 82% | 0.817 | S | S | * | * | trans | 40.3 | 118.4 | 157.7 | -50.6 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 104 | H | 43.7 | Very low | 38.1 | Very low | 176 Ų | 176 | 136 Ų | 136 | 82% | 0.815 | 83% | 0.825 | S | S | * | * | trans | -83.6 | 173.7 | 143.7 | 46.5 | -124.7 | 0 | 0 | 0 | 110.1 | ||||
| 105 | P | 54.9 | Low | 38.5 | Very low | 112 Ų | 112 | 131.5 Ų | 131.5 | 73% | 0.727 | 82% | 0.824 | S | S | * | * | cis | -129.9 | -171.4 | 9.5 | 41.6 | -23.8 | 0 | 0 | 0 | 114.8 | ||||
| 106 | S | 36.5 | Very low | 38.7 | Very low | 123 Ų | 123 | 130.2 Ų | 130.2 | 86% | 0.86 | 83% | 0.826 | S | S | * | * | trans | -139 | 110.4 | 170.2 | -74.3 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 107 | S | 38.1 | Very low | 38.9 | Very low | 115 Ų | 115 | 131 Ų | 131 | 80% | 0.804 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -82.7 | 140.1 | 163.7 | -56 | 0 | 0 | 0 | 0 | 109.7 | ||
| 108 | R | 39.8 | Very low | 39 | Very low | 254 Ų | 254 | 128.2 Ų | 128.2 | 96% | 0.958 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -101.8 | 121 | 168.7 | -99.1 | -179.1 | 158.4 | -174.7 | -6.7 | 110.3 | ||
| 109 | S | 39.1 | Very low | 39.7 | Very low | 115 Ų | 115 | 131.3 Ų | 131.3 | 80% | 0.804 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -89 | 157.5 | 173.4 | -52.2 | 0 | 0 | 0 | 0 | 111.8 | ||
| 110 | S | 37.9 | Very low | 40.2 | Very low | 128 Ų | 128 | 132.7 Ų | 132.7 | 90% | 0.895 | 84% | 0.838 | S | S | * | * | trans | -141.8 | 149.6 | 138.7 | 60.8 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 111 | S | 39.8 | Very low | 40 | Very low | 108 Ų | 108 | 130.5 Ų | 130.5 | 76% | 0.755 | 83% | 0.834 | S | S | * | * | trans | -154.2 | 142.5 | -160.6 | 169.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 112 | R | 39.3 | Very low | 40.6 | Very low | 233 Ų | 233 | 132.2 Ų | 132.2 | 88% | 0.879 | 83% | 0.826 | S | S | * | * | trans | 155.4 | 146.6 | 150.4 | -86.8 | 160.2 | 179.6 | -161.6 | -2.8 | 107 | ||||
| 113 | E | 36.1 | Very low | 41.1 | Very low | 190 Ų | 190 | 134.9 Ų | 134.9 | 89% | 0.888 | 83% | 0.83 | S | S | * | * | cis | -146.1 | 155.7 | 26.8 | 55.1 | -153.8 | 61 | 0 | 0 | 113.3 | ||||
| 114 | N | 34.1 | Very low | 41.3 | Very low | 159 Ų | 159 | 136.6 Ų | 136.6 | 85% | 0.85 | 83% | 0.828 | S | S | * | * | trans | -150.4 | 143.9 | 165.2 | -177.7 | 13.5 | 0 | 0 | 0 | 108.4 | ||||
| 115 | S | 45.5 | Very low | 41.4 | Very low | 114 Ų | 114 | 132.5 Ų | 132.5 | 80% | 0.797 | 82% | 0.824 | S | S | * | * | trans | -141.5 | 122.5 | 175.2 | -72 | 0 | 0 | 0 | 0 | 112 | ||||
| 116 | G | 38.7 | Very low | 40.8 | Very low | 68 Ų | 68 | 133.3 Ų | 133.3 | 70% | 0.701 | 83% | 0.827 | S | S | * | * | trans | 90.3 | 109.7 | 139.4 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 117 | S | 41.1 | Very low | 41.2 | Very low | 133 Ų | 133 | 133.1 Ų | 133.1 | 93% | 0.93 | 82% | 0.823 | S | S | * | * | trans | 61.5 | 145.1 | 145.2 | -54.2 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 118 | G | 39.7 | Very low | 41.9 | Very low | 74 Ų | 74 | 133.8 Ų | 133.8 | 76% | 0.763 | 82% | 0.822 | S | S | * | * | cis | 133.5 | 87.2 | -0.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 119 | S | 44.6 | Very low | 42.5 | Very low | 126 Ų | 126 | 127.4 Ų | 127.4 | 88% | 0.881 | 81% | 0.813 | S | S | * | * | trans | -164.1 | 150.2 | 169.7 | 46.1 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 120 | V | 47 | Very low | 43.2 | Very low | 156 Ų | 156 | 127.3 Ų | 127.3 | 95% | 0.945 | 81% | 0.813 | S | S | * | * | trans | -93.4 | 142.4 | -175.7 | 173.1 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 121 | G | 37.4 | Very low | 44.1 | Very low | 67 Ų | 67 | 126.7 Ų | 126.7 | 69% | 0.691 | 81% | 0.805 | S | S | * | * | trans | -175.7 | 108 | 172.6 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 122 | V | 47.8 | Very low | 44.9 | Very low | 125 Ų | 125 | 127.6 Ų | 127.6 | 76% | 0.758 | 81% | 0.809 | S | S | * | * | trans | 24 | 131.7 | 147.6 | -169 | 0 | 0 | 0 | 0 | 120.3 | I124 | V122-I124 PolarHBondContact O-N 2.86Š| ||
| 123 | P | 43.8 | Very low | 45.4 | Very low | 129 Ų | 129 | 121.5 Ų | 121.5 | 84% | 0.838 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 121.3 | 168.6 | 30.9 | -33.8 | 0 | 0 | 0 | 111.8 | ||
| 124 | I | 42.9 | Very low | 46 | Very low | 164 Ų | 164 | 119.2 Ų | 119.2 | 84% | 0.841 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -88.1 | 137.3 | 171 | -64.2 | -179.6 | 0 | 0 | 0 | 109.5 | V122 | V122-I124 PolarHBondContact O-N 2.86Š|
| 125 | A | 44.8 | Very low | 46.6 | Very low | 89 Ų | 89 | 120.6 Ų | 120.6 | 74% | 0.736 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 154 | -171.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 126 | V | 43 | Very low | 47 | Very low | 130 Ų | 130 | 120.5 Ų | 120.5 | 79% | 0.788 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -72 | 134.5 | 177.1 | -171.6 | 0 | 0 | 0 | 0 | 110.4 | T128 | V126-T128 PolarHBondContact O-N 2.78Š|
| 127 | P | 44.1 | Very low | 47 | Very low | 119 Ų | 119 | 121.8 Ų | 121.8 | 77% | 0.773 | 80% | 0.8 | S | S | * | * | trans | -73.2 | 114.1 | 170.1 | -15.3 | 30.3 | 0 | 0 | 0 | 111.3 | ||||
| 128 | T | 53.6 | Low | 47.5 | Very low | 129 Ų | 129 | 121.7 Ų | 121.7 | 79% | 0.791 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 127.9 | 169.6 | -22.8 | 0 | 0 | 0 | 0 | 109.8 | V126 S130 | V126-T128 PolarHBondContact O-N 2.78Å; T128-S130 PolarHBondContact O-N 3.05Å |
| 129 | P | 52.5 | Low | 47.5 | Very low | 120 Ų | 120 | 123.3 Ų | 123.3 | 78% | 0.779 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 128.1 | 172.4 | 28.4 | -32.6 | 0 | 0 | 0 | 110.7 | ||
| 130 | S | 53.9 | Low | 47.1 | Very low | 113 Ų | 113 | 121 Ų | 121 | 79% | 0.79 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -75.4 | 143.8 | 177.7 | -58.1 | 0 | 0 | 0 | 0 | 112.2 | T128 | T128-S130 PolarHBondContact O-N 3.05Š|
| 131 | P | 55.9 | Low | 46.6 | Very low | 114 Ų | 114 | 119.3 Ų | 119.3 | 74% | 0.74 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 150.2 | 170.4 | 31 | -34.6 | 0 | 0 | 0 | 111.4 | ||
| 132 | P | 58 | Low | 46.6 | Very low | 127 Ų | 127 | 120.9 Ų | 120.9 | 83% | 0.825 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 140 | 178.3 | 28.3 | -34.1 | 0 | 0 | 0 | 112 | ||
| 133 | S | 48.5 | Very low | 45.9 | Very low | 106 Ų | 106 | 118.6 Ų | 118.6 | 74% | 0.741 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 128.6 | 179.2 | -66.2 | 0 | 0 | 0 | 0 | 112.5 | ||
| 134 | V | 49.4 | Very low | 45.8 | Very low | 142 Ų | 142 | 119 Ų | 119 | 86% | 0.861 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 124.3 | 160.2 | 171.6 | 0 | 0 | 0 | 0 | 108.4 | ||
| 135 | F | 46.3 | Very low | 46.7 | Very low | 187 Ų | 187 | 116.9 Ų | 116.9 | 82% | 0.82 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -91.4 | 138.5 | 167.8 | -95.8 | -89.2 | 0 | 0 | 0 | 110.6 | ||
| 136 | P | 53.7 | Low | 47.4 | Very low | 112 Ų | 112 | 118.4 Ų | 118.4 | 73% | 0.727 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -84.5 | 152.5 | -177.9 | 33.9 | -35.4 | 0 | 0 | 0 | 112.9 | ||
| 137 | A | 40 | Very low | 47.4 | Very low | 95 Ų | 95 | 119.7 Ų | 119.7 | 79% | 0.785 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -81 | 146.9 | 167.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 138 | P | 51.6 | Low | 47.7 | Very low | 132 Ų | 132 | 120.2 Ų | 120.2 | 86% | 0.857 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -89.8 | 142.1 | 160.8 | 33.6 | -28.8 | 0 | 0 | 0 | 111 | ||
| 139 | A | 38 | Very low | 46.9 | Very low | 107 Ų | 107 | 118 Ų | 118 | 88% | 0.884 | 80% | 0.801 | S | S | * | * | trans | -121.6 | 153.8 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 140 | G | 38 | Very low | 46 | Very low | 77 Ų | 77 | 118.5 Ų | 118.5 | 79% | 0.794 | 80% | 0.802 | S | S | * | * | trans | 117.5 | 134.9 | 171.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 141 | S | 35.8 | Very low | 45.2 | Very low | 121 Ų | 121 | 118.3 Ų | 118.3 | 85% | 0.846 | 80% | 0.801 | S | S | * | * | cis | -162.7 | 157.8 | 3.4 | -158.1 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 142 | A | 36.1 | Very low | 44.2 | Very low | 101 Ų | 101 | 117.3 Ų | 117.3 | 84% | 0.835 | 80% | 0.802 | S | S | * | * | trans | 65.6 | 126.6 | 154 | 0 | 0 | 0 | 0 | 0 | 122 | ||||
| 143 | G | 33.9 | Very low | 43.2 | Very low | 77 Ų | 77 | 117.2 Ų | 117.2 | 79% | 0.794 | 80% | 0.804 | S | S | * | * | trans | 155.4 | 88.2 | 158.1 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 144 | T | 41.8 | Very low | 42.8 | Very low | 138 Ų | 138 | 118.2 Ų | 118.2 | 85% | 0.847 | 81% | 0.806 | S | S | * | * | trans | -150.1 | 165.4 | 168.6 | 42.7 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 145 | P | 61.8 | Low | 42.8 | Very low | 118 Ų | 118 | 117.4 Ų | 117.4 | 77% | 0.766 | 80% | 0.803 | S | S | * | * | cis | -121.6 | -152 | -47.7 | 41.5 | -24.6 | 0 | 0 | 0 | 108.7 | ||||
| 146 | P | 59.8 | Low | 42.4 | Very low | 121 Ų | 121 | 114.3 Ų | 114.3 | 79% | 0.786 | 80% | 0.8 | S | S | * | * | -145.2 | -178.6 | 53.7 | 38.4 | -15.3 | 0 | 0 | 0 | 116.8 | |||||
| 147 | L | 41.9 | Very low | 42.8 | Very low | 158 Ų | 158 | 114.3 Ų | 114.3 | 83% | 0.827 | 80% | 0.8 | S | S | * | * | trans | -78.7 | 173.4 | 169.7 | -70.6 | 157.5 | 0 | 0 | 0 | 112.3 | ||||
| 148 | P | 50.8 | Low | 42.6 | Very low | 130 Ų | 130 | 118 Ų | 118 | 84% | 0.844 | 81% | 0.806 | S | S | * | * | -135.7 | -179 | 106.6 | 38.8 | -28.7 | 0 | 0 | 0 | 114.2 | |||||
| 149 | A | 36.7 | Very low | 42.1 | Very low | 82 Ų | 82 | 117.7 Ų | 117.7 | 68% | 0.678 | 80% | 0.801 | S | S | * | * | trans | -130.8 | -173.9 | -161.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 150 | T | 35.1 | Very low | 42.7 | Very low | 130 Ų | 130 | 118.2 Ų | 118.2 | 80% | 0.798 | 80% | 0.796 | S | S | * | * | trans | 112.4 | 137 | 149 | 70.4 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 151 | S | 35.4 | Very low | 42.6 | Very low | 110 Ų | 110 | 118.9 Ų | 118.9 | 77% | 0.769 | 79% | 0.793 | S | S | * | * | trans | 62.2 | 116.3 | 151.8 | -56.3 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 152 | A | 36.4 | Very low | 42.4 | Very low | 92 Ų | 92 | 119 Ų | 119 | 76% | 0.76 | 79% | 0.79 | S | S | * | * | 85 | 120.7 | 51.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 153 | S | 37.2 | Very low | 42.5 | Very low | 125 Ų | 125 | 120.6 Ų | 120.6 | 87% | 0.874 | 79% | 0.788 | S | S | * | * | trans | 178.9 | 142.1 | 140.8 | -80.3 | 0 | 0 | 0 | 0 | 113 | ||||
| 154 | V | 39.3 | Very low | 43.2 | Very low | 128 Ų | 128 | 122.3 Ų | 122.3 | 78% | 0.776 | 79% | 0.786 | S | S | * | * | trans | -119 | 146.5 | 166.2 | 179.3 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 155 | P | 49 | Very low | 42.9 | Very low | 124 Ų | 124 | 120.8 Ų | 120.8 | 81% | 0.805 | 78% | 0.78 | S | S | * | * | -143.4 | 154.8 | 124.2 | 32.3 | -15.6 | 0 | 0 | 0 | 115 | |||||
| 156 | T | 38.3 | Very low | 41.6 | Very low | 122 Ų | 122 | 120.6 Ų | 120.6 | 75% | 0.748 | 78% | 0.782 | S | S | * | * | trans | -106.4 | -166.4 | 165.4 | 48 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 157 | P | 61 | Low | 40.4 | Very low | 112 Ų | 112 | 120.9 Ų | 120.9 | 73% | 0.727 | 78% | 0.782 | S | S | * | * | -121.4 | -176.3 | -61.7 | 36 | -22.2 | 0 | 0 | 0 | 111.2 | |||||
| 158 | L | 35.8 | Very low | 40.3 | Very low | 172 Ų | 172 | 117.6 Ų | 117.6 | 90% | 0.901 | 78% | 0.778 | S | S | * | * | trans | -169.3 | 142.1 | 146.1 | -106.2 | 158.5 | 0 | 0 | 0 | 112.4 | ||||
| 159 | V | 42.2 | Very low | 40.4 | Very low | 127 Ų | 127 | 117 Ų | 117 | 77% | 0.77 | 77% | 0.773 | S | S | * | * | trans | -111.5 | 164.9 | 171.9 | -66.4 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 160 | P | 51.1 | Low | 40.3 | Very low | 118 Ų | 118 | 120.1 Ų | 120.1 | 77% | 0.766 | 78% | 0.779 | S | S | * | * | -157 | 172.8 | 87.6 | 40.3 | -20.8 | 0 | 0 | 0 | 117.7 | |||||
| 161 | A | 34.1 | Very low | 40.3 | Very low | 90 Ų | 90 | 117.7 Ų | 117.7 | 74% | 0.744 | 77% | 0.772 | S | S | * | * | trans | 68.9 | 146.2 | 147.1 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 162 | T | 32.7 | Very low | 40.2 | Very low | 125 Ų | 125 | 116.9 Ų | 116.9 | 77% | 0.767 | 77% | 0.772 | S | S | * | * | cis | -162.5 | 150.2 | -4.6 | -95.5 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 163 | V | 38.9 | Very low | 40.1 | Very low | 133 Ų | 133 | 117.5 Ų | 117.5 | 81% | 0.806 | 78% | 0.777 | S | S | * | * | trans | -100.6 | 144.3 | 163.9 | -74.3 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 164 | P | 48.5 | Very low | 39.7 | Very low | 114 Ų | 114 | 115.7 Ų | 115.7 | 74% | 0.74 | 78% | 0.778 | S | S | * | * | -146.2 | 176.4 | 105.8 | 30 | -11.2 | 0 | 0 | 0 | 112.1 | |||||
| 165 | S | 34.1 | Very low | 39.2 | Very low | 105 Ų | 105 | 113.6 Ų | 113.6 | 73% | 0.734 | 78% | 0.783 | S | S | * | * | cis | 169.9 | 134.9 | -22.3 | -81 | 0 | 0 | 0 | 0 | 105.3 | ||||
| 166 | S | 35 | Very low | 38.6 | Very low | 115 Ų | 115 | 112.2 Ų | 112.2 | 80% | 0.804 | 78% | 0.781 | S | S | * | * | trans | 57 | 134.9 | 154.4 | -153.9 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 167 | T | 35.8 | Very low | 38.4 | Very low | 126 Ų | 126 | 115.3 Ų | 115.3 | 77% | 0.773 | 79% | 0.787 | S | S | * | * | 174.4 | 123.5 | 109.2 | -66.7 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 168 | A | 38.4 | Very low | 37.1 | Very low | 90 Ų | 90 | 113.9 Ų | 113.9 | 74% | 0.744 | 78% | 0.78 | S | S | * | * | trans | -106.7 | 152.5 | 152.8 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 169 | P | 53 | Low | 37 | Very low | 116 Ų | 116 | 113.6 Ų | 113.6 | 75% | 0.753 | 78% | 0.779 | S | S | * | * | -142.1 | -162.2 | 81.1 | 42.9 | -25.5 | 0 | 0 | 0 | 111.1 | |||||
| 170 | D | 34.8 | Very low | 36.7 | Very low | 148 Ų | 148 | 111.3 Ų | 111.3 | 79% | 0.791 | 77% | 0.773 | S | S | * | * | cis | -154.1 | 178.4 | 4.8 | -156.9 | -176.9 | 0 | 0 | 0 | 111.7 | ||||
| 171 | A | 35 | Very low | 35.8 | Very low | 79 Ų | 79 | 113.6 Ų | 113.6 | 65% | 0.653 | 78% | 0.779 | S | S | * | * | trans | 33.1 | 156.1 | 142 | 0 | 0 | 0 | 0 | 0 | 123 | ||||
| 172 | A | 33.6 | Very low | 35.6 | Very low | 93 Ų | 93 | 113 Ų | 113 | 77% | 0.769 | 78% | 0.782 | S | S | * | * | cis | -174.6 | 166.5 | -23.7 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 173 | A | 33.6 | Very low | 35.6 | Very low | 105 Ų | 105 | 116.3 Ų | 116.3 | 87% | 0.868 | 79% | 0.786 | S | S | * | * | trans | 67.9 | 113 | 155.7 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 174 | G | 29.1 | Very low | 35.3 | Very low | 87 Ų | 87 | 115.6 Ų | 115.6 | 90% | 0.897 | 78% | 0.782 | S | S | * | * | 93.6 | 119.1 | 105.2 | 0 | 0 | 0 | 0 | 0 | 119.8 | |||||
| 175 | G | 29.7 | Very low | 34.9 | Very low | 85 Ų | 85 | 115.1 Ų | 115.1 | 88% | 0.876 | 78% | 0.782 | S | S | * | * | trans | 169.5 | 130 | 165.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 176 | A | 35 | Very low | 35.6 | Very low | 94 Ų | 94 | 115.8 Ų | 115.8 | 78% | 0.777 | 78% | 0.783 | S | S | * | * | trans | -130.5 | 173.2 | -171.1 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 177 | Q | 35.6 | Very low | 35.7 | Very low | 187 Ų | 187 | 116.4 Ų | 116.4 | 87% | 0.874 | 78% | 0.782 | S | S | * | * | trans | 78.7 | 155.3 | 169.2 | -52.8 | -171.5 | -16.1 | 0 | 0 | 116.7 | ||||
| 178 | S | 33 | Very low | 36.5 | Very low | 83 Ų | 83 | 115.8 Ų | 115.8 | 58% | 0.58 | 78% | 0.78 | S | S | * | * | cis | -176.5 | 167 | -32.3 | 60 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 179 | L | 34.6 | Very low | 37 | Very low | 166 Ų | 166 | 117.3 Ų | 117.3 | 87% | 0.869 | 78% | 0.783 | S | S | * | * | trans | 70.9 | 149.5 | 165.5 | -57.4 | 162.6 | 0 | 0 | 0 | 115.8 | ||||
| 180 | A | 35.3 | Very low | 36.4 | Very low | 79 Ų | 79 | 118.1 Ų | 118.1 | 65% | 0.653 | 79% | 0.786 | S | S | * | * | cis | -160.6 | 172.7 | -13.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 181 | D | 32.2 | Very low | 36.4 | Very low | 165 Ų | 165 | 119.1 Ų | 119.1 | 88% | 0.882 | 79% | 0.789 | S | S | * | * | trans | -12.1 | 146 | 168.7 | -56.7 | -90.2 | 0 | 0 | 0 | 121.5 | ||||
| 182 | G | 30.8 | Very low | 36.3 | Very low | 79 Ų | 79 | 120.3 Ų | 120.3 | 81% | 0.814 | 79% | 0.792 | S | S | * | * | trans | -179.1 | 74.8 | 172.9 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 183 | F | 31.3 | Very low | 36.3 | Very low | 193 Ų | 193 | 120.8 Ų | 120.8 | 85% | 0.846 | 79% | 0.79 | S | S | * | * | trans | -16 | 160.6 | 159.3 | -142.5 | -115.3 | 0 | 0 | 0 | 121.5 | ||||
| 184 | T | 33.2 | Very low | 36.4 | Very low | 119 Ų | 119 | 123.7 Ų | 123.7 | 73% | 0.73 | 79% | 0.791 | S | S | * | * | trans | 78.8 | 123.8 | 157.5 | 20.1 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 185 | S | 40.6 | Very low | 37.7 | Very low | 104 Ų | 104 | 124.7 Ų | 124.7 | 73% | 0.727 | 78% | 0.782 | S | S | * | * | trans | -78.8 | 156.9 | 156.9 | 174.1 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 186 | P | 47.9 | Very low | 38.5 | Very low | 118 Ų | 118 | 125.9 Ų | 125.9 | 77% | 0.766 | 77% | 0.774 | S | S | * | * | trans | -141.5 | 138.6 | 137.9 | 34.9 | -20 | 0 | 0 | 0 | 115.7 | ||||
| 187 | T | 38.2 | Very low | 38.5 | Very low | 128 Ų | 128 | 128.2 Ų | 128.2 | 79% | 0.785 | 78% | 0.779 | S | S | * | * | trans | -75.2 | 154.1 | 147.9 | -14.6 | 0 | 0 | 0 | 0 | 109 | ||||
| 188 | P | 50.8 | Low | 38.4 | Very low | 113 Ų | 113 | 123 Ų | 123 | 73% | 0.734 | 78% | 0.775 | S | S | * | * | -158.9 | -155.5 | 83.5 | 44 | -22.4 | 0 | 0 | 0 | 112.5 | |||||
| 189 | P | 50.8 | Low | 38.8 | Very low | 123 Ų | 123 | 128 Ų | 128 | 80% | 0.799 | 79% | 0.789 | S | S | * | * | cis | -124.5 | -178.8 | -23.7 | 23.5 | -0.1 | 0 | 0 | 0 | 114.6 | ||||
| 190 | V | 39.3 | Very low | 39.5 | Very low | 133 Ų | 133 | 125.7 Ų | 125.7 | 81% | 0.806 | 78% | 0.784 | S | S | * | * | trans | -107.8 | 151.3 | 171.6 | 170.6 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 191 | I | 34.7 | Very low | 39.5 | Very low | 169 Ų | 169 | 127.2 Ų | 127.2 | 87% | 0.867 | 79% | 0.785 | S | S | * | * | trans | 168.9 | 147 | 156.2 | -94.8 | 151.6 | 0 | 0 | 0 | 108.2 | ||||
| 192 | S | 32.4 | Very low | 40 | Very low | 103 Ų | 103 | 128.1 Ų | 128.1 | 72% | 0.72 | 78% | 0.784 | S | S | * | * | cis | -169.7 | -178.1 | -20.8 | -171.4 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 193 | S | 33.7 | Very low | 40.2 | Very low | 103 Ų | 103 | 132 Ų | 132 | 72% | 0.72 | 78% | 0.779 | S | S | * | * | trans | 73.1 | 88.6 | 160.3 | 62.3 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 194 | N | 36 | Very low | 40.6 | Very low | 166 Ų | 166 | 133.1 Ų | 133.1 | 89% | 0.888 | 78% | 0.779 | S | S | * | * | 49.9 | 157.4 | 114.2 | -85.1 | 28.5 | 0 | 0 | 0 | 125.1 | |||||
| 195 | P | 57.4 | Low | 40.9 | Very low | 108 Ų | 108 | 132.7 Ų | 132.7 | 70% | 0.701 | 78% | 0.781 | S | S | * | * | trans | -111.6 | -168.6 | -143.6 | 44.1 | -37.6 | 0 | 0 | 0 | 115.8 | ||||
| 196 | P | 45.4 | Very low | 40.8 | Very low | 110 Ų | 110 | 135.5 Ų | 135.5 | 71% | 0.714 | 78% | 0.784 | S | S | * | * | -147.9 | 154.2 | 102.9 | 40.5 | -25.3 | 0 | 0 | 0 | 118.7 | |||||
| 197 | T | 36.2 | Very low | 40.3 | Very low | 143 Ų | 143 | 137.1 Ų | 137.1 | 88% | 0.877 | 79% | 0.787 | S | S | * | * | trans | 54.7 | 122.6 | 144.5 | 53.4 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 198 | G | 33.6 | Very low | 40.4 | Very low | 78 Ų | 78 | 142.8 Ų | 142.8 | 80% | 0.804 | 79% | 0.794 | S | S | * | * | trans | 169.1 | 91.8 | 155.9 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 199 | H | 40.3 | Very low | 40.4 | Very low | 188 Ų | 188 | 143.6 Ų | 143.6 | 87% | 0.87 | 80% | 0.799 | S | S | * | * | trans | -92.4 | 155.2 | 164.6 | -74.4 | -75.1 | 0 | 0 | 0 | 110 | ||||
| 200 | P | 50 | Low | 39.9 | Very low | 117 Ų | 117 | 142.8 Ų | 142.8 | 76% | 0.76 | 80% | 0.803 | S | S | * | * | -147.1 | 144.7 | 95 | 37.5 | -20.4 | 0 | 0 | 0 | 117 | |||||
| 201 | V | 35.8 | Very low | 39.9 | Very low | 111 Ų | 111 | 142.5 Ų | 142.5 | 67% | 0.673 | 81% | 0.807 | S | S | * | * | trans | 35.9 | 127.4 | 156.5 | -96.1 | 0 | 0 | 0 | 0 | 123 | ||||
| 202 | Q | 40.9 | Very low | 39.9 | Very low | 184 Ų | 184 | 145.2 Ų | 145.2 | 86% | 0.86 | 81% | 0.806 | S | S | * | * | -133.4 | 146.3 | 128.4 | -78.1 | -57.1 | -59.6 | 0 | 0 | 110.1 | |||||
| 203 | F | 35.7 | Very low | 40.3 | Very low | 160 Ų | 160 | 149.4 Ų | 149.4 | 70% | 0.702 | 81% | 0.814 | S | S | * | * | trans | -95.1 | 151 | 179.3 | -123.8 | -109 | 0 | 0 | 0 | 110.1 | ||||
| 204 | Y | 40.8 | Very low | 40.9 | Very low | 218 Ų | 218 | 149.8 Ų | 149.8 | 86% | 0.855 | 81% | 0.812 | S | S | * | * | 171.5 | 153.9 | 127.6 | -84.5 | -55.6 | 0 | 0 | 0 | 111.4 | |||||
| 205 | S | 38.2 | Very low | 41.5 | Very low | 110 Ų | 110 | 147.6 Ų | 147.6 | 77% | 0.769 | 81% | 0.807 | S | S | * | * | trans | -80.6 | 149.5 | -157.3 | -58.6 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 206 | M | 38.8 | Very low | 41.2 | Very low | 162 Ų | 162 | 148.6 Ų | 148.6 | 80% | 0.798 | 81% | 0.813 | S | S | * | * | trans | -57 | 139.6 | 162.9 | -80.1 | 70.9 | 94.5 | 0 | 0 | 113.5 | ||||
| 207 | N | 36.9 | Very low | 40.9 | Very low | 153 Ų | 153 | 149.4 Ų | 149.4 | 82% | 0.818 | 82% | 0.816 | S | S | * | * | 172.8 | 111.7 | 110 | -94.2 | -17.5 | 0 | 0 | 0 | 114.1 | |||||
| 208 | R | 41.8 | Very low | 41.1 | Very low | 246 Ų | 246 | 150.6 Ų | 150.6 | 93% | 0.928 | 82% | 0.816 | S | S | * | * | trans | -170.1 | 123.7 | 138.4 | -109.9 | 174.3 | -168.6 | -124.2 | 1.9 | 110.5 | ||||
| 209 | P | 49.9 | Very low | 41.1 | Very low | 131 Ų | 131 | 150.4 Ų | 150.4 | 85% | 0.851 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -81.6 | 140.4 | 176.7 | 31.8 | -33.1 | 0 | 0 | 0 | 111.8 | ||
| 210 | A | 40.7 | Very low | 40.8 | Very low | 106 Ų | 106 | 145.2 Ų | 145.2 | 88% | 0.876 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -96.8 | 137.5 | 167.7 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||
| 211 | S | 39.1 | Very low | 40.2 | Very low | 127 Ų | 127 | 145 Ų | 145 | 89% | 0.888 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -102 | 122.2 | 176.5 | 56.4 | 0 | 0 | 0 | 0 | 111.4 | ||
| 212 | R | 34 | Very low | 40.7 | Very low | 226 Ų | 226 | 147.6 Ų | 147.6 | 85% | 0.853 | 82% | 0.821 | S | S | * | * | trans | -131.4 | 123.6 | 173.2 | -171.9 | -176.2 | -168.9 | -127.5 | 5 | 108.5 | ||||
| 213 | H | 42.1 | Very low | 41.3 | Very low | 191 Ų | 191 | 143.7 Ų | 143.7 | 88% | 0.884 | 81% | 0.812 | S | S | * | * | trans | -145.8 | 145.6 | 168.3 | -108.7 | -77.8 | 0 | 0 | 0 | 112.1 | ||||
| 214 | T | 46.3 | Very low | 41.4 | Very low | 111 Ų | 111 | 147.4 Ų | 147.4 | 68% | 0.681 | 82% | 0.823 | S | S | * | * | trans | -101.1 | 166.8 | -173.6 | 41.4 | 0 | 0 | 0 | 0 | 112 | ||||
| 215 | P | 46.7 | Very low | 41.4 | Very low | 120 Ų | 120 | 147 Ų | 147 | 78% | 0.779 | 82% | 0.82 | S | S | * | * | trans | -93.4 | 163.9 | -166.7 | 37.3 | -36.6 | 0 | 0 | 0 | 114.5 | ||||
| 216 | P | 51.2 | Low | 41.6 | Very low | 129 Ų | 129 | 151.8 Ų | 151.8 | 84% | 0.838 | 82% | 0.821 | S | S | * | * | trans | -106.3 | 166.3 | 167.5 | 38.4 | -30.9 | 0 | 0 | 0 | 113.8 | ||||
| 217 | T | 39 | Very low | 42 | Very low | 127 Ų | 127 | 148.5 Ų | 148.5 | 78% | 0.779 | 81% | 0.812 | S | S | * | * | trans | -138 | 137.1 | -172.8 | -117.4 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 218 | I | 40.9 | Very low | 42.1 | Very low | 168 Ų | 168 | 147.2 Ų | 147.2 | 86% | 0.862 | 81% | 0.811 | S | S | * | * | trans | 61.5 | 134.3 | 158.1 | -65 | 169.5 | 0 | 0 | 0 | 120.7 | ||||
| 219 | G | 34 | Very low | 42 | Very low | 73 Ų | 73 | 140.6 Ų | 140.6 | 75% | 0.753 | 80% | 0.803 | S | S | * | * | trans | 154 | 85.3 | 139.9 | 0 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 220 | G | 33.6 | Very low | 41.4 | Very low | 80 Ų | 80 | 141.9 Ų | 141.9 | 83% | 0.825 | 80% | 0.801 | S | S | * | * | trans | 78 | 155.5 | 154.6 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 221 | S | 37.2 | Very low | 41.2 | Very low | 111 Ų | 111 | 141.8 Ų | 141.8 | 78% | 0.776 | 79% | 0.79 | S | S | * | * | cis | -168.6 | 122.5 | -9.8 | 53.3 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 222 | L | 46.1 | Very low | 41.1 | Very low | 167 Ų | 167 | 141.2 Ų | 141.2 | 87% | 0.874 | 79% | 0.786 | S | S | * | * | trans | 48.3 | 169.3 | 141.6 | -61.6 | -177.5 | 0 | 0 | 0 | 122.4 | ||||
| 223 | P | 54 | Low | 41.1 | Very low | 101 Ų | 101 | 138.8 Ų | 138.8 | 66% | 0.656 | 78% | 0.784 | S | S | * | * | cis | -134.9 | 158.9 | -39.1 | 34.9 | -18.7 | 0 | 0 | 0 | 114.4 | ||||
| 224 | Y | 38.4 | Very low | 40.7 | Very low | 238 Ų | 238 | 135.6 Ų | 135.6 | 93% | 0.933 | 78% | 0.778 | S | S | * | * | trans | -130.1 | 126.7 | 152.2 | -96.6 | -91.6 | 0 | 0 | 0 | 110.8 | ||||
| 225 | R | 39.8 | Very low | 40.1 | Very low | 210 Ų | 210 | 135.6 Ų | 135.6 | 79% | 0.792 | 78% | 0.783 | S | S | * | * | trans | -79.5 | 168.8 | 165.9 | -65.9 | -168.7 | -174.8 | -88.4 | 14.4 | 108.9 | ||||
| 226 | R | 43.7 | Very low | 39.7 | Very low | 211 Ų | 211 | 137.6 Ų | 137.6 | 80% | 0.796 | 79% | 0.786 | S | S | * | * | cis | -169.6 | -173.2 | 2.7 | -127.7 | -174.2 | 177.1 | 173.2 | -1.4 | 104.9 | ||||
| 227 | P | 45.7 | Very low | 38.9 | Very low | 93 Ų | 93 | 139.4 Ų | 139.4 | 60% | 0.604 | 78% | 0.783 | S | S | * | * | cis | -127.3 | 174.6 | -35.2 | 39.3 | -25.2 | 0 | 0 | 0 | 112.8 | ||||
| 228 | P | 39.9 | Very low | 39 | Very low | 125 Ų | 125 | 140.5 Ų | 140.5 | 81% | 0.812 | 78% | 0.784 | S | S | * | * | trans | -96.8 | 149.1 | 147.9 | 35.3 | -29.3 | 0 | 0 | 0 | 111.3 | ||||
| 229 | S | 38.8 | Very low | 38.8 | Very low | 108 Ų | 108 | 140.3 Ų | 140.3 | 76% | 0.755 | 78% | 0.78 | S | S | * | * | trans | -104.4 | 119.7 | 175.8 | -63.1 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 230 | I | 39.3 | Very low | 38.9 | Very low | 158 Ų | 158 | 144.8 Ų | 144.8 | 81% | 0.81 | 78% | 0.783 | S | S | * | * | 27.5 | 139.4 | 114.1 | -90.1 | -154.5 | 0 | 0 | 0 | 117.1 | |||||
| 231 | T | 35.4 | Very low | 39 | Very low | 103 Ų | 103 | 148.6 Ų | 148.6 | 63% | 0.632 | 79% | 0.785 | S | S | * | * | cis | -170.1 | 146.4 | 3.1 | -95.1 | 0 | 0 | 0 | 0 | 110 | ||||
| 232 | S | 37 | Very low | 38.8 | Very low | 115 Ų | 115 | 146.6 Ų | 146.6 | 80% | 0.804 | 78% | 0.781 | S | S | * | * | trans | -163 | 111.5 | 134.4 | 56.4 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 233 | Q | 34.9 | Very low | 38.3 | Very low | 175 Ų | 175 | 142.1 Ų | 142.1 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | trans | -65.9 | 170.6 | 156.9 | -57.6 | 168.1 | -51.3 | 0 | 0 | 108.1 | ||||
| 234 | T | 32.9 | Very low | 38.3 | Very low | 125 Ų | 125 | 143 Ų | 143 | 77% | 0.767 | 78% | 0.781 | S | S | * | * | cis | -159.8 | 169.4 | 25.5 | -23.7 | 0 | 0 | 0 | 0 | 105.3 | ||||
| 235 | S | 33.8 | Very low | 38.1 | Very low | 110 Ų | 110 | 141.8 Ų | 141.8 | 77% | 0.769 | 78% | 0.781 | S | S | * | * | cis | -151.9 | 179.6 | 26.4 | -60.9 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 236 | L | 37.8 | Very low | 38 | Very low | 162 Ų | 162 | 142.1 Ų | 142.1 | 85% | 0.848 | 78% | 0.784 | S | S | * | * | trans | -87.1 | 154.3 | 168 | -61.7 | 148.8 | 0 | 0 | 0 | 110.9 | ||||
| 237 | Q | 34.7 | Very low | 37.3 | Very low | 167 Ų | 167 | 137.9 Ų | 137.9 | 78% | 0.78 | 78% | 0.777 | S | S | * | * | -160 | 122.3 | 126.4 | -158.2 | 70.6 | -10.9 | 0 | 0 | 110.2 | |||||
| 238 | N | 40.3 | Very low | 36.7 | Very low | 151 Ų | 151 | 141 Ų | 141 | 81% | 0.807 | 78% | 0.784 | S | S | * | * | trans | -113.6 | 126.6 | 174.6 | -155.6 | 23.2 | 0 | 0 | 0 | 107 | ||||
| 239 | Q | 37.1 | Very low | 36.9 | Very low | 164 Ų | 164 | 141.5 Ų | 141.5 | 77% | 0.766 | 78% | 0.779 | S | S | * | * | trans | -143.3 | 156.8 | 174.7 | -83.8 | -55.1 | -19.5 | 0 | 0 | 113.6 | ||||
| 240 | M | 37 | Very low | 37.4 | Very low | 166 Ų | 166 | 142 Ų | 142 | 82% | 0.818 | 78% | 0.78 | S | S | * | * | trans | -104.1 | 136.1 | -151.1 | -168.1 | 76 | 82.8 | 0 | 0 | 113 | ||||
| 241 | N | 34.5 | Very low | 37.5 | Very low | 161 Ų | 161 | 140 Ų | 140 | 86% | 0.861 | 78% | 0.775 | S | S | * | * | trans | 36.2 | 130 | 142.3 | -162.3 | 64.8 | 0 | 0 | 0 | 121.6 | ||||
| 242 | G | 33.7 | Very low | 38 | Very low | 68 Ų | 68 | 140.3 Ų | 140.3 | 70% | 0.701 | 78% | 0.781 | S | S | * | * | trans | 147.9 | 117.5 | 142.6 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 243 | G | 35 | Very low | 38.3 | Very low | 73 Ų | 73 | 143.2 Ų | 143.2 | 75% | 0.753 | 79% | 0.787 | S | S | * | * | trans | 88.5 | 143.5 | 135.4 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 244 | P | 54.7 | Low | 39.4 | Very low | 119 Ų | 119 | 139.2 Ų | 139.2 | 77% | 0.773 | 78% | 0.784 | S | S | * | * | trans | -100.9 | 146.3 | -171.9 | 37.8 | -33.1 | 0 | 0 | 0 | 114.4 | ||||
| 245 | F | 35.1 | Very low | 40.6 | Very low | 213 Ų | 213 | 138.9 Ų | 138.9 | 93% | 0.934 | 78% | 0.784 | S | S | * | * | trans | -138 | 155.9 | 161 | -77.6 | -76 | 0 | 0 | 0 | 111.7 | ||||
| 246 | Y | 36.7 | Very low | 41.7 | Very low | 218 Ų | 218 | 139.1 Ų | 139.1 | 86% | 0.855 | 78% | 0.783 | S | S | * | * | trans | -95.6 | 156.6 | -158.6 | -133.8 | -98.7 | 0 | 0 | 0 | 113.3 | ||||
| 247 | N | 29.3 | Very low | 42.5 | Very low | 122 Ų | 122 | 136.8 Ų | 136.8 | 65% | 0.652 | 78% | 0.777 | S | S | * | * | trans | 103.5 | 146.8 | 137.8 | -127.3 | -13.2 | 0 | 0 | 0 | 121.7 | ||||
| 248 | Q | 33.3 | Very low | 43.4 | Very low | 159 Ų | 159 | 134.9 Ų | 134.9 | 74% | 0.743 | 78% | 0.78 | S | S | * | * | trans | 86 | 86.9 | 170.7 | -44.5 | -55.6 | 12.1 | 0 | 0 | 120 | ||||
| 249 | N | 43 | Very low | 43.9 | Very low | 135 Ų | 135 | 133.4 Ų | 133.4 | 72% | 0.722 | 78% | 0.781 | S | S | * | * | trans | -69.2 | 158.9 | 148.8 | -117.7 | 49.1 | 0 | 0 | 0 | 109.8 | ||||
| 250 | P | 50 | Low | 44.2 | Very low | 119 Ų | 119 | 133.3 Ų | 133.3 | 77% | 0.773 | 78% | 0.784 | S | S | * | * | -146.7 | 139 | 69 | 36 | -16 | 0 | 0 | 0 | 118.5 | |||||
| 251 | V | 40.9 | Very low | 44.7 | Very low | 116 Ų | 116 | 133.2 Ų | 133.2 | 70% | 0.703 | 79% | 0.786 | S | S | * | * | trans | 48.1 | 118.7 | 131.2 | -165.3 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 252 | S | 47.1 | Very low | 45.1 | Very low | 108 Ų | 108 | 134.4 Ų | 134.4 | 76% | 0.755 | 79% | 0.786 | S | S | * | * | trans | -61.2 | 138.3 | 168.3 | -45.5 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 253 | L | 43 | Very low | 45.6 | Very low | 176 Ų | 176 | 137.9 Ų | 137.9 | 92% | 0.921 | 79% | 0.793 | S | S | * | * | trans | -142.3 | 103.2 | 153.2 | -77.9 | 178.5 | 0 | 0 | 0 | 110 | ||||
| 254 | A | 56.7 | Low | 45.9 | Very low | 92 Ų | 92 | 139.9 Ų | 139.9 | 76% | 0.76 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -100.5 | 137.8 | 163.2 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||
| 255 | P | 58.5 | Low | 45.4 | Very low | 118 Ų | 118 | 140.3 Ų | 140.3 | 77% | 0.766 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -73.4 | 147.1 | -178.4 | 30 | -34.6 | 0 | 0 | 0 | 111.8 | ||
| 256 | P | 58.4 | Low | 45.8 | Very low | 115 Ų | 115 | 138.7 Ų | 138.7 | 75% | 0.747 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 154.4 | 176.3 | 31.3 | -35.2 | 0 | 0 | 0 | 112.2 | ||
| 257 | P | 53.3 | Low | 46.8 | Very low | 112 Ų | 112 | 136.2 Ų | 136.2 | 73% | 0.727 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 155.7 | 174.1 | 31.5 | -35.5 | 0 | 0 | 0 | 111.9 | ||
| 258 | P | 53.2 | Low | 47.7 | Very low | 128 Ų | 128 | 136.5 Ų | 136.5 | 83% | 0.831 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 135.4 | 180 | 29.1 | -34.5 | 0 | 0 | 0 | 112.4 | ||
| 259 | S | 50.4 | Low | 48.8 | Very low | 120 Ų | 120 | 136.1 Ų | 136.1 | 84% | 0.839 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 135.3 | 176.3 | -56.3 | 0 | 0 | 0 | 0 | 112.2 | ||
| 260 | I | 45.3 | Very low | 49 | Very low | 162 Ų | 162 | 137.6 Ų | 137.6 | 83% | 0.831 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 131.5 | 170.4 | -156.3 | 164.4 | 0 | 0 | 0 | 109.4 | Q262 | I260-Q262 PolarHBondContact O-N 3.43Š|
| 261 | L | 47.2 | Very low | 48.7 | Very low | 163 Ų | 163 | 134.7 Ų | 134.7 | 85% | 0.853 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -70 | 124.9 | -178 | -72.2 | 169.9 | 0 | 0 | 0 | 110.6 | ||
| 262 | Q | 43.3 | Very low | 48.7 | Very low | 186 Ų | 186 | 139.1 Ų | 139.1 | 87% | 0.869 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 122.2 | 173.3 | -67.9 | 174.7 | -39.9 | 0 | 0 | 109.5 | I260 | I260-Q262 PolarHBondContact O-N 3.43Š|
| 263 | V | 43.2 | Very low | 48.5 | Very low | 141 Ų | 141 | 140.1 Ų | 140.1 | 86% | 0.855 | 81% | 0.809 | S | S | * | * | trans | -86.1 | 113.5 | 174.2 | 177.5 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 264 | T | 41.3 | Very low | 48.6 | Very low | 115 Ų | 115 | 135.7 Ų | 135.7 | 71% | 0.706 | 80% | 0.797 | S | S | * | * | trans | -97.9 | 134 | 165.8 | 45.2 | 0 | 0 | 0 | 0 | 109.8 | Q266 | T264-Q266 PolarHBondContact O-N 2.81Š| ||
| 265 | P | 43.5 | Very low | 48.2 | Very low | 129 Ų | 129 | 142.3 Ų | 142.3 | 84% | 0.838 | 80% | 0.803 | S | S | * | * | trans | -77.1 | 116 | 172.7 | 30.1 | -31.4 | 0 | 0 | 0 | 109.6 | ||||
| 266 | Q | 44.3 | Very low | 47.7 | Very low | 179 Ų | 179 | 143 Ų | 143 | 84% | 0.836 | 80% | 0.804 | S | S | * | * | trans | -110.2 | 119.7 | 171.2 | -166 | 174.2 | 102.6 | 0 | 0 | 109 | T264 | T264-Q266 PolarHBondContact O-N 2.81Š| ||
| 267 | L | 57.1 | Low | 46.7 | Very low | 166 Ų | 166 | 145.5 Ų | 145.5 | 87% | 0.869 | 81% | 0.806 | S | S | * | * | trans | -70.8 | 126.9 | 176.4 | -64 | 170.2 | 0 | 0 | 0 | 109.8 | L269 | L267-L269 PolarHBondContact O-N 2.87Š| ||
| 268 | P | 48.9 | Very low | 46.1 | Very low | 127 Ų | 127 | 149.2 Ų | 149.2 | 83% | 0.825 | 81% | 0.813 | S | S | * | * | trans | -80.4 | 107.6 | 171.8 | 30.4 | -30.7 | 0 | 0 | 0 | 110.5 | ||||
| 269 | L | 56.2 | Low | 45.3 | Very low | 152 Ų | 152 | 149.6 Ų | 149.6 | 80% | 0.796 | 81% | 0.808 | S | S | * | * | trans | -74.4 | 155.1 | 163.7 | -161.7 | 71 | 0 | 0 | 0 | 109.8 | L267 | L267-L269 PolarHBondContact O-N 2.87Š| ||
| 270 | M | 46.9 | Very low | 45 | Very low | 166 Ų | 166 | 151.2 Ų | 151.2 | 82% | 0.818 | 81% | 0.806 | S | S | * | * | trans | 72.7 | 93.2 | 173.9 | -123.9 | 75.5 | 74.3 | 0 | 0 | 116.7 | ||||
| 271 | G | 44.7 | Very low | 44.7 | Very low | 58 Ų | 58 | 148.8 Ų | 148.8 | 60% | 0.598 | 80% | 0.804 | S | S | * | * | trans | -84.5 | 138.8 | 160.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 272 | F | 40 | Very low | 44.6 | Very low | 209 Ų | 209 | 148 Ų | 148 | 92% | 0.917 | 80% | 0.8 | S | S | * | * | trans | 61.2 | 79.9 | 150.9 | -50.1 | -74.6 | 0 | 0 | 0 | 119.6 | A274 | F272-A274 PolarHBondContact O-N 3.46Š| ||
| 273 | V | 44.1 | Very low | 44.7 | Very low | 129 Ų | 129 | 145.4 Ų | 145.4 | 78% | 0.782 | 80% | 0.797 | S | S | * | * | trans | -83.5 | 99.2 | 145.3 | 179.8 | 0 | 0 | 0 | 0 | 108.4 | R275 | V273-R275 PolarHBondContact O-N 2.85Š| ||
| 274 | A | 43.4 | Very low | 45.2 | Very low | 82 Ų | 82 | 144 Ų | 144 | 68% | 0.678 | 79% | 0.791 | S | S | * | * | trans | -70.6 | 111.3 | 170.8 | 0 | 0 | 0 | 0 | 0 | 109.8 | F272 V276 | F272-A274 PolarHBondContact O-N 3.46Å; A274-V276 PolarHBondContact O-N 3.01Å | ||
| 275 | R | 50 | Low | 45.9 | Very low | 232 Ų | 232 | 144.2 Ų | 144.2 | 88% | 0.875 | 80% | 0.795 | S | S | * | * | trans | -76 | 73.4 | 168 | -77.1 | -174.7 | 172.3 | 80.5 | -1.6 | 110 | V273 Q277 | V273-R275 PolarHBondContact O-N 2.85Å; R275-Q277 PolarHBondContact O-N 2.91Å | ||
| 276 | V | 46.3 | Very low | 46.6 | Very low | 131 Ų | 131 | 143.8 Ų | 143.8 | 79% | 0.794 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 122.5 | 164.8 | 157.1 | 0 | 0 | 0 | 0 | 108.2 | A274 | A274-V276 PolarHBondContact O-N 3.01Š|
| 277 | Q | 37.4 | Very low | 47.3 | Very low | 169 Ų | 169 | 141 Ų | 141 | 79% | 0.79 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -83.3 | 121.4 | -179.8 | 178.5 | 167.6 | -12 | 0 | 0 | 109.4 | R275 N279 | R275-Q277 PolarHBondContact O-N 2.91Å; Q277-N279 PolarHBondContact O-N 2.94Å; Q277-N279 PolarHBondContact O-ND2 2.87Å |
| 278 | E | 41.3 | Very low | 47.1 | Very low | 189 Ų | 189 | 138.7 Ų | 138.7 | 88% | 0.883 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 137.5 | -178.8 | -68.7 | -154.6 | 133.9 | 0 | 0 | 112.7 | ||
| 279 | N | 36.4 | Very low | 47.2 | Very low | 136 Ų | 136 | 138.7 Ų | 138.7 | 73% | 0.727 | 78% | 0.784 | S | S | * | * | trans | -142.6 | 104.5 | 157.4 | 50.1 | 104.8 | 0 | 0 | 0 | 108.4 | Q277 | Q277-N279 PolarHBondContact O-N 2.94Å; Q277-N279 PolarHBondContact O-ND2 2.87Å | ||
| 280 | I | 44.8 | Very low | 46.8 | Very low | 155 Ų | 155 | 138.3 Ų | 138.3 | 80% | 0.795 | 79% | 0.788 | S | S | * | * | trans | 28.3 | 110.7 | 149 | 50.8 | 154.4 | 0 | 0 | 0 | 118.9 | ||||
| 281 | S | 38 | Very low | 46.8 | Very low | 111 Ų | 111 | 139.1 Ų | 139.1 | 78% | 0.776 | 79% | 0.789 | S | S | * | * | 172.9 | 127.9 | 106.9 | -73 | 0 | 0 | 0 | 0 | 114 | |||||
| 282 | D | 45.9 | Very low | 46.8 | Very low | 146 Ų | 146 | 144.9 Ų | 144.9 | 78% | 0.781 | 80% | 0.801 | S | S | * | * | trans | 55.2 | 95.3 | 136.7 | -144.2 | -92.6 | 0 | 0 | 0 | 121.4 | ||||
| 283 | T | 45.8 | Very low | 47.3 | Very low | 131 Ų | 131 | 140.2 Ų | 140.2 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | -176.9 | 153.9 | 122.1 | 19.5 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 284 | P | 53.3 | Low | 47.6 | Very low | 111 Ų | 111 | 140.1 Ų | 140.1 | 72% | 0.721 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -87.1 | 161.5 | -173.5 | 35.3 | -35.5 | 0 | 0 | 0 | 114 | ||
| 285 | P | 55.2 | Low | 47.5 | Very low | 121 Ų | 121 | 145.6 Ų | 145.6 | 79% | 0.786 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -80.8 | 144.4 | -177.2 | 32.6 | -35.4 | 0 | 0 | 0 | 113.6 | ||
| 286 | P | 58.7 | Low | 47.7 | Very low | 119 Ų | 119 | 141.3 Ų | 141.3 | 77% | 0.773 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -76.7 | 157 | 168.9 | 31.5 | -33.7 | 0 | 0 | 0 | 112.9 | ||
| 287 | P | 58.6 | Low | 48.1 | Very low | 120 Ų | 120 | 143.2 Ų | 143.2 | 78% | 0.779 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -85.1 | 162.1 | -169.1 | 34 | -37.4 | 0 | 0 | 0 | 115.5 | ||
| 288 | P | 52.9 | Low | 49 | Very low | 118 Ų | 118 | 139.7 Ų | 139.7 | 77% | 0.766 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -73.7 | 169.9 | 171.3 | 33.8 | -36.6 | 0 | 0 | 0 | 112.8 | ||
| 289 | P | 50.6 | Low | 49.9 | Very low | 127 Ų | 127 | 136.1 Ų | 136.1 | 83% | 0.825 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -85.3 | 163.1 | -144.1 | 34.3 | -37.8 | 0 | 0 | 0 | 115.6 | ||
| 290 | V | 47.5 | Very low | 50.8 | Low | 144 Ų | 144 | 134.9 Ų | 134.9 | 87% | 0.873 | 78% | 0.781 | S | S | * | * | trans | -119.8 | 138.7 | 166.8 | 177.7 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 291 | E | 46.8 | Very low | 51.4 | Low | 183 Ų | 183 | 132.9 Ų | 132.9 | 86% | 0.855 | 78% | 0.778 | S | S | * | * | trans | -72.5 | 145 | -174 | -61.7 | 169.4 | 134.5 | 0 | 0 | 113.1 | ||||
| 292 | E | 45.9 | Very low | 52.6 | Low | 179 Ų | 179 | 133 Ų | 133 | 84% | 0.836 | 78% | 0.777 | S | S | * | * | trans | 19 | 139.8 | 144.2 | -67.5 | -155.4 | 174.4 | 0 | 0 | 120.7 | ||||
| 293 | P | 50.6 | Low | 53.2 | Low | 112 Ų | 112 | 131.4 Ų | 131.4 | 73% | 0.727 | 77% | 0.774 | S | S | * | * | -151 | 153.9 | 65 | 38.2 | -17.6 | 0 | 0 | 0 | 119.7 | |||||
| 294 | V | 49.2 | Very low | 53.7 | Low | 127 Ų | 127 | 130.5 Ų | 130.5 | 77% | 0.77 | 77% | 0.771 | S | S | * | * | trans | 49.6 | 106.6 | 142.8 | -176.1 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 295 | F | 42.4 | Very low | 53.8 | Low | 197 Ų | 197 | 130.7 Ų | 130.7 | 86% | 0.864 | 77% | 0.771 | S | S | * | * | trans | -125.1 | 132.7 | 131.6 | -154.1 | -94.7 | 0 | 0 | 0 | 108.9 | E297 | F295-E297 PolarHBondContact O-N 2.73Š| ||
| 296 | D | 54.5 | Low | 53.6 | Low | 141 Ų | 141 | 132 Ų | 132 | 75% | 0.754 | 77% | 0.767 | S | S | * | * | trans | -76.2 | 98.8 | -179.7 | -172.2 | 68.2 | 0 | 0 | 0 | 109 | ||||
| 297 | E | 54.8 | Low | 52.5 | Low | 171 Ų | 171 | 133.4 Ų | 133.4 | 80% | 0.799 | 77% | 0.768 | S | S | * | * | trans | -113.2 | 129.7 | 163.5 | -169.9 | 103.7 | 100.7 | 0 | 0 | 106 | F295 | F295-E297 PolarHBondContact O-N 2.73Š| ||
| 298 | S | 56.3 | Low | 52.2 | Low | 95 Ų | 95 | 136.6 Ų | 136.6 | 66% | 0.664 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -52 | 147.6 | -165.2 | -59.6 | 0 | 0 | 0 | 0 | 113.2 | ||
| 299 | P | 58.9 | Low | 51.4 | Low | 114 Ų | 114 | 139.5 Ų | 139.5 | 74% | 0.74 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -52.9 | 138.6 | 172 | 24.5 | -34.2 | 0 | 0 | 0 | 108.8 | ||
| 300 | P | 55.6 | Low | 50.9 | Low | 110 Ų | 110 | 141.2 Ų | 141.2 | 71% | 0.714 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 148.7 | 173.3 | 24.9 | -33.9 | 0 | 0 | 0 | 108.6 | ||
| 301 | P | 57.5 | Low | 50.8 | Low | 113 Ų | 113 | 144 Ų | 144 | 73% | 0.734 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 141 | 173.6 | 24.4 | -34 | 0 | 0 | 0 | 108.2 | ||
| 302 | P | 63.4 | Low | 50.5 | Low | 115 Ų | 115 | 142.4 Ų | 142.4 | 75% | 0.747 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 141.4 | 177.7 | 23.7 | -33.7 | 0 | 0 | 0 | 108.3 | ||
| 303 | P | 58.5 | Low | 50.3 | Low | 112 Ų | 112 | 137.6 Ų | 137.6 | 73% | 0.727 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -51.1 | 144.4 | 172.9 | 24.4 | -33.6 | 0 | 0 | 0 | 108.2 | ||
| 304 | P | 57.6 | Low | 49.8 | Very low | 112 Ų | 112 | 136.8 Ų | 136.8 | 73% | 0.727 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -50.4 | 141.1 | 170.5 | 25 | -33.7 | 0 | 0 | 0 | 108 | E306 | P304-E306 PolarHBondContact O-N 2.82Š|
| 305 | P | 53.9 | Low | 49.7 | Very low | 114 Ų | 114 | 136.3 Ų | 136.3 | 74% | 0.74 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 143 | 179.5 | 23.9 | -33.9 | 0 | 0 | 0 | 109.3 | D307 | P305-D307 PolarHBondContact O-N 2.57Š|
| 306 | E | 51.8 | Low | 50 | Low | 149 Ų | 149 | 131.9 Ų | 131.9 | 70% | 0.696 | 74% | 0.742 | S | S | * | * | trans | -67.6 | 73.6 | -179.1 | -69.1 | -178.8 | 128.9 | 0 | 0 | 111.3 | P304 Y308 | P304-E306 PolarHBondContact O-N 2.82Å; E306-Y308 HydrophobicContact CB-CD2 3.75Å; E306-Y308 HydrophobicContact CB-CE2 3.72Å; E306-Y308 HydrophobicContact CG-CD2 4.3Å; E306-Y308 HydrophobicContact CG-CE2 3.75Å; E306-Y308 PolarHBondContact O-N 2.7Å; E306-Y308 WeakPolarHBondContact OE1-CE2 3.36Å; E306-Y308 PolarHBondContact OE1-OH 3.45Å | ||
| 307 | D | 36.1 | Very low | 49.6 | Very low | 149 Ų | 149 | 132.6 Ų | 132.6 | 80% | 0.797 | 74% | 0.741 | S | S | * | * | trans | -71.5 | 76 | 151.5 | -81.3 | -31.3 | 0 | 0 | 0 | 107.4 | P305 E309 | P305-D307 PolarHBondContact O-N 2.57Å; D307-E309 PolarHBondContact O-N 3.25Å | ||
| 308 | Y | 50.5 | Low | 49 | Very low | 187 Ų | 187 | 133.2 Ų | 133.2 | 73% | 0.733 | 74% | 0.737 | S | S | * | * | trans | -70.1 | 76.2 | 155.2 | -69.2 | -77.3 | 0 | 0 | 0 | 108.4 | E306 | E306-Y308 HydrophobicContact CB-CD2 3.75Å; E306-Y308 HydrophobicContact CB-CE2 3.72Å; E306-Y308 HydrophobicContact CG-CD2 4.3Å; E306-Y308 HydrophobicContact CG-CE2 3.75Å; E306-Y308 PolarHBondContact O-N 2.7Å; E306-Y308 WeakPolarHBondContact OE1-CE2 3.36Å; E306-Y308 PolarHBondContact OE1-OH 3.45Å | ||
| 309 | E | 36.8 | Very low | 48.5 | Very low | 179 Ų | 179 | 132.8 Ų | 132.8 | 84% | 0.836 | 73% | 0.734 | S | S | * | * | trans | -100.8 | 90.9 | 146 | -70.1 | -164 | 170.7 | 0 | 0 | 106.9 | D307 E311 | D307-E309 PolarHBondContact O-N 3.25Å; E309-E311 PolarHBondContact O-N 3.32Å | ||
| 310 | E | 39.8 | Very low | 48 | Very low | 162 Ų | 162 | 129.7 Ų | 129.7 | 76% | 0.757 | 71% | 0.711 | S | S | * | * | trans | -25.7 | 111 | 162 | -176.3 | 165.2 | -156.4 | 0 | 0 | 111.9 | E312 | E310-E312 HydrophobicContact CG-CB 4.08Å; E310-E312 HydrophobicContact CG-CG 4Å; E310-E312 PolarHBondContact O-N 2.94Å | ||
| 311 | E | 45.1 | Very low | 48.1 | Very low | 204 Ų | 204 | 130 Ų | 130 | 95% | 0.953 | 71% | 0.713 | S | S | * | * | trans | -68.7 | 57.9 | 159.1 | -71.1 | -171.5 | 122.3 | 0 | 0 | 109.1 | E309 | E309-E311 PolarHBondContact O-N 3.32Š| ||
| 312 | E | 40.5 | Very low | 47.9 | Very low | 149 Ų | 149 | 131.8 Ų | 131.8 | 70% | 0.696 | 71% | 0.706 | S | S | * | * | trans | -52.5 | 153.4 | 151.5 | -111.2 | -135.8 | 121.9 | 0 | 0 | 107.6 | E310 A314 | E310-E312 HydrophobicContact CG-CB 4.08Å; E310-E312 HydrophobicContact CG-CG 4Å; E310-E312 PolarHBondContact O-N 2.94Å; E312-A314 PolarHBondContact O-N 2.83Å | ||
| 313 | A | 41.6 | Very low | 47.5 | Very low | 77 Ų | 77 | 129.6 Ų | 129.6 | 64% | 0.636 | 70% | 0.698 | S | S | * | * | trans | -42.7 | 130.7 | -176.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | V315 | A313-V315 PolarHBondContact O-N 2.81Š| ||
| 314 | A | 41.3 | Very low | 47.3 | Very low | 95 Ų | 95 | 131.7 Ų | 131.7 | 79% | 0.785 | 70% | 0.698 | S | S | * | * | trans | -66 | 69.4 | 163.9 | 0 | 0 | 0 | 0 | 0 | 109.6 | E312 V316 | E312-A314 PolarHBondContact O-N 2.83Å; A314-V316 PolarHBondContact O-N 2.83Å | ||
| 315 | V | 47 | Very low | 47.9 | Very low | 118 Ų | 118 | 135.2 Ų | 135.2 | 72% | 0.715 | 71% | 0.705 | S | S | * | * | trans | -51.5 | 85.3 | 132.8 | -176.7 | 0 | 0 | 0 | 0 | 104.4 | A313 E317 | A313-V315 PolarHBondContact O-N 2.81Å; V315-E317 PolarHBondContact O-N 3Å | ||
| 316 | V | 47.8 | Very low | 49 | Very low | 104 Ų | 104 | 132.7 Ų | 132.7 | 63% | 0.63 | 69% | 0.685 | S | S | * | * | trans | -56.9 | 95.7 | 150.3 | 177.2 | 0 | 0 | 0 | 0 | 102.7 | A314 Y318 | A314-V316 PolarHBondContact O-N 2.83Å; V316-Y318 HydrophobicContact CG1-CD2 4.07Å; V316-Y318 PolarHBondContact O-N 3.18Å | ||
| 317 | E | 47.8 | Very low | 50.5 | Low | 155 Ų | 155 | 127.5 Ų | 127.5 | 72% | 0.724 | 67% | 0.665 | S | S | * | * | trans | -60.5 | 91.9 | 169.1 | -173.5 | 178.2 | 167.9 | 0 | 0 | 104.1 | V315 S319 | V315-E317 PolarHBondContact O-N 3Å; E317-S319 PolarHBondContact O-N 2.74Å; E317-S319 PolarHBondContact O-OG 2.64Å | ||
| 318 | Y | 42.2 | Very low | 52.8 | Low | 185 Ų | 185 | 127.2 Ų | 127.2 | 73% | 0.725 | 67% | 0.671 | S | S | * | * | trans | -75.9 | 76.9 | 179.7 | -147.6 | -85.7 | 0 | 0 | 0 | 104 | V316 D320 | V316-Y318 HydrophobicContact CG1-CD2 4.07Å; V316-Y318 PolarHBondContact O-N 3.18Å; Y318-D320 PolarHBondContact O-N 2.83Å | ||
| 319 | S | 44.5 | Very low | 54.5 | Low | 85 Ų | 85 | 122.3 Ų | 122.3 | 59% | 0.594 | 65% | 0.651 | S | S | * | * | trans | -61.4 | 81.7 | 171.5 | -48.6 | 0 | 0 | 0 | 0 | 106.2 | E317 P321 | E317-S319 PolarHBondContact O-N 2.74Å; E317-S319 PolarHBondContact O-OG 2.64Å; S319-P321 VanDerWaalsContact O-CD 3.28Å; S319-P321 WeakPolarHBondContact O-CD 3.03Å; S319-P321 VanDerWaalsContact O-N 3.11Å | ||
| 320 | D | 49.7 | Very low | 56.9 | Low | 50 Ų | 50 | 114.5 Ų | 114.5 | 27% | 0.267 | 62% | 0.617 | S | S | . | * | trans | -54 | 119.1 | 170.8 | 177 | -2.6 | 0 | 0 | 0 | 105 | Y318 Y322 A323 | Y318-D320 PolarHBondContact O-N 2.83Å; D320-Y322 PolarHBondContact O-N 3.35Å; D320-Y322 WeakPolarHBondContact OD1-CB 3.41Å; D320-Y322 PolarHBondContact OD1-N 3.23Å; D320-A323 HydrophobicContact CB-CB 3.95Å; D320-A323 WeakPolarHBondContact O-CA 3.2Å; D320-A323 WeakPolarHBondContact O-CB 3.3Å; D320-A323 PolarHBondContact O-N 3.31Å | ||
| 321 | P | 57.1 | Low | 59.3 | Low | 117 Ų | 117 | 108.2 Ų | 108.2 | 76% | 0.76 | 59% | 0.59 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.9 | 2.3 | 178.6 | 27.6 | -34.7 | 0 | 0 | 0 | 112.7 | S319 | S319-P321 VanDerWaalsContact O-CD 3.28Å; S319-P321 WeakPolarHBondContact O-CD 3.03Å; S319-P321 VanDerWaalsContact O-N 3.11Å |
| 322 | Y | 53.3 | Low | 61.2 | Low | 149 Ų | 149 | 110.8 Ų | 110.8 | 58% | 0.584 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108 | -2.5 | 164.8 | -79.8 | -76.3 | 0 | 0 | 0 | 115.5 | D320 E324 | D320-Y322 PolarHBondContact O-N 3.35Å; D320-Y322 WeakPolarHBondContact OD1-CB 3.41Å; D320-Y322 PolarHBondContact OD1-N 3.23Å; Y322-E324 PolarHBondContact O-N 3.49Å |
| 323 | A | 53.7 | Low | 63.5 | Low | 69 Ų | 69 | 107.5 Ų | 107.5 | 57% | 0.57 | 59% | 0.589 | S | S | * | * | trans | -76.2 | 65.5 | 160.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | D320 E325 | D320-A323 HydrophobicContact CB-CB 3.95Å; D320-A323 WeakPolarHBondContact O-CA 3.2Å; D320-A323 WeakPolarHBondContact O-CB 3.3Å; D320-A323 PolarHBondContact O-N 3.31Å; A323-E325 PolarHBondContact O-N 3.22Å | ||
| 324 | E | 55.9 | Low | 65.8 | Low | 156 Ų | 156 | 107.7 Ų | 107.7 | 73% | 0.729 | 57% | 0.574 | S | S | * | * | trans | -44.2 | 128.9 | 157.9 | -59.3 | -86.8 | 144.3 | 0 | 0 | 107.5 | Y322 D326 | Y322-E324 PolarHBondContact O-N 3.49Å; E324-D326 PolarHBondContact O-N 2.8Å | ||
| 325 | E | 68.7 | Low | 68.2 | Low | 186 Ų | 186 | 108.6 Ų | 108.6 | 87% | 0.869 | 57% | 0.565 | S | S | * | * | trans | -42.5 | 129.6 | -176.7 | -62.1 | -179.4 | 147.6 | 0 | 0 | 110.4 | A323 P327 | A323-E325 PolarHBondContact O-N 3.22Å; E325-P327 VanDerWaalsContact O-N 3.11Å | ||
| 326 | D | 77.5 | Confident | 70.3 | Confident | 62 Ų | 62 | 104.6 Ų | 104.6 | 33% | 0.332 | 54% | 0.539 | S | S | . | . | trans | -48.8 | 125.2 | -177.1 | -88.5 | -23.4 | 0 | 0 | 0 | 108.6 | E324 A330 Y334 K337 Y361 | E324-D326 PolarHBondContact O-N 2.8Å; D326-A330 HydrophobicContact CB-CB 4.05Å; D326-Y334 WeakPolarHBondContact OD2-CE1 3.49Å; D326-Y334 PolarHBondContact OD2-OH 2.81Å; D326-K337 IonicContact OD1-NZ 2.63Å; D326-K337 PolarHBondContact OD1-NZ 3.15Å; D326-Y361 PolarHBondContact OD1-OH 3.16Å | ||
| 327 | P | 84.5 | Confident | 72.4 | Confident | 40 Ų | 40 | 102.2 Ų | 102.2 | 26% | 0.26 | 52% | 0.52 | S | S | . | . | trans | -58.5 | 153.5 | -162.5 | 23 | -35 | 0 | 0 | 0 | 110.5 | E325 W329 A330 | E325-P327 VanDerWaalsContact O-N 3.11Å; P327-W329 HydrophobicContact CG-CD2 4.13Å; P327-W329 VanDerWaalsContact CG-CE2 3.47Å; P327-W329 HydrophobicContact CG-CH2 4.37Å; P327-W329 HydrophobicContact CG-CZ2 3.63Å; P327-W329 PolarHBondContact O-N 2.9Å; P327-A330 HydrophobicContact CG-CB 4.27Å; P327-A330 WeakPolarHBondContact O-CA 3.33Å; P327-A330 WeakPolarHBondContact O-CB 3.4Å; P327-A330 PolarHBondContact O-N 2.9Å | ||
| 328 | P | 84.3 | Confident | 74.7 | Confident | 142 Ų | 142 | 94.9 Ų | 94.9 | 92% | 0.922 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.1 | -10.2 | -167.2 | 24.1 | -35.9 | 0 | 0 | 0 | 115.5 | ||
| 329 | W | 85.1 | Confident | 77.2 | Confident | 85 Ų | 85 | 86.2 Ų | 86.2 | 32% | 0.322 | 45% | 0.452 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.5 | -15.6 | 171.3 | 61.9 | -105.9 | 0 | 0 | 0 | 114.1 | P327 Y361 V374 | P327-W329 HydrophobicContact CG-CD2 4.13Å; P327-W329 VanDerWaalsContact CG-CE2 3.47Å; P327-W329 HydrophobicContact CG-CH2 4.37Å; P327-W329 HydrophobicContact CG-CZ2 3.63Å; P327-W329 PolarHBondContact O-N 2.9Å; W329-Y361 AromaticContact CH2-CD2 3.98Å; W329-Y361 HydrophobicContact CH2-CD2 3.98Å; W329-Y361 AromaticContact CH2-CE2 3.58Å; W329-Y361 HydrophobicContact CH2-CE2 3.58Å; W329-Y361 AromaticContact CZ3-CD2 3.7Å; W329-Y361 HydrophobicContact CZ3-CD2 3.7Å; W329-Y361 AromaticContact CZ3-CE2 3.71Å; W329-Y361 HydrophobicContact CZ3-CE2 3.71Å; W329-V374 HydrophobicContact CE3-CG1 4.11Å; W329-V374 HydrophobicContact CZ3-CG1 4.27Å |
| 330 | A | 87.9 | Confident | 79.6 | Confident | 15 Ų | 15 | 82.1 Ų | 82.1 | 12% | 0.124 | 42% | 0.423 | C | S | . | . | S | Bend | trans | -65.9 | 139.7 | 179.3 | 0 | 0 | 0 | 0 | 0 | 109.7 | D326 P327 R332 Y361 | D326-A330 HydrophobicContact CB-CB 4.05Å; P327-A330 HydrophobicContact CG-CB 4.27Å; P327-A330 WeakPolarHBondContact O-CA 3.33Å; P327-A330 WeakPolarHBondContact O-CB 3.4Å; P327-A330 PolarHBondContact O-N 2.9Å; A330-R332 PolarHBondContact O-N 3.41Å; A330-Y361 HydrophobicContact CB-CD2 4.2Å; A330-Y361 HydrophobicContact CB-CE1 4.27Å; A330-Y361 HydrophobicContact CB-CE2 3.87Å |
| 331 | P | 88.9 | Confident | 81.7 | Confident | 29 Ų | 29 | 81.3 Ų | 81.3 | 19% | 0.188 | 42% | 0.419 | C | S | . | . | trans | -66.4 | 136.6 | 177.7 | 29 | -34.5 | 0 | 0 | 0 | 109.5 | A333 Y334 Y361 I363 V374 | P331-A333 PolarHBondContact O-N 3.08Å; P331-Y334 HydrophobicContact CG-CD1 4.43Å; P331-Y334 WeakPolarHBondContact O-CD1 3.27Å; P331-Y361 HydrophobicContact CG-CG 4.3Å; P331-I363 HydrophobicContact CB-CG2 4.11Å; P331-I363 HydrophobicContact CG-CG2 3.88Å; P331-V374 HydrophobicContact CB-CG2 4.36Å; P331-V374 HydrophobicContact CG-CB 4.14Å; P331-V374 HydrophobicContact CG-CG2 3.95Å | ||
| 332 | R | 85.8 | Confident | 83.4 | Confident | 259 Ų | 259 | 78 Ų | 78 | 98% | 0.977 | 39% | 0.391 | S | S | * | . | S | Bend | trans | -66.6 | -18.1 | 176.3 | -63.5 | -175.5 | -178.9 | -170.3 | -1.9 | 113.8 | A330 | A330-R332 PolarHBondContact O-N 3.41Š|
| 333 | A | 88.3 | Confident | 85.4 | Confident | 80 Ų | 80 | 75.2 Ų | 75.2 | 66% | 0.661 | 39% | 0.387 | S | S | * | . | S | Bend | trans | -129.7 | 119.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 108.4 | P331 | P331-A333 PolarHBondContact O-N 3.08Š|
| 334 | Y | 90.6 | Very high | 87.3 | Confident | 81 Ų | 81 | 72.6 Ų | 72.6 | 32% | 0.318 | 36% | 0.362 | S | S | . | . | trans | -140.8 | 153.1 | 173.8 | 54.9 | -94.2 | 0 | 0 | 0 | 109.3 | D326 P331 K337 Y361 V362 | D326-Y334 WeakPolarHBondContact OD2-CE1 3.49Å; D326-Y334 PolarHBondContact OD2-OH 2.81Å; P331-Y334 HydrophobicContact CG-CD1 4.43Å; P331-Y334 WeakPolarHBondContact O-CD1 3.27Å; Y334-K337 HydrophobicContact CE2-CB 4.19Å; Y334-Y361 AromaticContact CD1-CD1 3.65Å; Y334-Y361 HydrophobicContact CD1-CD1 3.65Å; Y334-Y361 HydrophobicContact CD1-CE1 4.45Å; Y334-Y361 HydrophobicContact CD1-CG 4.44Å; Y334-Y361 HydrophobicContact CD2-CD1 4.19Å; Y334-Y361 AromaticContact CE1-CD1 3.54Å; Y334-Y361 HydrophobicContact CE1-CD1 3.54Å; Y334-Y361 AromaticContact CE1-CE1 3.9Å; Y334-Y361 HydrophobicContact CE1-CE1 3.9Å; Y334-Y361 HydrophobicContact CE2-CD1 4.1Å; Y334-Y361 AromaticContact CG-CD1 3.96Å; Y334-Y361 HydrophobicContact CG-CD1 3.96Å; Y334-Y361 AromaticContact CZ-CD1 3.76Å; Y334-Y361 AromaticContact CZ-CE1 3.96Å; Y334-V362 CarbonylContact C-O 3.47Å; Y334-V362 WeakPolarHBondContact CA-O 3.47Å; Y334-V362 WeakPolarHBondContact CB-O 3.31Å | ||
| 335 | L | 91.4 | Very high | 89.2 | Confident | 114 Ų | 114 | 70.3 Ų | 70.3 | 60% | 0.597 | 36% | 0.359 | S | S | * | . | S | Bend | trans | -75.7 | -39.8 | 175.5 | -61.9 | 176 | 0 | 0 | 0 | 111.4 | V362 K365 | L335-V362 PolarHBondContact N-O 3.27Å; L335-K365 HydrophobicContact CD1-CG 4.37Å |
| 336 | E | 91.4 | Very high | 90.4 | Very high | 34 Ų | 34 | 65.8 Ų | 65.8 | 16% | 0.159 | 34% | 0.336 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -161.7 | 148.7 | -174 | -170.5 | 168.3 | -148.1 | 0 | 0 | 112.2 | V338 V362 K365 S389 | E336-V338 HydrophobicContact CB-CG1 4.45Å; E336-V338 HydrophobicContact CG-CG1 3.98Å; E336-V362 HydrophobicContact CB-CB 4.44Å; E336-V362 WeakPolarHBondContact O-CB 3.46Å; E336-V362 PolarHBondContact O-N 2.87Å; E336-K365 IonicContact OE2-NZ 2.64Å; E336-K365 PolarHBondContact OE2-NZ 3.38Å; E336-S389 VanDerWaalsContact CD-OG 3.27Å; E336-S389 WeakPolarHBondContact OE1-CB 3.26Å; E336-S389 PolarHBondContact OE1-OG 3.44Å |
| 337 | K | 92.6 | Very high | 91 | Very high | 54 Ų | 54 | 69.1 Ų | 69.1 | 24% | 0.235 | 35% | 0.354 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.2 | 122.3 | 169.7 | -159.5 | 171.4 | -177.5 | 162.1 | 0 | 108.6 | D326 Y334 I359 Y361 I390 | D326-K337 IonicContact OD1-NZ 2.63Å; D326-K337 PolarHBondContact OD1-NZ 3.15Å; Y334-K337 HydrophobicContact CE2-CB 4.19Å; K337-I359 HydrophobicContact CD-CG2 4.38Å; K337-I359 HydrophobicContact CG-CG2 3.89Å; K337-Y361 HydrophobicContact CD-CD1 4.48Å; K337-Y361 HydrophobicContact CD-CE1 3.79Å; K337-Y361 WeakPolarHBondContact CE-OH 3.12Å; K337-Y361 HydrophobicContact CG-CD1 4.21Å; K337-Y361 HydrophobicContact CG-CE1 3.95Å; K337-Y361 PolarHBondContact NZ-OH 3.36Å; K337-Y361 VanDerWaalsContact NZ-OH 3.12Å; K337-I390 HydrophobicContact CG-CD1 4.01Å; K337-I390 WeakPolarHBondContact O-CB 3.43Å; K337-I390 PolarHBondContact O-N 3.13Å |
| 338 | V | 94.6 | Very high | 91.4 | Very high | 1 Ų | 1 | 70.3 Ų | 70.3 | 1% | 0.006 | 36% | 0.355 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.7 | 151.3 | -176.7 | -56.1 | 0 | 0 | 0 | 0 | 111.6 | E336 I360 V362 F382 V387 E388 I390 | E336-V338 HydrophobicContact CB-CG1 4.45Å; E336-V338 HydrophobicContact CG-CG1 3.98Å; V338-I360 HydrophobicContact CG2-CB 3.91Å; V338-I360 WeakPolarHBondContact CG2-O 3.29Å; V338-I360 PolarHBondContact N-O 2.93Å; V338-I360 PolarHBondContact O-N 3.44Å; V338-V362 HydrophobicContact CB-CG2 4.35Å; V338-V362 HydrophobicContact CG1-CG2 3.65Å; V338-V362 HydrophobicContact CG2-CG2 3.73Å; V338-F382 HydrophobicContact CG2-CZ 4.33Å; V338-V387 HydrophobicContact CB-CB 3.96Å; V338-V387 HydrophobicContact CB-CG2 4.13Å; V338-V387 HydrophobicContact CG1-CG2 4.42Å; V338-V387 HydrophobicContact CG2-CB 3.79Å; V338-V387 HydrophobicContact CG2-CG1 3.91Å; V338-V387 HydrophobicContact CG2-CG2 3.94Å; V338-E388 CarbonylContact C-O 3.43Å; V338-E388 VanDerWaalsContact CA-O 3.27Å; V338-E388 WeakPolarHBondContact CA-O 3.14Å; V338-E388 WeakPolarHBondContact CB-O 3Å; V338-I390 WeakPolarHBondContact O-CD1 3.41Å |
| 339 | V | 95 | Very high | 91.8 | Very high | 2 Ų | 2 | 72 Ų | 72 | 1% | 0.012 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.9 | 144.5 | 170.5 | 73.5 | 0 | 0 | 0 | 0 | 109.3 | W8 I341 A358 I359 V387 E388 I390 | W8-V339 HydrophobicContact CH2-CB 3.8Å; W8-V339 HydrophobicContact CH2-CG1 3.41Å; W8-V339 VanDerWaalsContact CH2-CG1 3.41Å; W8-V339 HydrophobicContact CH2-CG2 4.25Å; W8-V339 HydrophobicContact CZ2-CB 4.5Å; W8-V339 HydrophobicContact CZ2-CG1 3.66Å; V339-I341 HydrophobicContact CG1-CG2 4.17Å; V339-A358 CarbonylContact C-O 3.55Å; V339-A358 WeakPolarHBondContact CA-O 3.21Å; V339-I359 HydrophobicContact CB-CD1 4.46Å; V339-I359 HydrophobicContact CG2-CD1 4.2Å; V339-V387 CarbonylContact O-C 3.6Å; V339-V387 WeakPolarHBondContact O-CA 3.16Å; V339-V387 WeakPolarHBondContact O-CB 3.49Å; V339-E388 HydrophobicContact CG1-CB 4.08Å; V339-E388 PolarHBondContact N-O 3.13Å; V339-E388 PolarHBondContact O-N 2.91Å; V339-I390 HydrophobicContact CB-CD1 4.08Å; V339-I390 HydrophobicContact CB-CG1 3.99Å |
| 340 | A | 95.3 | Very high | 92.3 | Very high | 0 Ų | 0 | 71.5 Ų | 71.5 | 0% | 0 | 35% | 0.354 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.7 | 128.1 | 165 | 0 | 0 | 0 | 0 | 0 | 111.1 | F354 Q355 G357 A358 Y386 | A340-F354 HydrophobicContact CB-CD2 3.38Å; A340-F354 HydrophobicContact CB-CE2 3.51Å; A340-F354 HydrophobicContact CB-CG 4.41Å; A340-Q355 WeakPolarHBondContact CB-O 3.08Å; A340-G357 PolarHBondContact O-N 3.09Å; A340-A358 HydrophobicContact CB-CB 4.16Å; A340-A358 PolarHBondContact N-O 2.82Å; A340-Y386 CarbonylContact C-O 3.55Å; A340-Y386 WeakPolarHBondContact CA-O 3.28Å |
| 341 | I | 94.6 | Very high | 92.7 | Very high | 33 Ų | 33 | 71 Ų | 71 | 17% | 0.169 | 35% | 0.35 | C | S | . | . | S | Bend | trans | -100.8 | -5.2 | 172.2 | 55.2 | 159.3 | 0 | 0 | 0 | 113.3 | V339 Y386 E388 | V339-I341 HydrophobicContact CG1-CG2 4.17Å; I341-Y386 WeakPolarHBondContact CG1-O 3.07Å; I341-Y386 PolarHBondContact N-O 3.13Å; I341-E388 HydrophobicContact CD1-CG 4.01Å; I341-E388 HydrophobicContact CG1-CG 4.4Å; I341-E388 HydrophobicContact CG2-CB 4Å; I341-E388 HydrophobicContact CG2-CG 3.69Å |
| 342 | Y | 92.8 | Very high | 93.1 | Very high | 46 Ų | 46 | 69.9 Ų | 69.9 | 18% | 0.18 | 34% | 0.342 | C | S | . | . | S | Bend | trans | -145.8 | 154.8 | 171.7 | -57.7 | -75.4 | 0 | 0 | 0 | 110.6 | P34 F354 | P34-Y342 HydrophobicContact CB-CE2 4.48Å; P34-Y342 VanDerWaalsContact CD-CD2 3.49Å; P34-Y342 HydrophobicContact CG-CD2 3.58Å; P34-Y342 HydrophobicContact CG-CE2 3.57Å; P34-Y342 HydrophobicContact CG-CG 4.37Å; Y342-F354 WeakPolarHBondContact O-CE2 3.44Å |
| 343 | D | 93.9 | Very high | 93.6 | Very high | 91 Ų | 91 | 59.9 Ų | 59.9 | 49% | 0.487 | 31% | 0.312 | S | S | . | . | trans | -63.1 | 135.4 | 168 | -68.1 | -21.4 | 0 | 0 | 0 | 111.6 | Q355 E356 | D343-Q355 WeakPolarHBondContact OD1-CA 3.35Å; D343-E356 PolarHBondContact OD1-N 2.95Å | ||
| 344 | Y | 95.2 | Very high | 94 | Very high | 14 Ų | 14 | 56.6 Ų | 56.6 | 6% | 0.055 | 28% | 0.283 | C | S | . | . | B | Isolated β-bridge | trans | -126.5 | 127.3 | 171.1 | -170.7 | -101.1 | 0 | 0 | 0 | 111.5 | E351 L352 S353 F354 W370 P383 Y386 | Y344-E351 PolarHBondContact OH-OE2 3.03Å; Y344-E351 VanDerWaalsContact OH-OE2 3.07Å; Y344-L352 WeakPolarHBondContact CD1-O 3.18Å; Y344-S353 CarbonylContact O-C 3.58Å; Y344-S353 VanDerWaalsContact O-CA 3.29Å; Y344-S353 WeakPolarHBondContact O-CA 3.24Å; Y344-F354 HydrophobicContact CD1-CE1 4.27Å; Y344-F354 HydrophobicContact CG-CE1 4.38Å; Y344-F354 HydrophobicContact CG-CZ 4.24Å; Y344-F354 PolarHBondContact N-O 2.88Å; Y344-F354 PolarHBondContact O-N 3.1Å; Y344-W370 WeakPolarHBondContact OH-CH2 3.33Å; Y344-P383 HydrophobicContact CD2-CG 3.56Å; Y344-P383 HydrophobicContact CE2-CG 3.51Å; Y344-P383 HydrophobicContact CG-CG 4.19Å; Y344-Y386 AromaticContact CD2-CD1 3.98Å; Y344-Y386 HydrophobicContact CD2-CD1 3.98Å; Y344-Y386 AromaticContact CD2-CE1 3.93Å; Y344-Y386 HydrophobicContact CD2-CE1 3.93Å; Y344-Y386 HydrophobicContact CD2-CG 4.47Å; Y344-Y386 HydrophobicContact CG-CD1 4.47Å |
| 345 | T | 95.1 | Very high | 94.2 | Very high | 108 Ų | 108 | 59.7 Ų | 59.7 | 66% | 0.663 | 30% | 0.3 | S | S | * | . | trans | -112.5 | 126.2 | 172.8 | -50.6 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 346 | K | 92.7 | Very high | 94.2 | Very high | 92 Ų | 92 | 58.5 Ų | 58.5 | 40% | 0.4 | 29% | 0.291 | S | S | . | . | trans | -61.5 | 137.2 | 178.2 | 74.1 | -176.5 | -161.4 | 164.2 | 0 | 112.7 | K348 E349 E351 S353 | K346-K348 VanDerWaalsContact CD-O 3.23Å; K346-K348 WeakPolarHBondContact CD-O 3.12Å; K346-K348 WeakPolarHBondContact CG-O 3.47Å; K346-E349 PolarHBondContact NZ-O 3.11Å; K346-E351 HydrophobicContact CB-CB 3.58Å; K346-E351 WeakPolarHBondContact CD-O 3.2Å; K346-S353 WeakPolarHBondContact CB-OG 3.5Å; K346-S353 VanDerWaalsContact CG-OG 3.3Å; K346-S353 WeakPolarHBondContact CG-OG 3.43Å; K346-S353 PolarHBondContact N-OG 2.8Å | ||
| 347 | D | 91.2 | Very high | 94.2 | Very high | 132 Ų | 132 | 57.5 Ų | 57.5 | 71% | 0.706 | 29% | 0.29 | S | S | * | . | S | Bend | trans | -89.1 | -35.7 | 169.5 | -169.2 | -110.1 | 0 | 0 | 0 | 110.3 | E351 | D347-E351 PolarHBondContact N-OE2 2.83Š|
| 348 | K | 92.8 | Very high | 94.2 | Very high | 65 Ų | 65 | 55.9 Ų | 55.9 | 28% | 0.283 | 29% | 0.287 | S | S | . | . | S | Bend | trans | -112.3 | 172.5 | -179.3 | -53 | -165.8 | -138.8 | 80.6 | 0 | 114.1 | K346 D350 E351 | K346-K348 VanDerWaalsContact CD-O 3.23Å; K346-K348 WeakPolarHBondContact CD-O 3.12Å; K346-K348 WeakPolarHBondContact CG-O 3.47Å; K348-D350 WeakPolarHBondContact CB-OD1 3.46Å; K348-E351 HydrophobicContact CB-CG 4.29Å; K348-E351 PolarHBondContact N-OE2 2.84Å; K348-E351 VanDerWaalsContact N-OE2 3.16Å; K348-E351 IonicContact NZ-OE1 2.68Å; K348-E351 PolarHBondContact NZ-OE1 3.07Å |
| 349 | E | 93.3 | Very high | 94.2 | Very high | 176 Ų | 176 | 58.2 Ų | 58.2 | 82% | 0.822 | 30% | 0.299 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.2 | -35.1 | 179.3 | 62.5 | -175.5 | 179.4 | 0 | 0 | 113.4 | K346 E351 | K346-E349 PolarHBondContact NZ-O 3.11Å; E349-E351 VanDerWaalsContact C-N 3.28Å; E349-E351 PolarHBondContact O-N 2.93Å |
| 350 | D | 95.4 | Very high | 94.3 | Very high | 75 Ų | 75 | 58.1 Ų | 58.1 | 40% | 0.401 | 30% | 0.298 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.3 | -6.6 | 179.6 | 57.6 | -51.3 | 0 | 0 | 0 | 114.4 | K348 G380 L381 | K348-D350 WeakPolarHBondContact CB-OD1 3.46Å; D350-G380 CarbonylContact O-C 3.55Å; D350-G380 VanDerWaalsContact O-CA 3.28Å; D350-G380 WeakPolarHBondContact O-CA 3.34Å; D350-L381 PolarHBondContact O-N 3.19Å |
| 351 | E | 96.4 | Very high | 94.3 | Very high | 6 Ų | 6 | 58.4 Ų | 58.4 | 3% | 0.028 | 30% | 0.299 | C | S | . | . | B | Isolated β-bridge | trans | -93.2 | 150.9 | -178.1 | -76.7 | 169.8 | -163.9 | 0 | 0 | 112.8 | Y344 K346 D347 K348 E349 W370 L381 | Y344-E351 PolarHBondContact OH-OE2 3.03Å; Y344-E351 VanDerWaalsContact OH-OE2 3.07Å; K346-E351 HydrophobicContact CB-CB 3.58Å; K346-E351 WeakPolarHBondContact CD-O 3.2Å; D347-E351 PolarHBondContact N-OE2 2.83Å; K348-E351 HydrophobicContact CB-CG 4.29Å; K348-E351 PolarHBondContact N-OE2 2.84Å; K348-E351 VanDerWaalsContact N-OE2 3.16Å; K348-E351 IonicContact NZ-OE1 2.68Å; K348-E351 PolarHBondContact NZ-OE1 3.07Å; E349-E351 VanDerWaalsContact C-N 3.28Å; E349-E351 PolarHBondContact O-N 2.93Å; E351-W370 HydrophobicContact CG-CH2 4.34Å; E351-W370 HydrophobicContact CG-CZ3 3.87Å; E351-W370 WeakPolarHBondContact OE1-CH2 3.39Å; E351-L381 CarbonylContact C-O 3.54Å; E351-L381 WeakPolarHBondContact CA-O 3.23Å; E351-L381 HydrophobicContact CG-CB 4.36Å |
| 352 | L | 96.4 | Very high | 94.4 | Very high | 4 Ų | 4 | 56.9 Ų | 56.9 | 2% | 0.021 | 29% | 0.291 | C | S | . | . | trans | -102.6 | 112.2 | -177.2 | -177.1 | 67.6 | 0 | 0 | 0 | 111 | Y344 F354 I360 M375 V378 L381 F382 | Y344-L352 WeakPolarHBondContact CD1-O 3.18Å; L352-F354 HydrophobicContact CG-CD1 4.38Å; L352-F354 VanDerWaalsContact O-CD1 3.31Å; L352-F354 WeakPolarHBondContact O-CD1 3.45Å; L352-I360 HydrophobicContact CD2-CD1 4.44Å; L352-I360 HydrophobicContact CD2-CG2 3.9Å; L352-M375 HydrophobicContact CD1-CB 4.43Å; L352-M375 HydrophobicContact CD1-CE 4.4Å; L352-M375 HydrophobicContact CD2-CB 4.04Å; L352-V378 HydrophobicContact CD1-CB 4.11Å; L352-V378 HydrophobicContact CD1-CG1 3.89Å; L352-L381 PolarHBondContact N-O 3.08Å; L352-F382 HydrophobicContact CB-CD1 4.48Å; L352-F382 HydrophobicContact CD2-CD1 4.12Å; L352-F382 HydrophobicContact CD2-CE1 4.46Å | ||
| 353 | S | 96.1 | Very high | 94.6 | Very high | 49 Ų | 49 | 57.3 Ų | 57.3 | 34% | 0.343 | 30% | 0.296 | S | S | . | . | trans | -79.8 | 140.9 | 172.2 | -60.9 | 0 | 0 | 0 | 0 | 112.1 | Y344 K346 M375 | Y344-S353 CarbonylContact O-C 3.58Å; Y344-S353 VanDerWaalsContact O-CA 3.29Å; Y344-S353 WeakPolarHBondContact O-CA 3.24Å; K346-S353 WeakPolarHBondContact CB-OG 3.5Å; K346-S353 VanDerWaalsContact CG-OG 3.3Å; K346-S353 WeakPolarHBondContact CG-OG 3.43Å; K346-S353 PolarHBondContact N-OG 2.8Å; S353-M375 WeakPolarHBondContact O-CE 3.49Å | ||
| 354 | F | 96.2 | Very high | 94.6 | Very high | 12 Ų | 12 | 57.9 Ų | 57.9 | 5% | 0.053 | 29% | 0.294 | C | S | . | . | B | Isolated β-bridge | trans | -156.2 | 170 | 176.2 | 52.9 | -99.7 | 0 | 0 | 0 | 112.3 | A340 Y342 Y344 L352 A358 I360 M375 F382 V387 | A340-F354 HydrophobicContact CB-CD2 3.38Å; A340-F354 HydrophobicContact CB-CE2 3.51Å; A340-F354 HydrophobicContact CB-CG 4.41Å; Y342-F354 WeakPolarHBondContact O-CE2 3.44Å; Y344-F354 HydrophobicContact CD1-CE1 4.27Å; Y344-F354 HydrophobicContact CG-CE1 4.38Å; Y344-F354 HydrophobicContact CG-CZ 4.24Å; Y344-F354 PolarHBondContact N-O 2.88Å; Y344-F354 PolarHBondContact O-N 3.1Å; L352-F354 HydrophobicContact CG-CD1 4.38Å; L352-F354 VanDerWaalsContact O-CD1 3.31Å; L352-F354 WeakPolarHBondContact O-CD1 3.45Å; F354-A358 HydrophobicContact CB-CB 3.94Å; F354-I360 HydrophobicContact CB-CD1 4.43Å; F354-I360 HydrophobicContact CD1-CD1 3.43Å; F354-I360 VanDerWaalsContact CD1-CD1 3.43Å; F354-I360 HydrophobicContact CD2-CD1 4.24Å; F354-I360 HydrophobicContact CE1-CD1 3.53Å; F354-I360 HydrophobicContact CE2-CD1 4.33Å; F354-I360 HydrophobicContact CG-CD1 3.79Å; F354-I360 HydrophobicContact CZ-CD1 3.99Å; F354-M375 HydrophobicContact CB-CE 3.8Å; F354-M375 HydrophobicContact CB-SD 3.67Å; F354-F382 HydrophobicContact CE1-CB 3.56Å; F354-F382 AromaticContact CE1-CD2 3.97Å; F354-F382 HydrophobicContact CE1-CD2 3.97Å; F354-F382 AromaticContact CE1-CG 3.82Å; F354-F382 HydrophobicContact CE1-CG 3.82Å; F354-F382 HydrophobicContact CZ-CB 4.2Å; F354-F382 HydrophobicContact CZ-CD2 4.12Å; F354-F382 HydrophobicContact CZ-CG 4.39Å; F354-V387 HydrophobicContact CZ-CG1 4.28Å |
| 355 | Q | 96.1 | Very high | 94.7 | Very high | 146 Ų | 146 | 61.1 Ų | 61.1 | 68% | 0.682 | 31% | 0.309 | S | S | * | . | trans | -107.7 | 159.6 | 176.3 | -65.8 | -178.1 | -49 | 0 | 0 | 111.3 | A340 D343 G357 A358 | A340-Q355 WeakPolarHBondContact CB-O 3.08Å; D343-Q355 WeakPolarHBondContact OD1-CA 3.35Å; Q355-G357 PolarHBondContact O-N 2.82Å; Q355-A358 WeakPolarHBondContact O-CB 2.92Å; Q355-A358 PolarHBondContact O-N 2.83Å | ||
| 356 | E | 91.8 | Very high | 94.7 | Very high | 88 Ų | 88 | 57.9 Ų | 57.9 | 41% | 0.411 | 29% | 0.288 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -50.6 | 134.1 | 167.6 | -174.1 | -174 | 150.7 | 0 | 0 | 110.7 | D343 A358 | D343-E356 PolarHBondContact OD1-N 2.95Å; E356-A358 VanDerWaalsContact C-N 3.35Å |
| 357 | G | 89.9 | Confident | 94.6 | Very high | 13 Ų | 13 | 62.1 Ų | 62.1 | 13% | 0.134 | 31% | 0.314 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 84.6 | -4.4 | -175.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | A340 Q355 | A340-G357 PolarHBondContact O-N 3.09Å; Q355-G357 PolarHBondContact O-N 2.82Å |
| 358 | A | 93.8 | Very high | 94.6 | Very high | 20 Ų | 20 | 58.5 Ų | 58.5 | 17% | 0.165 | 30% | 0.295 | C | S | . | . | trans | -65.7 | 143.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | V339 A340 F354 Q355 E356 M375 | V339-A358 CarbonylContact C-O 3.55Å; V339-A358 WeakPolarHBondContact CA-O 3.21Å; A340-A358 HydrophobicContact CB-CB 4.16Å; A340-A358 PolarHBondContact N-O 2.82Å; F354-A358 HydrophobicContact CB-CB 3.94Å; Q355-A358 WeakPolarHBondContact O-CB 2.92Å; Q355-A358 PolarHBondContact O-N 2.83Å; E356-A358 VanDerWaalsContact C-N 3.35Å; A358-M375 HydrophobicContact CB-SD 3.74Å | ||
| 359 | I | 94.6 | Very high | 94.7 | Very high | 50 Ų | 50 | 56.8 Ų | 56.8 | 26% | 0.256 | 30% | 0.296 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.1 | 126.8 | 177.7 | -52.2 | -62.7 | 0 | 0 | 0 | 109 | K337 V339 Y361 I390 | K337-I359 HydrophobicContact CD-CG2 4.38Å; K337-I359 HydrophobicContact CG-CG2 3.89Å; V339-I359 HydrophobicContact CB-CD1 4.46Å; V339-I359 HydrophobicContact CG2-CD1 4.2Å; I359-Y361 HydrophobicContact CG2-CE2 4.47Å; I359-I390 HydrophobicContact CD1-CD1 3.65Å; I359-I390 HydrophobicContact CG2-CD1 4.17Å |
| 360 | I | 96 | Very high | 94.9 | Very high | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 26% | 0.257 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127 | 135.7 | -177.3 | -46.2 | 175.7 | 0 | 0 | 0 | 109 | V338 L352 F354 M375 F382 V387 | V338-I360 HydrophobicContact CG2-CB 3.91Å; V338-I360 WeakPolarHBondContact CG2-O 3.29Å; V338-I360 PolarHBondContact N-O 2.93Å; V338-I360 PolarHBondContact O-N 3.44Å; L352-I360 HydrophobicContact CD2-CD1 4.44Å; L352-I360 HydrophobicContact CD2-CG2 3.9Å; F354-I360 HydrophobicContact CB-CD1 4.43Å; F354-I360 HydrophobicContact CD1-CD1 3.43Å; F354-I360 VanDerWaalsContact CD1-CD1 3.43Å; F354-I360 HydrophobicContact CD2-CD1 4.24Å; F354-I360 HydrophobicContact CE1-CD1 3.53Å; F354-I360 HydrophobicContact CE2-CD1 4.33Å; F354-I360 HydrophobicContact CG-CD1 3.79Å; F354-I360 HydrophobicContact CZ-CD1 3.99Å; I360-M375 HydrophobicContact CG1-CB 4.34Å; I360-M375 HydrophobicContact CG2-CB 4.49Å; I360-F382 HydrophobicContact CB-CZ 4.39Å; I360-F382 HydrophobicContact CD1-CE1 4.48Å; I360-F382 HydrophobicContact CD1-CE2 4.31Å; I360-F382 HydrophobicContact CD1-CZ 4.26Å; I360-F382 HydrophobicContact CG2-CD1 4.49Å; I360-F382 HydrophobicContact CG2-CE1 3.64Å; I360-F382 HydrophobicContact CG2-CZ 3.8Å; I360-V387 HydrophobicContact CD1-CG1 4.2Å |
| 361 | Y | 95.8 | Very high | 95 | Very high | 7 Ų | 7 | 47.6 Ų | 47.6 | 3% | 0.027 | 25% | 0.248 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -95.7 | 108.2 | 174.9 | -61.2 | -93.4 | 0 | 0 | 0 | 108.5 | D326 W329 A330 P331 Y334 K337 I359 I363 G373 V374 | D326-Y361 PolarHBondContact OD1-OH 3.16Å; W329-Y361 AromaticContact CH2-CD2 3.98Å; W329-Y361 HydrophobicContact CH2-CD2 3.98Å; W329-Y361 AromaticContact CH2-CE2 3.58Å; W329-Y361 HydrophobicContact CH2-CE2 3.58Å; W329-Y361 AromaticContact CZ3-CD2 3.7Å; W329-Y361 HydrophobicContact CZ3-CD2 3.7Å; W329-Y361 AromaticContact CZ3-CE2 3.71Å; W329-Y361 HydrophobicContact CZ3-CE2 3.71Å; A330-Y361 HydrophobicContact CB-CD2 4.2Å; A330-Y361 HydrophobicContact CB-CE1 4.27Å; A330-Y361 HydrophobicContact CB-CE2 3.87Å; P331-Y361 HydrophobicContact CG-CG 4.3Å; Y334-Y361 AromaticContact CD1-CD1 3.65Å; Y334-Y361 HydrophobicContact CD1-CD1 3.65Å; Y334-Y361 HydrophobicContact CD1-CE1 4.45Å; Y334-Y361 HydrophobicContact CD1-CG 4.44Å; Y334-Y361 HydrophobicContact CD2-CD1 4.19Å; Y334-Y361 AromaticContact CE1-CD1 3.54Å; Y334-Y361 HydrophobicContact CE1-CD1 3.54Å; Y334-Y361 AromaticContact CE1-CE1 3.9Å; Y334-Y361 HydrophobicContact CE1-CE1 3.9Å; Y334-Y361 HydrophobicContact CE2-CD1 4.1Å; Y334-Y361 AromaticContact CG-CD1 3.96Å; Y334-Y361 HydrophobicContact CG-CD1 3.96Å; Y334-Y361 AromaticContact CZ-CD1 3.76Å; Y334-Y361 AromaticContact CZ-CE1 3.96Å; K337-Y361 HydrophobicContact CD-CD1 4.48Å; K337-Y361 HydrophobicContact CD-CE1 3.79Å; K337-Y361 WeakPolarHBondContact CE-OH 3.12Å; K337-Y361 HydrophobicContact CG-CD1 4.21Å; K337-Y361 HydrophobicContact CG-CE1 3.95Å; K337-Y361 PolarHBondContact NZ-OH 3.36Å; K337-Y361 VanDerWaalsContact NZ-OH 3.12Å; I359-Y361 HydrophobicContact CG2-CE2 4.47Å; Y361-I363 PolarHBondContact O-N 3.21Å; Y361-G373 CarbonylContact O-C 3.45Å; Y361-G373 WeakPolarHBondContact O-CA 3.3Å; Y361-V374 PolarHBondContact N-O 3.24Å; Y361-V374 PolarHBondContact O-N 3.27Å |
| 362 | V | 96.8 | Very high | 95 | Very high | 0 Ų | 0 | 50.2 Ų | 50.2 | 0% | 0 | 26% | 0.261 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.6 | 116.2 | -179.3 | -178.9 | 0 | 0 | 0 | 0 | 108.8 | Y334 L335 E336 V338 K364 K365 Y371 F382 | Y334-V362 CarbonylContact C-O 3.47Å; Y334-V362 WeakPolarHBondContact CA-O 3.47Å; Y334-V362 WeakPolarHBondContact CB-O 3.31Å; L335-V362 PolarHBondContact N-O 3.27Å; E336-V362 HydrophobicContact CB-CB 4.44Å; E336-V362 WeakPolarHBondContact O-CB 3.46Å; E336-V362 PolarHBondContact O-N 2.87Å; V338-V362 HydrophobicContact CB-CG2 4.35Å; V338-V362 HydrophobicContact CG1-CG2 3.65Å; V338-V362 HydrophobicContact CG2-CG2 3.73Å; V362-K364 WeakPolarHBondContact CG1-O 3.47Å; V362-K365 HydrophobicContact CG1-CG 3.76Å; V362-Y371 HydrophobicContact CG1-CG 4.49Å; V362-Y371 HydrophobicContact CG2-CD2 4.38Å; V362-F382 HydrophobicContact CG2-CZ 4.12Å |
| 363 | I | 96.1 | Very high | 95 | Very high | 56 Ų | 56 | 50 Ų | 50 | 29% | 0.287 | 26% | 0.26 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.8 | -22.1 | 175.1 | 62.5 | 175.5 | 0 | 0 | 0 | 112.1 | P331 Y361 E372 V374 T379 | P331-I363 HydrophobicContact CB-CG2 4.11Å; P331-I363 HydrophobicContact CG-CG2 3.88Å; Y361-I363 PolarHBondContact O-N 3.21Å; I363-E372 HydrophobicContact CD1-CG 4.06Å; I363-E372 HydrophobicContact CG1-CB 4.05Å; I363-E372 HydrophobicContact CG1-CG 4.07Å; I363-E372 WeakPolarHBondContact CG1-O 3.32Å; I363-E372 PolarHBondContact N-O 3.36Å; I363-V374 HydrophobicContact CD1-CG2 4.42Å; I363-V374 HydrophobicContact CG2-CG2 4.08Å; I363-T379 HydrophobicContact CD1-CG2 3.8Å |
| 364 | K | 96 | Very high | 95.1 | Very high | 102 Ų | 102 | 48.2 Ų | 48.2 | 44% | 0.443 | 25% | 0.246 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -153.2 | 147.2 | 178.6 | -165.8 | -176.7 | 173.5 | -161.8 | 0 | 111.6 | V362 N366 Y371 E372 | V362-K364 WeakPolarHBondContact CG1-O 3.47Å; K364-N366 WeakPolarHBondContact CE-OD1 3.37Å; K364-N366 PolarHBondContact NZ-OD1 3.16Å; K364-Y371 CarbonylContact O-C 3.46Å; K364-Y371 WeakPolarHBondContact O-CA 3.42Å; K364-E372 HydrophobicContact CB-CB 3.81Å; K364-E372 PolarHBondContact N-O 2.59Å; K364-E372 VanDerWaalsContact N-O 3.11Å; K364-E372 PolarHBondContact O-N 2.86Å |
| 365 | K | 96 | Very high | 95 | Very high | 83 Ų | 83 | 48.7 Ų | 48.7 | 36% | 0.361 | 25% | 0.249 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -118.2 | 127 | 167.1 | -60 | -172.9 | 175.9 | -178.2 | 0 | 108.5 | L335 E336 V362 Y371 | L335-K365 HydrophobicContact CD1-CG 4.37Å; E336-K365 IonicContact OE2-NZ 2.64Å; E336-K365 PolarHBondContact OE2-NZ 3.38Å; V362-K365 HydrophobicContact CG1-CG 3.76Å; K365-Y371 HydrophobicContact CB-CD1 3.69Å; K365-Y371 HydrophobicContact CB-CE1 3.77Å; K365-Y371 HydrophobicContact CD-CD1 4.16Å; K365-Y371 HydrophobicContact CD-CE1 3.74Å; K365-Y371 HydrophobicContact CD-CE2 4.21Å; K365-Y371 HydrophobicContact CG-CD1 3.57Å; K365-Y371 HydrophobicContact CG-CD2 4.41Å; K365-Y371 HydrophobicContact CG-CE1 3.66Å; K365-Y371 HydrophobicContact CG-CE2 4.47Å; K365-Y371 HydrophobicContact CG-CG 3.99Å |
| 366 | N | 94.8 | Very high | 94.7 | Very high | 40 Ų | 40 | 47.1 Ų | 47.1 | 21% | 0.214 | 25% | 0.245 | C | C | . | . | trans | -96.4 | 151.9 | 174.7 | -59.3 | -23.9 | 0 | 0 | 0 | 110.2 | K364 D368 G369 W370 | K364-N366 WeakPolarHBondContact CE-OD1 3.37Å; K364-N366 PolarHBondContact NZ-OD1 3.16Å; N366-D368 WeakPolarHBondContact CB-OD1 3.41Å; N366-D368 PolarHBondContact O-N 2.76Å; N366-D368 VanDerWaalsContact O-N 3.16Å; N366-G369 PolarHBondContact O-N 2.96Å; N366-W370 VanDerWaalsContact CB-O 3.27Å; N366-W370 WeakPolarHBondContact CB-O 3.36Å; N366-W370 PolarHBondContact N-O 2.68Å | ||
| 367 | D | 92.1 | Very high | 94.7 | Very high | 180 Ų | 180 | 45.1 Ų | 45.1 | 96% | 0.963 | 25% | 0.248 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -69 | -10.6 | -178.1 | -53.9 | -53.7 | 0 | 0 | 0 | 114.2 | G369 | D367-G369 VanDerWaalsContact C-N 3.3Š|
| 368 | D | 91.1 | Very high | 95 | Very high | 56 Ų | 56 | 48.6 Ų | 48.6 | 30% | 0.299 | 27% | 0.267 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.6 | 0.3 | 176.3 | 63 | 2.9 | 0 | 0 | 0 | 113.7 | S40 N366 W370 | S40-D368 VanDerWaalsContact CB-OD2 3.26Å; S40-D368 WeakPolarHBondContact CB-OD2 3.34Å; S40-D368 PolarHBondContact OG-OD2 3.35Å; N366-D368 WeakPolarHBondContact CB-OD1 3.41Å; N366-D368 PolarHBondContact O-N 2.76Å; N366-D368 VanDerWaalsContact O-N 3.16Å; D368-W370 WeakPolarHBondContact OD1-CB 3.03Å; D368-W370 PolarHBondContact OD1-N 3.32Å; D368-W370 VanDerWaalsContact OD1-N 3.1Å |
| 369 | G | 94.5 | Very high | 95.1 | Very high | 29 Ų | 29 | 51.2 Ų | 51.2 | 30% | 0.299 | 28% | 0.281 | S | S | . | . | S | Bend | trans | 89.8 | 5.2 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | N366 D367 G384 | N366-G369 PolarHBondContact O-N 2.96Å; D367-G369 VanDerWaalsContact C-N 3.3Å; G369-G384 PolarHBondContact O-N 3.14Å |
| 370 | W | 96.4 | Very high | 95.2 | Very high | 5 Ų | 5 | 49.1 Ų | 49.1 | 2% | 0.019 | 27% | 0.271 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.1 | 135.5 | 172 | -68.6 | 80.7 | 0 | 0 | 0 | 111.6 | P37 P38 Y344 E351 N366 D368 L381 F382 | P37-W370 HydrophobicContact CG-CD2 4.26Å; P37-W370 HydrophobicContact CG-CG 4.4Å; P37-W370 HydrophobicContact CG-CZ2 4.26Å; P38-W370 PolarHBondContact O-NE1 3.43Å; Y344-W370 WeakPolarHBondContact OH-CH2 3.33Å; E351-W370 HydrophobicContact CG-CH2 4.34Å; E351-W370 HydrophobicContact CG-CZ3 3.87Å; E351-W370 WeakPolarHBondContact OE1-CH2 3.39Å; N366-W370 VanDerWaalsContact CB-O 3.27Å; N366-W370 WeakPolarHBondContact CB-O 3.36Å; N366-W370 PolarHBondContact N-O 2.68Å; D368-W370 WeakPolarHBondContact OD1-CB 3.03Å; D368-W370 PolarHBondContact OD1-N 3.32Å; D368-W370 VanDerWaalsContact OD1-N 3.1Å; W370-L381 HydrophobicContact CE3-CB 4.08Å; W370-F382 WeakPolarHBondContact CA-O 3.33Å; W370-F382 VanDerWaalsContact CE3-C 3.44Å |
| 371 | Y | 97.3 | Very high | 95.3 | Very high | 54 Ų | 54 | 50.5 Ų | 50.5 | 21% | 0.212 | 28% | 0.279 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.9 | 145.3 | 174.7 | -60.9 | -11 | 0 | 0 | 0 | 109.4 | V362 K364 K365 L381 F382 G384 V387 | V362-Y371 HydrophobicContact CG1-CG 4.49Å; V362-Y371 HydrophobicContact CG2-CD2 4.38Å; K364-Y371 CarbonylContact O-C 3.46Å; K364-Y371 WeakPolarHBondContact O-CA 3.42Å; K365-Y371 HydrophobicContact CB-CD1 3.69Å; K365-Y371 HydrophobicContact CB-CE1 3.77Å; K365-Y371 HydrophobicContact CD-CD1 4.16Å; K365-Y371 HydrophobicContact CD-CE1 3.74Å; K365-Y371 HydrophobicContact CD-CE2 4.21Å; K365-Y371 HydrophobicContact CG-CD1 3.57Å; K365-Y371 HydrophobicContact CG-CD2 4.41Å; K365-Y371 HydrophobicContact CG-CE1 3.66Å; K365-Y371 HydrophobicContact CG-CE2 4.47Å; K365-Y371 HydrophobicContact CG-CG 3.99Å; Y371-L381 CarbonylContact O-C 3.5Å; Y371-L381 VanDerWaalsContact O-CA 3.31Å; Y371-L381 WeakPolarHBondContact O-CA 3.05Å; Y371-F382 HydrophobicContact CD2-CE2 4.06Å; Y371-F382 HydrophobicContact CD2-CZ 4.35Å; Y371-F382 HydrophobicContact CG-CE2 4.46Å; Y371-F382 PolarHBondContact N-O 3.4Å; Y371-F382 WeakPolarHBondContact O-CD1 3.5Å; Y371-F382 PolarHBondContact O-N 2.91Å; Y371-G384 VanDerWaalsContact CE2-CA 3.49Å; Y371-V387 HydrophobicContact CD2-CG2 4.18Å; Y371-V387 HydrophobicContact CE2-CG2 4.19Å |
| 372 | E | 97.4 | Very high | 95.4 | Very high | 61 Ų | 61 | 50.2 Ų | 50.2 | 29% | 0.285 | 28% | 0.277 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.6 | 132.9 | 168.6 | -158.9 | -178 | 160.9 | 0 | 0 | 107.3 | I363 K364 T379 L381 | I363-E372 HydrophobicContact CD1-CG 4.06Å; I363-E372 HydrophobicContact CG1-CB 4.05Å; I363-E372 HydrophobicContact CG1-CG 4.07Å; I363-E372 WeakPolarHBondContact CG1-O 3.32Å; I363-E372 PolarHBondContact N-O 3.36Å; K364-E372 HydrophobicContact CB-CB 3.81Å; K364-E372 PolarHBondContact N-O 2.59Å; K364-E372 VanDerWaalsContact N-O 3.11Å; K364-E372 PolarHBondContact O-N 2.86Å; E372-T379 HydrophobicContact CG-CG2 4.27Å; E372-L381 HydrophobicContact CB-CD2 3.93Å; E372-L381 HydrophobicContact CG-CD2 4.11Å |
| 373 | G | 97 | Very high | 95.4 | Very high | 0 Ų | 0 | 50.2 Ų | 50.2 | 0% | 0 | 28% | 0.277 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -160.4 | 173 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | Y361 T379 G380 | Y361-G373 CarbonylContact O-C 3.45Å; Y361-G373 WeakPolarHBondContact O-CA 3.3Å; G373-T379 WeakPolarHBondContact O-CA 3.39Å; G373-G380 PolarHBondContact N-O 3.35Å; G373-G380 VanDerWaalsContact N-O 3.09Å; G373-G380 PolarHBondContact O-N 3.48Å |
| 374 | V | 96.6 | Very high | 95.3 | Very high | 10 Ų | 10 | 48 Ų | 48 | 6% | 0.061 | 27% | 0.269 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.9 | 131.2 | -174.8 | -171.3 | 0 | 0 | 0 | 0 | 109.9 | W329 P331 Y361 I363 V378 T379 | W329-V374 HydrophobicContact CE3-CG1 4.11Å; W329-V374 HydrophobicContact CZ3-CG1 4.27Å; P331-V374 HydrophobicContact CB-CG2 4.36Å; P331-V374 HydrophobicContact CG-CB 4.14Å; P331-V374 HydrophobicContact CG-CG2 3.95Å; Y361-V374 PolarHBondContact N-O 3.24Å; Y361-V374 PolarHBondContact O-N 3.27Å; I363-V374 HydrophobicContact CD1-CG2 4.42Å; I363-V374 HydrophobicContact CG2-CG2 4.08Å; V374-V378 WeakPolarHBondContact CA-O 3.39Å; V374-T379 HydrophobicContact CG2-CG2 4.3Å |
| 375 | M | 94.6 | Very high | 95.3 | Very high | 23 Ų | 23 | 46.1 Ų | 46.1 | 11% | 0.113 | 26% | 0.263 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.4 | 129.4 | 171.4 | -177.9 | -166.4 | 63 | 0 | 0 | 109.3 | L352 S353 F354 A358 I360 G377 V378 | L352-M375 HydrophobicContact CD1-CB 4.43Å; L352-M375 HydrophobicContact CD1-CE 4.4Å; L352-M375 HydrophobicContact CD2-CB 4.04Å; S353-M375 WeakPolarHBondContact O-CE 3.49Å; F354-M375 HydrophobicContact CB-CE 3.8Å; F354-M375 HydrophobicContact CB-SD 3.67Å; A358-M375 HydrophobicContact CB-SD 3.74Å; I360-M375 HydrophobicContact CG1-CB 4.34Å; I360-M375 HydrophobicContact CG2-CB 4.49Å; M375-G377 PolarHBondContact O-N 3.11Å; M375-V378 PolarHBondContact N-O 3.39Å; M375-V378 PolarHBondContact O-N 2.69Å |
| 376 | N | 90.7 | Very high | 95.3 | Very high | 113 Ų | 113 | 42.2 Ų | 42.2 | 60% | 0.604 | 25% | 0.246 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 52.6 | 35.2 | -179.4 | -58.2 | -41.5 | 0 | 0 | 0 | 113.5 | V378 | N376-V378 PolarHBondContact O-N 3.4Š|
| 377 | G | 91.9 | Very high | 95.3 | Very high | 45 Ų | 45 | 41 Ų | 41 | 46% | 0.464 | 24% | 0.24 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 75.1 | 3.4 | -176.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | M375 | M375-G377 PolarHBondContact O-N 3.11Š|
| 378 | V | 95.1 | Very high | 95.3 | Very high | 87 Ų | 87 | 37.1 Ų | 37.1 | 53% | 0.527 | 22% | 0.216 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -99.7 | 124.7 | 174.9 | -176.2 | 0 | 0 | 0 | 0 | 109.4 | L352 V374 M375 N376 | L352-V378 HydrophobicContact CD1-CB 4.11Å; L352-V378 HydrophobicContact CD1-CG1 3.89Å; V374-V378 WeakPolarHBondContact CA-O 3.39Å; M375-V378 PolarHBondContact N-O 3.39Å; M375-V378 PolarHBondContact O-N 2.69Å; N376-V378 PolarHBondContact O-N 3.4Å |
| 379 | T | 96.5 | Very high | 95.3 | Very high | 75 Ų | 75 | 37.2 Ų | 37.2 | 46% | 0.46 | 22% | 0.221 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -92.7 | 142.2 | 172.2 | -48.6 | 0 | 0 | 0 | 0 | 110.4 | I363 E372 G373 V374 | I363-T379 HydrophobicContact CD1-CG2 3.8Å; E372-T379 HydrophobicContact CG-CG2 4.27Å; G373-T379 WeakPolarHBondContact O-CA 3.39Å; V374-T379 HydrophobicContact CG2-CG2 4.3Å |
| 380 | G | 96.8 | Very high | 94.8 | Very high | 6 Ų | 6 | 38.2 Ų | 38.2 | 6% | 0.062 | 22% | 0.219 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -175.6 | 175 | 168.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | D350 G373 | D350-G380 CarbonylContact O-C 3.55Å; D350-G380 VanDerWaalsContact O-CA 3.28Å; D350-G380 WeakPolarHBondContact O-CA 3.34Å; G373-G380 PolarHBondContact N-O 3.35Å; G373-G380 VanDerWaalsContact N-O 3.09Å; G373-G380 PolarHBondContact O-N 3.48Å |
| 381 | L | 97.6 | Very high | 93.7 | Very high | 29 Ų | 29 | 43.8 Ų | 43.8 | 15% | 0.152 | 25% | 0.247 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -82.8 | 141.5 | 176.6 | -68.1 | 176.8 | 0 | 0 | 0 | 112.1 | D350 E351 L352 W370 Y371 E372 | D350-L381 PolarHBondContact O-N 3.19Å; E351-L381 CarbonylContact C-O 3.54Å; E351-L381 WeakPolarHBondContact CA-O 3.23Å; E351-L381 HydrophobicContact CG-CB 4.36Å; L352-L381 PolarHBondContact N-O 3.08Å; W370-L381 HydrophobicContact CE3-CB 4.08Å; Y371-L381 CarbonylContact O-C 3.5Å; Y371-L381 VanDerWaalsContact O-CA 3.31Å; Y371-L381 WeakPolarHBondContact O-CA 3.05Å; E372-L381 HydrophobicContact CB-CD2 3.93Å; E372-L381 HydrophobicContact CG-CD2 4.11Å |
| 382 | F | 97.2 | Very high | 91.5 | Very high | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 27% | 0.27 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -149.5 | 156.6 | 173.8 | 63.8 | -87.1 | 0 | 0 | 0 | 112.6 | V338 L352 F354 I360 V362 W370 Y371 G384 V387 | V338-F382 HydrophobicContact CG2-CZ 4.33Å; L352-F382 HydrophobicContact CB-CD1 4.48Å; L352-F382 HydrophobicContact CD2-CD1 4.12Å; L352-F382 HydrophobicContact CD2-CE1 4.46Å; F354-F382 HydrophobicContact CE1-CB 3.56Å; F354-F382 AromaticContact CE1-CD2 3.97Å; F354-F382 HydrophobicContact CE1-CD2 3.97Å; F354-F382 AromaticContact CE1-CG 3.82Å; F354-F382 HydrophobicContact CE1-CG 3.82Å; F354-F382 HydrophobicContact CZ-CB 4.2Å; F354-F382 HydrophobicContact CZ-CD2 4.12Å; F354-F382 HydrophobicContact CZ-CG 4.39Å; I360-F382 HydrophobicContact CB-CZ 4.39Å; I360-F382 HydrophobicContact CD1-CE1 4.48Å; I360-F382 HydrophobicContact CD1-CE2 4.31Å; I360-F382 HydrophobicContact CD1-CZ 4.26Å; I360-F382 HydrophobicContact CG2-CD1 4.49Å; I360-F382 HydrophobicContact CG2-CE1 3.64Å; I360-F382 HydrophobicContact CG2-CZ 3.8Å; V362-F382 HydrophobicContact CG2-CZ 4.12Å; W370-F382 WeakPolarHBondContact CA-O 3.33Å; W370-F382 VanDerWaalsContact CE3-C 3.44Å; Y371-F382 HydrophobicContact CD2-CE2 4.06Å; Y371-F382 HydrophobicContact CD2-CZ 4.35Å; Y371-F382 HydrophobicContact CG-CE2 4.46Å; Y371-F382 PolarHBondContact N-O 3.4Å; Y371-F382 WeakPolarHBondContact O-CD1 3.5Å; Y371-F382 PolarHBondContact O-N 2.91Å; F382-G384 PolarHBondContact O-N 3Å; F382-V387 HydrophobicContact CD2-CG1 4.05Å; F382-V387 HydrophobicContact CE2-CB 4.4Å; F382-V387 HydrophobicContact CE2-CG1 3.6Å; F382-V387 HydrophobicContact CE2-CG2 3.88Å |
| 383 | P | 96.8 | Very high | 88.7 | Confident | 0 Ų | 0 | 54.4 Ų | 54.4 | 0% | 0 | 29% | 0.292 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.1 | 124.3 | -179.7 | 30.3 | -39.7 | 0 | 0 | 0 | 112.6 | P37 Y344 N385 Y386 | P37-P383 HydrophobicContact CG-CB 3.43Å; P37-P383 VanDerWaalsContact CG-CB 3.43Å; Y344-P383 HydrophobicContact CD2-CG 3.56Å; Y344-P383 HydrophobicContact CE2-CG 3.51Å; Y344-P383 HydrophobicContact CG-CG 4.19Å; P383-N385 PolarHBondContact O-N 2.81Å; P383-N385 VanDerWaalsContact O-N 3.15Å; P383-Y386 HydrophobicContact CB-CD2 3.58Å; P383-Y386 HydrophobicContact CB-CE2 3.96Å; P383-Y386 HydrophobicContact CB-CG 4.4Å; P383-Y386 HydrophobicContact CG-CD1 4.33Å; P383-Y386 HydrophobicContact CG-CD2 3.22Å; P383-Y386 HydrophobicContact CG-CE2 3.66Å; P383-Y386 HydrophobicContact CG-CG 3.62Å; P383-Y386 WeakPolarHBondContact O-CB 3.31Å; P383-Y386 PolarHBondContact O-N 3.48Å; P383-Y386 VanDerWaalsContact O-N 3.08Å |
| 384 | G | 95.3 | Very high | 85.8 | Confident | 10 Ų | 10 | 60.7 Ų | 60.7 | 10% | 0.103 | 34% | 0.336 | C | S | . | . | G | 310 helix | trans | -64.4 | -20 | -175.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | G369 Y371 F382 Y386 V387 | G369-G384 PolarHBondContact O-N 3.14Å; Y371-G384 VanDerWaalsContact CE2-CA 3.49Å; F382-G384 PolarHBondContact O-N 3Å; G384-Y386 VanDerWaalsContact C-N 3.26Å; G384-Y386 PolarHBondContact O-N 3.01Å; G384-V387 VanDerWaalsContact O-CG2 3.24Å; G384-V387 WeakPolarHBondContact O-CG2 3.16Å |
| 385 | N | 95.8 | Very high | 82.7 | Confident | 62 Ų | 62 | 72 Ų | 72 | 33% | 0.332 | 39% | 0.388 | S | S | . | . | G | 310 helix | trans | -83.6 | 6.5 | 175.5 | 66.3 | -36.3 | 0 | 0 | 0 | 114.4 | P35 P37 P383 | P35-N385 PolarHBondContact O-ND2 3.14Å; P37-N385 WeakPolarHBondContact CD-OD1 3.46Å; P383-N385 PolarHBondContact O-N 2.81Å; P383-N385 VanDerWaalsContact O-N 3.15Å |
| 386 | Y | 95.2 | Very high | 82.1 | Confident | 1 Ų | 1 | 74.5 Ų | 74.5 | 0% | 0.004 | 40% | 0.402 | C | S | . | . | G | 310 helix | trans | -98.7 | -0.7 | 173 | -75.9 | -117.5 | 0 | 0 | 0 | 112.1 | K33 P34 A340 I341 Y344 P383 G384 | K33-Y386 HydrophobicContact CD-CE1 4.26Å; K33-Y386 WeakPolarHBondContact CE-OH 3.27Å; K33-Y386 HydrophobicContact CG-CE1 3.97Å; K33-Y386 WeakPolarHBondContact CG-OH 3.17Å; P34-Y386 HydrophobicContact CG-CD2 4.13Å; P34-Y386 HydrophobicContact CG-CE1 4.49Å; P34-Y386 HydrophobicContact CG-CE2 3.79Å; P34-Y386 PolarHBondContact O-OH 3.22Å; A340-Y386 CarbonylContact C-O 3.55Å; A340-Y386 WeakPolarHBondContact CA-O 3.28Å; I341-Y386 WeakPolarHBondContact CG1-O 3.07Å; I341-Y386 PolarHBondContact N-O 3.13Å; Y344-Y386 AromaticContact CD2-CD1 3.98Å; Y344-Y386 HydrophobicContact CD2-CD1 3.98Å; Y344-Y386 AromaticContact CD2-CE1 3.93Å; Y344-Y386 HydrophobicContact CD2-CE1 3.93Å; Y344-Y386 HydrophobicContact CD2-CG 4.47Å; Y344-Y386 HydrophobicContact CG-CD1 4.47Å; P383-Y386 HydrophobicContact CB-CD2 3.58Å; P383-Y386 HydrophobicContact CB-CE2 3.96Å; P383-Y386 HydrophobicContact CB-CG 4.4Å; P383-Y386 HydrophobicContact CG-CD1 4.33Å; P383-Y386 HydrophobicContact CG-CD2 3.22Å; P383-Y386 HydrophobicContact CG-CE2 3.66Å; P383-Y386 HydrophobicContact CG-CG 3.62Å; P383-Y386 WeakPolarHBondContact O-CB 3.31Å; P383-Y386 PolarHBondContact O-N 3.48Å; P383-Y386 VanDerWaalsContact O-N 3.08Å; G384-Y386 VanDerWaalsContact C-N 3.26Å; G384-Y386 PolarHBondContact O-N 3.01Å |
| 387 | V | 94.4 | Very high | 81.7 | Confident | 15 Ų | 15 | 72.5 Ų | 72.5 | 9% | 0.091 | 39% | 0.391 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.4 | 155.4 | -175.3 | -60.9 | 0 | 0 | 0 | 0 | 112.2 | V338 V339 F354 I360 Y371 F382 G384 | V338-V387 HydrophobicContact CB-CB 3.96Å; V338-V387 HydrophobicContact CB-CG2 4.13Å; V338-V387 HydrophobicContact CG1-CG2 4.42Å; V338-V387 HydrophobicContact CG2-CB 3.79Å; V338-V387 HydrophobicContact CG2-CG1 3.91Å; V338-V387 HydrophobicContact CG2-CG2 3.94Å; V339-V387 CarbonylContact O-C 3.6Å; V339-V387 WeakPolarHBondContact O-CA 3.16Å; V339-V387 WeakPolarHBondContact O-CB 3.49Å; F354-V387 HydrophobicContact CZ-CG1 4.28Å; I360-V387 HydrophobicContact CD1-CG1 4.2Å; Y371-V387 HydrophobicContact CD2-CG2 4.18Å; Y371-V387 HydrophobicContact CE2-CG2 4.19Å; F382-V387 HydrophobicContact CD2-CG1 4.05Å; F382-V387 HydrophobicContact CE2-CB 4.4Å; F382-V387 HydrophobicContact CE2-CG1 3.6Å; F382-V387 HydrophobicContact CE2-CG2 3.88Å; G384-V387 VanDerWaalsContact O-CG2 3.24Å; G384-V387 WeakPolarHBondContact O-CG2 3.16Å |
| 388 | E | 92.9 | Very high | 81.1 | Confident | 98 Ų | 98 | 74 Ų | 74 | 46% | 0.458 | 39% | 0.387 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.4 | 143.9 | 169 | -77.3 | 178.5 | 176.1 | 0 | 0 | 110.2 | V338 V339 I341 I390 | V338-E388 CarbonylContact C-O 3.43Å; V338-E388 VanDerWaalsContact CA-O 3.27Å; V338-E388 WeakPolarHBondContact CA-O 3.14Å; V338-E388 WeakPolarHBondContact CB-O 3Å; V339-E388 HydrophobicContact CG1-CB 4.08Å; V339-E388 PolarHBondContact N-O 3.13Å; V339-E388 PolarHBondContact O-N 2.91Å; I341-E388 HydrophobicContact CD1-CG 4.01Å; I341-E388 HydrophobicContact CG1-CG 4.4Å; I341-E388 HydrophobicContact CG2-CB 4Å; I341-E388 HydrophobicContact CG2-CG 3.69Å; E388-I390 PolarHBondContact O-N 3.1Å |
| 389 | S | 91.1 | Very high | 80.3 | Confident | 58 Ų | 58 | 73.2 Ų | 73.2 | 41% | 0.406 | 38% | 0.379 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -57.1 | 129.9 | 170.6 | -62.4 | 0 | 0 | 0 | 0 | 111.2 | E336 M391 | E336-S389 VanDerWaalsContact CD-OG 3.27Å; E336-S389 WeakPolarHBondContact OE1-CB 3.26Å; E336-S389 PolarHBondContact OE1-OG 3.44Å; S389-M391 VanDerWaalsContact C-N 3.32Å |
| 390 | I | 84.7 | Confident | 79.3 | Confident | 50 Ų | 50 | 73.1 Ų | 73.1 | 26% | 0.256 | 37% | 0.374 | S | S | . | . | S | Bend | trans | -82 | -18.3 | 172.5 | -64.5 | 160.7 | 0 | 0 | 0 | 110.9 | W8 K337 V338 V339 I359 E388 H392 | W8-I390 HydrophobicContact CH2-CG1 4.04Å; W8-I390 HydrophobicContact CZ3-CG1 4.21Å; W8-I390 HydrophobicContact CZ3-CG2 4.42Å; K337-I390 HydrophobicContact CG-CD1 4.01Å; K337-I390 WeakPolarHBondContact O-CB 3.43Å; K337-I390 PolarHBondContact O-N 3.13Å; V338-I390 WeakPolarHBondContact O-CD1 3.41Å; V339-I390 HydrophobicContact CB-CD1 4.08Å; V339-I390 HydrophobicContact CB-CG1 3.99Å; I359-I390 HydrophobicContact CD1-CD1 3.65Å; I359-I390 HydrophobicContact CG2-CD1 4.17Å; E388-I390 PolarHBondContact O-N 3.1Å; I390-H392 PolarHBondContact O-N 2.96Å |
| 391 | M | 72.5 | Confident | 78.1 | Confident | 123 Ų | 123 | 77.6 Ų | 77.6 | 61% | 0.606 | 40% | 0.395 | S | S | * | . | trans | -73.8 | 115.5 | 171 | -63.1 | -59.8 | -149.4 | 0 | 0 | 110.6 | S389 | S389-M391 VanDerWaalsContact C-N 3.32Š| ||
| 392 | H | 50.9 | Low | 76.7 | Confident | 149 Ų | 149 | 81.1 Ų | 81.1 | 69% | 0.69 | 41% | 0.412 | S | S | * | . | trans | 147.6 | 143.9 | 156.8 | -85.9 | 103.5 | 0 | 0 | 0 | 109.8 | I390 | I390-H392 PolarHBondContact O-N 2.96Š| ||
| 393 | Y | 39.1 | Very low | 75.2 | Confident | 189 Ų | 189 | 87.3 Ų | 87.3 | 74% | 0.741 | 44% | 0.444 | S | S | * | . | cis | -131.3 | 142 | 4.7 | -70 | -91.9 | 0 | 0 | 0 | 110.2 | ||||
| 394 | S | 36.6 | Very low | 73.4 | Confident | 132 Ų | 132 | 94.6 Ų | 94.6 | 92% | 0.923 | 48% | 0.481 | S | S | * | . | trans | -106.6 | 90.6 | 157.6 | 56.5 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 395 | E | 31.7 | Very low | 71.4 | Confident | 248 Ų | 248 | 102.3 Ų | 102.3 | 100% | 1.159 | 52% | 0.515 | S | S | * | . | trans | -144.7 | 0 | 172 | -161.2 | 177.3 | 163.9 | 0 | 0 | 109.7 |
Retrieved 395 of 395 residues in 213.2 ms
(Link to these results)