| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 27.7 | Very low | 38.3 | Very low | 235 Ų | 235 | 132.4 Ų | 132.4 | 100% | 1.158 | 75% | 0.748 | S | S | * | * | 0 | 109.8 | 0 | -148.7 | -174.7 | -62.2 | 0 | 0 | 106.4 | |||||
| 2 | W | 23.1 | Very low | 40.2 | Very low | 260 Ų | 260 | 132.2 Ų | 132.2 | 99% | 0.985 | 75% | 0.752 | S | S | * | * | trans | -125.9 | 121.7 | -179.6 | -69.8 | 70.5 | 0 | 0 | 0 | 107.2 | ||||
| 3 | A | 28.5 | Very low | 42.2 | Very low | 104 Ų | 104 | 134.6 Ų | 134.6 | 86% | 0.86 | 75% | 0.753 | S | S | * | * | trans | -112.4 | 108.7 | 172.7 | 0 | 0 | 0 | 0 | 0 | 107.5 | K5 | A3-K5 PolarHBondContact O-N 3.29Š| ||
| 4 | A | 27.8 | Very low | 44.2 | Very low | 55 Ų | 55 | 130 Ų | 130 | 46% | 0.455 | 73% | 0.73 | S | S | . | * | trans | -89.3 | 98.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | G6 N32 | A4-G6 PolarHBondContact O-N 3.2Å; A4-G6 VanDerWaalsContact O-N 3.17Å; A4-N32 WeakPolarHBondContact CB-ND2 3.44Å; A4-N32 PolarHBondContact O-ND2 3.29Å | ||
| 5 | K | 31.7 | Very low | 46.3 | Very low | 193 Ų | 193 | 128.5 Ų | 128.5 | 84% | 0.839 | 72% | 0.724 | S | S | * | * | trans | -64.1 | 110.5 | 161.5 | -85.4 | -177.2 | 173.2 | -177.4 | 0 | 107 | A3 Q7 | A3-K5 PolarHBondContact O-N 3.29Å; K5-Q7 PolarHBondContact O-N 2.98Å; K5-Q7 VanDerWaalsContact O-N 3.1Å | ||
| 6 | G | 42 | Very low | 48.2 | Very low | 42 Ų | 42 | 124.6 Ų | 124.6 | 43% | 0.433 | 70% | 0.704 | S | S | . | * | trans | -55.6 | 117.1 | 168.4 | 0 | 0 | 0 | 0 | 0 | 108 | A4 P8 | A4-G6 PolarHBondContact O-N 3.2Å; A4-G6 VanDerWaalsContact O-N 3.17Å; G6-P8 VanDerWaalsContact O-CD 3.26Å; G6-P8 WeakPolarHBondContact O-CD 3.47Å | ||
| 7 | Q | 40.6 | Very low | 49.9 | Very low | 176 Ų | 176 | 126.3 Ų | 126.3 | 82% | 0.822 | 70% | 0.702 | S | S | * | * | trans | -88.9 | 110.1 | -175.1 | -155.9 | 143.9 | -70.4 | 0 | 0 | 107.5 | K5 A9 | K5-Q7 PolarHBondContact O-N 2.98Å; K5-Q7 VanDerWaalsContact O-N 3.1Å; Q7-A9 PolarHBondContact O-N 3.15Å | ||
| 8 | P | 48.2 | Very low | 51.4 | Low | 94 Ų | 94 | 131.3 Ų | 131.3 | 61% | 0.61 | 72% | 0.716 | S | S | * | * | trans | -67.5 | 132.7 | 178.3 | 24.1 | -28.2 | 0 | 0 | 0 | 109.7 | G6 A10 | G6-P8 VanDerWaalsContact O-CD 3.26Å; G6-P8 WeakPolarHBondContact O-CD 3.47Å; P8-A10 PolarHBondContact O-N 2.91Å | ||
| 9 | A | 49.6 | Very low | 52.8 | Low | 67 Ų | 67 | 128.4 Ų | 128.4 | 55% | 0.554 | 72% | 0.719 | S | S | * | * | trans | -73.8 | 112 | -178.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | Q7 D11 | Q7-A9 PolarHBondContact O-N 3.15Å; A9-D11 PolarHBondContact O-N 3.05Å | ||
| 10 | A | 51.1 | Low | 53.9 | Low | 96 Ų | 96 | 131.5 Ų | 131.5 | 79% | 0.793 | 72% | 0.719 | S | S | * | * | S | Bend | trans | 47.5 | -24.7 | 156.9 | 0 | 0 | 0 | 0 | 0 | 122.2 | P8 | P8-A10 PolarHBondContact O-N 2.91Š|
| 11 | D | 51.5 | Low | 55 | Low | 134 Ų | 134 | 133 Ų | 133 | 72% | 0.717 | 73% | 0.726 | S | S | * | * | trans | -107.4 | 87.8 | 170.8 | -73.9 | -21.4 | 0 | 0 | 0 | 108.1 | A9 E13 | A9-D11 PolarHBondContact O-N 3.05Å; D11-E13 PolarHBondContact O-N 3.25Å | ||
| 12 | T | 60.3 | Low | 57.1 | Low | 130 Ų | 130 | 125.4 Ų | 125.4 | 80% | 0.798 | 69% | 0.693 | S | S | * | * | trans | -71.1 | -12.1 | -173.4 | 40.8 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 13 | E | 66.3 | Low | 59.4 | Low | 164 Ų | 164 | 118.5 Ų | 118.5 | 77% | 0.766 | 68% | 0.684 | S | S | * | * | trans | -132.8 | 116.8 | -177.9 | -168.9 | 174.2 | -169.7 | 0 | 0 | 111 | D11 | D11-E13 PolarHBondContact O-N 3.25Š| ||
| 14 | V | 70.1 | Confident | 61.5 | Low | 70 Ų | 70 | 117.1 Ų | 117.1 | 42% | 0.424 | 66% | 0.662 | S | S | . | * | trans | -122.2 | 113.2 | 179 | 176.9 | 0 | 0 | 0 | 0 | 108.1 | V16 V22 L24 | V14-V16 HydrophobicContact CG1-CG2 4.03Å; V14-V22 HydrophobicContact CG1-CB 4.43Å; V14-V22 HydrophobicContact CG1-CG1 4.39Å; V14-V22 HydrophobicContact CG1-CG2 3.57Å; V14-L24 HydrophobicContact CB-CD2 4.14Å; V14-L24 HydrophobicContact CG1-CD2 4.23Å; V14-L24 HydrophobicContact CG2-CD2 3.79Å | ||
| 15 | V | 75.6 | Confident | 63.4 | Low | 107 Ų | 107 | 119.4 Ų | 119.4 | 65% | 0.648 | 67% | 0.672 | S | S | * | * | trans | -93.7 | 122.5 | 178.6 | -177.5 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 16 | V | 76.6 | Confident | 65.1 | Low | 66 Ų | 66 | 113.8 Ų | 113.8 | 40% | 0.4 | 66% | 0.657 | S | S | . | * | trans | -120.1 | 129.2 | -179.3 | -169.5 | 0 | 0 | 0 | 0 | 109.8 | V14 R20 V22 | V14-V16 HydrophobicContact CG1-CG2 4.03Å; V16-R20 HydrophobicContact CG1-CB 3.97Å; V16-R20 WeakPolarHBondContact CG1-O 3.34Å; V16-V22 HydrophobicContact CG2-CB 3.66Å; V16-V22 HydrophobicContact CG2-CG1 3.46Å; V16-V22 VanDerWaalsContact CG2-CG1 3.46Å; V16-V22 HydrophobicContact CG2-CG2 4.26Å | ||
| 17 | F | 77.4 | Confident | 66.3 | Low | 154 Ų | 154 | 117.5 Ų | 117.5 | 68% | 0.675 | 67% | 0.671 | S | S | * | * | trans | -85 | 150 | 174.6 | -62.9 | -79 | 0 | 0 | 0 | 111.2 | G19 R20 | F17-G19 PolarHBondContact O-N 3.44Å; F17-R20 HydrophobicContact CB-CG 4.38Å; F17-R20 WeakPolarHBondContact O-CB 3.4Å; F17-R20 PolarHBondContact O-N 3.07Å | ||
| 18 | K | 76.6 | Confident | 67.6 | Low | 217 Ų | 217 | 111.8 Ų | 111.8 | 94% | 0.943 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -50.9 | 129.4 | 177.4 | -174.8 | 179.5 | 178.6 | -177.9 | 0 | 111.1 | R20 | K18-R20 VanDerWaalsContact C-N 3.34Š|
| 19 | G | 77.8 | Confident | 68.4 | Low | 76 Ų | 76 | 110 Ų | 110 | 78% | 0.784 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 85.1 | 0.9 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | F17 | F17-G19 PolarHBondContact O-N 3.44Š|
| 20 | R | 74.8 | Confident | 69.1 | Low | 190 Ų | 190 | 112.8 Ų | 112.8 | 72% | 0.717 | 65% | 0.648 | S | S | * | * | trans | -99.2 | 147.3 | 169.8 | -61.3 | -69.4 | 175.4 | 172.2 | -3.9 | 110 | V16 F17 K18 | V16-R20 HydrophobicContact CG1-CB 3.97Å; V16-R20 WeakPolarHBondContact CG1-O 3.34Å; F17-R20 HydrophobicContact CB-CG 4.38Å; F17-R20 WeakPolarHBondContact O-CB 3.4Å; F17-R20 PolarHBondContact O-N 3.07Å; K18-R20 VanDerWaalsContact C-N 3.34Å | ||
| 21 | N | 77.4 | Confident | 69.8 | Low | 162 Ų | 162 | 112.9 Ų | 112.9 | 87% | 0.866 | 64% | 0.643 | S | S | * | * | trans | -99.8 | 146.7 | 171.9 | -63.3 | -15.1 | 0 | 0 | 0 | 108.7 | ||||
| 22 | V | 72.7 | Confident | 70.4 | Confident | 76 Ų | 76 | 107.6 Ų | 107.6 | 46% | 0.461 | 61% | 0.614 | S | S | . | * | trans | -130.1 | 148 | 169.1 | 75.5 | 0 | 0 | 0 | 0 | 109.6 | V14 V16 | V14-V22 HydrophobicContact CG1-CB 4.43Å; V14-V22 HydrophobicContact CG1-CG1 4.39Å; V14-V22 HydrophobicContact CG1-CG2 3.57Å; V16-V22 HydrophobicContact CG2-CB 3.66Å; V16-V22 HydrophobicContact CG2-CG1 3.46Å; V16-V22 VanDerWaalsContact CG2-CG1 3.46Å; V16-V22 HydrophobicContact CG2-CG2 4.26Å | ||
| 23 | S | 71.9 | Confident | 70.6 | Confident | 115 Ų | 115 | 104.1 Ų | 104.1 | 80% | 0.804 | 59% | 0.593 | S | S | * | * | trans | -111.1 | 121.9 | 172.7 | -61.9 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 24 | L | 71.8 | Confident | 70.7 | Confident | 75 Ų | 75 | 101 Ų | 101 | 39% | 0.393 | 58% | 0.579 | S | S | . | * | trans | -98.1 | 121.1 | 175.2 | -63 | 176.5 | 0 | 0 | 0 | 108.6 | V14 C26 L37 | V14-L24 HydrophobicContact CB-CD2 4.14Å; V14-L24 HydrophobicContact CG1-CD2 4.23Å; V14-L24 HydrophobicContact CG2-CD2 3.79Å; L24-C26 PolarHBondContact O-N 3.21Å; L24-L37 HydrophobicContact CD1-CD1 3.91Å; L24-L37 HydrophobicContact CD1-CD2 4.17Å | ||
| 25 | P | 67.1 | Low | 70.8 | Confident | 103 Ų | 103 | 99.4 Ų | 99.4 | 67% | 0.669 | 57% | 0.566 | S | S | * | * | trans | -67.4 | 125.9 | 174.1 | 28.2 | -32.1 | 0 | 0 | 0 | 109 | ||||
| 26 | C | 68.1 | Low | 70.7 | Confident | 76 Ų | 76 | 98.8 Ų | 98.8 | 51% | 0.514 | 56% | 0.562 | S | S | . | * | trans | -130.4 | 142.2 | 176.2 | 61.4 | 0 | 0 | 0 | 0 | 110.4 | L24 | L24-C26 PolarHBondContact O-N 3.21Š| ||
| 27 | T | 67.5 | Low | 70.7 | Confident | 119 Ų | 119 | 98.2 Ų | 98.2 | 73% | 0.73 | 56% | 0.557 | S | S | * | * | P | Polyproline II helix | trans | -101 | 117.9 | 172 | -55.4 | 0 | 0 | 0 | 0 | 108.8 | ||
| 28 | V | 66.7 | Low | 70.7 | Confident | 56 Ų | 56 | 96.1 Ų | 96.1 | 34% | 0.339 | 55% | 0.549 | S | S | . | . | P | Polyproline II helix | trans | -100.4 | 126.4 | 175.7 | 177.3 | 0 | 0 | 0 | 0 | 109 | F35 P53 | V28-F35 HydrophobicContact CB-CE2 4.39Å; V28-F35 HydrophobicContact CB-CZ 4.23Å; V28-F35 HydrophobicContact CG1-CE2 4.02Å; V28-F35 HydrophobicContact CG1-CZ 4.07Å; V28-F35 HydrophobicContact CG2-CE2 3.88Å; V28-F35 HydrophobicContact CG2-CZ 4Å; V28-P53 HydrophobicContact CB-CG 4.36Å; V28-P53 HydrophobicContact CG1-CB 4.04Å; V28-P53 HydrophobicContact CG1-CG 3.33Å; V28-P53 HydrophobicContact CG2-CG 4.14Å |
| 29 | T | 65 | Low | 70.8 | Confident | 58 Ų | 58 | 90.2 Ų | 90.2 | 36% | 0.356 | 52% | 0.521 | S | S | . | . | P | Polyproline II helix | trans | -97.2 | 150.2 | 168.1 | 56.8 | 0 | 0 | 0 | 0 | 109.6 | S31 N32 | T29-S31 PolarHBondContact O-N 2.88Å; T29-S31 PolarHBondContact OG1-OG 2.74Å; T29-N32 PolarHBondContact O-N 3.34Å; T29-N32 WeakPolarHBondContact OG1-CB 3.41Å |
| 30 | P | 64.8 | Low | 70.5 | Confident | 125 Ų | 125 | 91.7 Ų | 91.7 | 81% | 0.812 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.8 | -28.3 | -179.4 | -26.9 | 33.6 | 0 | 0 | 0 | 114.5 | N32 | P30-N32 PolarHBondContact O-N 2.73Š|
| 31 | S | 66.3 | Low | 70.7 | Confident | 98 Ų | 98 | 87 Ų | 87 | 69% | 0.685 | 50% | 0.499 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.3 | -13.1 | 175.8 | 53.5 | 0 | 0 | 0 | 0 | 114.5 | T29 | T29-S31 PolarHBondContact O-N 2.88Å; T29-S31 PolarHBondContact OG1-OG 2.74Å |
| 32 | N | 63 | Low | 70.7 | Confident | 22 Ų | 22 | 85 Ų | 85 | 12% | 0.118 | 50% | 0.498 | C | S | . | . | trans | -113.9 | 87.4 | -169.6 | -150.8 | -15.3 | 0 | 0 | 0 | 108.9 | A4 T29 P30 Q34 F35 | A4-N32 WeakPolarHBondContact CB-ND2 3.44Å; A4-N32 PolarHBondContact O-ND2 3.29Å; T29-N32 PolarHBondContact O-N 3.34Å; T29-N32 WeakPolarHBondContact OG1-CB 3.41Å; P30-N32 PolarHBondContact O-N 2.73Å; N32-Q34 PolarHBondContact OD1-O 3.09Å; N32-F35 HydrophobicContact CB-CE1 3.82Å; N32-F35 HydrophobicContact CB-CE2 4.13Å; N32-F35 HydrophobicContact CB-CZ 3.4Å; N32-F35 WeakPolarHBondContact ND2-CE1 3.4Å; N32-F35 WeakPolarHBondContact O-CE2 3.49Å; N32-F35 WeakPolarHBondContact OD1-CE1 3.46Å | ||
| 33 | T | 64.6 | Low | 71.2 | Confident | 58 Ų | 58 | 85.2 Ų | 85.2 | 36% | 0.356 | 52% | 0.516 | S | S | . | . | trans | -86.2 | -14.5 | -174.1 | 55.8 | 0 | 0 | 0 | 0 | 112.7 | S52 P53 | T33-S52 WeakPolarHBondContact O-CA 3.16Å; T33-S52 WeakPolarHBondContact O-CB 3.46Å; T33-S52 PolarHBondContact O-OG 3.39Å; T33-P53 WeakPolarHBondContact O-CD 3.45Å | ||
| 34 | Q | 68.1 | Low | 71.6 | Confident | 99 Ų | 99 | 87.4 Ų | 87.4 | 46% | 0.463 | 51% | 0.507 | S | S | . | . | trans | -148.3 | 128.8 | -173.9 | -66.7 | -176.1 | -2 | 0 | 0 | 111.1 | N32 L50 L51 | N32-Q34 PolarHBondContact OD1-O 3.09Å; Q34-L50 HydrophobicContact CB-CD1 4.15Å; Q34-L51 WeakPolarHBondContact CA-O 3.41Å | ||
| 35 | F | 73.4 | Confident | 72 | Confident | 36 Ų | 36 | 85.1 Ų | 85.1 | 16% | 0.158 | 50% | 0.502 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.6 | 144.6 | 175.6 | -51.1 | -102.3 | 0 | 0 | 0 | 109.2 | V28 N32 L51 P53 | V28-F35 HydrophobicContact CB-CE2 4.39Å; V28-F35 HydrophobicContact CB-CZ 4.23Å; V28-F35 HydrophobicContact CG1-CE2 4.02Å; V28-F35 HydrophobicContact CG1-CZ 4.07Å; V28-F35 HydrophobicContact CG2-CE2 3.88Å; V28-F35 HydrophobicContact CG2-CZ 4Å; N32-F35 HydrophobicContact CB-CE1 3.82Å; N32-F35 HydrophobicContact CB-CE2 4.13Å; N32-F35 HydrophobicContact CB-CZ 3.4Å; N32-F35 WeakPolarHBondContact ND2-CE1 3.4Å; N32-F35 WeakPolarHBondContact O-CE2 3.49Å; N32-F35 WeakPolarHBondContact OD1-CE1 3.46Å; F35-L51 HydrophobicContact CB-CB 4.47Å; F35-L51 PolarHBondContact N-O 3.28Å; F35-L51 PolarHBondContact O-N 2.81Å; F35-P53 HydrophobicContact CE2-CG 4.2Å |
| 36 | V | 73.6 | Confident | 72.7 | Confident | 93 Ų | 93 | 83.6 Ų | 83.6 | 56% | 0.564 | 49% | 0.492 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -101.9 | 116.9 | 171.9 | -178.9 | 0 | 0 | 0 | 0 | 108.2 | Y48 L50 | V36-Y48 HydrophobicContact CG1-CD1 3.8Å; V36-Y48 HydrophobicContact CG1-CG 4.33Å; V36-L50 HydrophobicContact CG2-CD1 4.1Å |
| 37 | L | 76.2 | Confident | 73.3 | Confident | 55 Ų | 55 | 82.8 Ų | 82.8 | 29% | 0.288 | 48% | 0.482 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.7 | 113.5 | 166.6 | 177.9 | 65.5 | 0 | 0 | 0 | 108.3 | L24 Y48 T49 L51 | L24-L37 HydrophobicContact CD1-CD1 3.91Å; L24-L37 HydrophobicContact CD1-CD2 4.17Å; L37-Y48 CarbonylContact O-C 3.56Å; L37-Y48 WeakPolarHBondContact O-CA 3.26Å; L37-T49 PolarHBondContact N-O 3.07Å; L37-T49 PolarHBondContact O-N 3.18Å; L37-L51 HydrophobicContact CB-CD1 3.85Å; L37-L51 HydrophobicContact CB-CG 4.29Å; L37-L51 HydrophobicContact CD2-CD1 4.37Å |
| 38 | E | 76.5 | Confident | 73.9 | Confident | 110 Ų | 110 | 81.5 Ų | 81.5 | 51% | 0.514 | 46% | 0.464 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.5 | 130 | 166.7 | -179.5 | 169.5 | -162.4 | 0 | 0 | 109.1 | M47 Y48 | E38-M47 WeakPolarHBondContact CA-O 3.41Å; E38-Y48 HydrophobicContact CB-CD1 3.86Å; E38-Y48 HydrophobicContact CB-CE1 3.75Å; E38-Y48 HydrophobicContact CG-CD1 4.01Å; E38-Y48 HydrophobicContact CG-CE1 3.5Å; E38-Y48 PolarHBondContact OE1-OH 3.46Å |
| 39 | W | 78.8 | Confident | 74.3 | Confident | 93 Ų | 93 | 79.1 Ų | 79.1 | 35% | 0.352 | 45% | 0.45 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.5 | 143.9 | 175.5 | 60.3 | -80.2 | 0 | 0 | 0 | 110.1 | K41 M47 T49 | W39-K41 HydrophobicContact CE3-CB 4.3Å; W39-K41 HydrophobicContact CH2-CB 4.46Å; W39-K41 HydrophobicContact CH2-CD 4.49Å; W39-K41 HydrophobicContact CZ3-CB 3.74Å; W39-K41 HydrophobicContact CZ3-CD 4.35Å; W39-K41 HydrophobicContact CZ3-CG 4.22Å; W39-M47 HydrophobicContact CD2-CB 3.82Å; W39-M47 HydrophobicContact CD2-CG 4.49Å; W39-M47 VanDerWaalsContact CE2-CB 3.47Å; W39-M47 HydrophobicContact CE3-CB 4.34Å; W39-M47 HydrophobicContact CG-CB 4.25Å; W39-M47 HydrophobicContact CH2-CB 4.28Å; W39-M47 HydrophobicContact CH2-CG 4.13Å; W39-M47 HydrophobicContact CZ2-CB 3.73Å; W39-M47 HydrophobicContact CZ2-CG 4.03Å; W39-M47 HydrophobicContact CZ3-CG 4.4Å; W39-M47 PolarHBondContact N-O 3.2Å; W39-M47 WeakPolarHBondContact O-CA 3.46Å; W39-M47 WeakPolarHBondContact O-CB 2.89Å; W39-M47 PolarHBondContact O-N 3.11Å; W39-M47 VanDerWaalsContact O-O 3.12Å; W39-T49 PolarHBondContact NE1-OG1 2.8Å; W39-T49 VanDerWaalsContact NE1-OG1 3.07Å |
| 40 | V | 73.2 | Confident | 74.7 | Confident | 107 Ų | 107 | 78.4 Ų | 78.4 | 65% | 0.648 | 44% | 0.443 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -100.2 | 124.4 | -177.7 | 179.3 | 0 | 0 | 0 | 0 | 109.7 | ||
| 41 | K | 78.5 | Confident | 75 | Confident | 92 Ų | 92 | 73.6 Ų | 73.6 | 40% | 0.4 | 41% | 0.411 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96 | 120 | 170 | -171.7 | -179.1 | 178.3 | -176.7 | 0 | 108.9 | W39 G43 Y44 G45 M47 | W39-K41 HydrophobicContact CE3-CB 4.3Å; W39-K41 HydrophobicContact CH2-CB 4.46Å; W39-K41 HydrophobicContact CH2-CD 4.49Å; W39-K41 HydrophobicContact CZ3-CB 3.74Å; W39-K41 HydrophobicContact CZ3-CD 4.35Å; W39-K41 HydrophobicContact CZ3-CG 4.22Å; K41-G43 PolarHBondContact O-N 3.33Å; K41-Y44 HydrophobicContact CD-CD2 3.62Å; K41-Y44 HydrophobicContact CD-CE2 4.22Å; K41-Y44 HydrophobicContact CD-CG 4.06Å; K41-Y44 HydrophobicContact CG-CD2 3.83Å; K41-Y44 HydrophobicContact CG-CG 4.45Å; K41-Y44 PolarHBondContact O-N 2.83Å; K41-G45 PolarHBondContact N-O 2.88Å; K41-G45 PolarHBondContact O-N 2.84Å; K41-G45 VanDerWaalsContact O-N 3.15Å; K41-M47 HydrophobicContact CB-CG 4.31Å |
| 42 | S | 76.2 | Confident | 75 | Confident | 119 Ų | 119 | 70.4 Ų | 70.4 | 83% | 0.832 | 39% | 0.388 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.5 | 125.6 | 177.8 | -174.2 | 0 | 0 | 0 | 0 | 111 | Y44 | S42-Y44 VanDerWaalsContact C-N 3.35Å; S42-Y44 WeakPolarHBondContact O-CD2 3.24Å |
| 43 | G | 83.3 | Confident | 75 | Confident | 81 Ų | 81 | 72 Ų | 72 | 84% | 0.835 | 40% | 0.4 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 84.1 | -7.7 | -177 | 0 | 0 | 0 | 0 | 0 | 116.3 | K41 | K41-G43 PolarHBondContact O-N 3.33Š|
| 44 | Y | 80.5 | Confident | 74.7 | Confident | 160 Ų | 160 | 75 Ų | 75 | 63% | 0.627 | 41% | 0.41 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -121.6 | -12.3 | -179.2 | -64.3 | -92.4 | 0 | 0 | 0 | 113.8 | K41 S42 M47 | K41-Y44 HydrophobicContact CD-CD2 3.62Å; K41-Y44 HydrophobicContact CD-CE2 4.22Å; K41-Y44 HydrophobicContact CD-CG 4.06Å; K41-Y44 HydrophobicContact CG-CD2 3.83Å; K41-Y44 HydrophobicContact CG-CG 4.45Å; K41-Y44 PolarHBondContact O-N 2.83Å; S42-Y44 VanDerWaalsContact C-N 3.35Å; S42-Y44 WeakPolarHBondContact O-CD2 3.24Å; Y44-M47 HydrophobicContact CG-CE 4.42Å |
| 45 | G | 80 | Confident | 74 | Confident | 27 Ų | 27 | 72.7 Ų | 72.7 | 28% | 0.278 | 41% | 0.413 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 85.5 | -162.1 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113 | K41 | K41-G45 PolarHBondContact N-O 2.88Å; K41-G45 PolarHBondContact O-N 2.84Å; K41-G45 VanDerWaalsContact O-N 3.15Å |
| 46 | P | 83.3 | Confident | 72.7 | Confident | 71 Ų | 71 | 76.9 Ų | 76.9 | 46% | 0.461 | 43% | 0.433 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.2 | 136.9 | -179 | 29.6 | -33.7 | 0 | 0 | 0 | 110.8 | Y48 | P46-Y48 HydrophobicContact CB-CE2 4.26Å |
| 47 | M | 80.8 | Confident | 71.3 | Confident | 60 Ų | 60 | 79.2 Ų | 79.2 | 30% | 0.296 | 44% | 0.438 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.1 | 147.4 | 172.3 | -65.1 | -72.2 | 170.7 | 0 | 0 | 107.8 | E38 W39 K41 Y44 | E38-M47 WeakPolarHBondContact CA-O 3.41Å; W39-M47 HydrophobicContact CD2-CB 3.82Å; W39-M47 HydrophobicContact CD2-CG 4.49Å; W39-M47 VanDerWaalsContact CE2-CB 3.47Å; W39-M47 HydrophobicContact CE3-CB 4.34Å; W39-M47 HydrophobicContact CG-CB 4.25Å; W39-M47 HydrophobicContact CH2-CB 4.28Å; W39-M47 HydrophobicContact CH2-CG 4.13Å; W39-M47 HydrophobicContact CZ2-CB 3.73Å; W39-M47 HydrophobicContact CZ2-CG 4.03Å; W39-M47 HydrophobicContact CZ3-CG 4.4Å; W39-M47 PolarHBondContact N-O 3.2Å; W39-M47 WeakPolarHBondContact O-CA 3.46Å; W39-M47 WeakPolarHBondContact O-CB 2.89Å; W39-M47 PolarHBondContact O-N 3.11Å; W39-M47 VanDerWaalsContact O-O 3.12Å; K41-M47 HydrophobicContact CB-CG 4.31Å; Y44-M47 HydrophobicContact CG-CE 4.42Å |
| 48 | Y | 79.2 | Confident | 69.5 | Low | 91 Ų | 91 | 81.3 Ų | 81.3 | 36% | 0.357 | 45% | 0.446 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.9 | 140.1 | 178.3 | -59.3 | -82.2 | 0 | 0 | 0 | 108.2 | V36 L37 E38 P46 Y63 | V36-Y48 HydrophobicContact CG1-CD1 3.8Å; V36-Y48 HydrophobicContact CG1-CG 4.33Å; L37-Y48 CarbonylContact O-C 3.56Å; L37-Y48 WeakPolarHBondContact O-CA 3.26Å; E38-Y48 HydrophobicContact CB-CD1 3.86Å; E38-Y48 HydrophobicContact CB-CE1 3.75Å; E38-Y48 HydrophobicContact CG-CD1 4.01Å; E38-Y48 HydrophobicContact CG-CE1 3.5Å; E38-Y48 PolarHBondContact OE1-OH 3.46Å; P46-Y48 HydrophobicContact CB-CE2 4.26Å; Y48-Y63 VanDerWaalsContact C-CD1 3.44Å; Y48-Y63 WeakPolarHBondContact O-CD1 3.2Å; Y48-Y63 WeakPolarHBondContact O-CE1 3.49Å |
| 49 | T | 75.9 | Confident | 67.7 | Low | 7 Ų | 7 | 85.5 Ų | 85.5 | 4% | 0.043 | 46% | 0.457 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.4 | 124.4 | 177.1 | -69.3 | 0 | 0 | 0 | 0 | 108.5 | L37 W39 L51 E64 A66 | L37-T49 PolarHBondContact N-O 3.07Å; L37-T49 PolarHBondContact O-N 3.18Å; W39-T49 PolarHBondContact NE1-OG1 2.8Å; W39-T49 VanDerWaalsContact NE1-OG1 3.07Å; T49-L51 HydrophobicContact CG2-CD2 3.89Å; T49-L51 HydrophobicContact CG2-CG 4.47Å; T49-E64 VanDerWaalsContact CG2-O 3.24Å; T49-E64 WeakPolarHBondContact CG2-O 3.43Å; T49-E64 PolarHBondContact OG1-O 3.05Å; T49-A66 HydrophobicContact CG2-CB 4.12Å |
| 50 | L | 72.3 | Confident | 65.8 | Low | 43 Ų | 43 | 82.7 Ų | 82.7 | 23% | 0.225 | 45% | 0.453 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.6 | 122.6 | 174 | -168.9 | 69.8 | 0 | 0 | 0 | 109.1 | Q34 V36 H58 | Q34-L50 HydrophobicContact CB-CD1 4.15Å; V36-L50 HydrophobicContact CG2-CD1 4.1Å; L50-H58 HydrophobicContact CD2-CB 4.47Å |
| 51 | L | 71.5 | Confident | 64.1 | Low | 23 Ų | 23 | 86.7 Ų | 86.7 | 12% | 0.12 | 46% | 0.462 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.6 | 125.7 | 175.1 | -58.2 | 176.7 | 0 | 0 | 0 | 108.6 | Q34 F35 L37 T49 A66 L68 | Q34-L51 WeakPolarHBondContact CA-O 3.41Å; F35-L51 HydrophobicContact CB-CB 4.47Å; F35-L51 PolarHBondContact N-O 3.28Å; F35-L51 PolarHBondContact O-N 2.81Å; L37-L51 HydrophobicContact CB-CD1 3.85Å; L37-L51 HydrophobicContact CB-CG 4.29Å; L37-L51 HydrophobicContact CD2-CD1 4.37Å; T49-L51 HydrophobicContact CG2-CD2 3.89Å; T49-L51 HydrophobicContact CG2-CG 4.47Å; L51-A66 HydrophobicContact CD2-CB 4.1Å; L51-L68 HydrophobicContact CB-CD1 4.28Å; L51-L68 HydrophobicContact CD1-CD1 4.41Å |
| 52 | S | 67.2 | Low | 62.7 | Low | 31 Ų | 31 | 86.2 Ų | 86.2 | 22% | 0.217 | 48% | 0.483 | C | S | . | . | trans | -125.1 | 132.4 | 172.9 | -175.6 | 0 | 0 | 0 | 0 | 110.4 | T33 Q54 | T33-S52 WeakPolarHBondContact O-CA 3.16Å; T33-S52 WeakPolarHBondContact O-CB 3.46Å; T33-S52 PolarHBondContact O-OG 3.39Å; S52-Q54 PolarHBondContact O-N 3.36Å; S52-Q54 PolarHBondContact OG-N 2.88Å | ||
| 53 | P | 62.4 | Low | 60.8 | Low | 55 Ų | 55 | 85.2 Ų | 85.2 | 36% | 0.357 | 46% | 0.462 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.8 | -26.9 | 175.4 | -16 | 28.9 | 0 | 0 | 0 | 113 | V28 T33 F35 G55 | V28-P53 HydrophobicContact CB-CG 4.36Å; V28-P53 HydrophobicContact CG1-CB 4.04Å; V28-P53 HydrophobicContact CG1-CG 3.33Å; V28-P53 HydrophobicContact CG2-CG 4.14Å; T33-P53 WeakPolarHBondContact O-CD 3.45Å; F35-P53 HydrophobicContact CE2-CG 4.2Å; P53-G55 VanDerWaalsContact C-N 3.29Å; P53-G55 PolarHBondContact O-N 2.79Å |
| 54 | Q | 58.8 | Low | 58.9 | Low | 121 Ų | 121 | 88.7 Ų | 88.7 | 57% | 0.565 | 46% | 0.457 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.2 | 7.8 | -167.5 | -76 | 146.3 | 9.4 | 0 | 0 | 113.8 | S52 E56 | S52-Q54 PolarHBondContact O-N 3.36Å; S52-Q54 PolarHBondContact OG-N 2.88Å; Q54-E56 HydrophobicContact CB-CG 4.5Å; Q54-E56 PolarHBondContact O-N 3.17Å |
| 55 | G | 51.7 | Low | 57 | Low | 52 Ų | 52 | 84.7 Ų | 84.7 | 54% | 0.536 | 45% | 0.445 | S | S | . | . | trans | 63.2 | 5.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | P53 H57 | P53-G55 VanDerWaalsContact C-N 3.29Å; P53-G55 PolarHBondContact O-N 2.79Å; G55-H57 PolarHBondContact O-CD2 3.45Å; G55-H57 PolarHBondContact O-N 3.1Å; G55-H57 VanDerWaalsContact O-N 3.07Å | ||
| 56 | E | 46.2 | Very low | 55.2 | Low | 124 Ų | 124 | 85.9 Ų | 85.9 | 58% | 0.579 | 45% | 0.453 | S | S | * | . | trans | -67.4 | 109.5 | 177.7 | -76.8 | -96.6 | 142.6 | 0 | 0 | 108.9 | Q54 H58 | Q54-E56 HydrophobicContact CB-CG 4.5Å; Q54-E56 PolarHBondContact O-N 3.17Å; E56-H58 PolarHBondContact O-N 2.8Å; E56-H58 IonicContact OE2-NE2 3.72Å | ||
| 57 | H | 45 | Very low | 53.3 | Low | 142 Ų | 142 | 90.9 Ų | 90.9 | 66% | 0.657 | 46% | 0.463 | S | S | * | . | trans | -67.6 | 67.9 | -176.6 | -66.9 | -97.9 | 0 | 0 | 0 | 112.2 | G55 R59 | G55-H57 PolarHBondContact O-CD2 3.45Å; G55-H57 PolarHBondContact O-N 3.1Å; G55-H57 VanDerWaalsContact O-N 3.07Å; H57-R59 PolarHBondContact O-N 2.96Å | ||
| 58 | H | 39.2 | Very low | 51.5 | Low | 99 Ų | 99 | 92 Ų | 92 | 46% | 0.458 | 47% | 0.471 | S | S | . | . | trans | -81.2 | 91.3 | 168.4 | -62.8 | -64.9 | 0 | 0 | 0 | 108.8 | L50 E56 A60 | L50-H58 HydrophobicContact CD2-CB 4.47Å; E56-H58 PolarHBondContact O-N 2.8Å; E56-H58 IonicContact OE2-NE2 3.72Å; H58-A60 PolarHBondContact O-N 2.82Å | ||
| 59 | R | 37.2 | Very low | 49.5 | Very low | 198 Ų | 198 | 93.6 Ų | 93.6 | 75% | 0.747 | 49% | 0.49 | S | S | * | . | trans | -63.3 | 85.4 | 163.6 | -168.5 | -172.8 | -155.3 | -172.4 | 6.9 | 108 | H57 F61 | H57-R59 PolarHBondContact O-N 2.96Å; R59-F61 PolarHBondContact O-N 3.23Å | ||
| 60 | A | 38.7 | Very low | 47.7 | Very low | 34 Ų | 34 | 100.8 Ų | 100.8 | 28% | 0.281 | 52% | 0.523 | S | S | . | . | trans | -65.5 | 121 | 163.6 | 0 | 0 | 0 | 0 | 0 | 106.9 | H58 G62 Y63 | H58-A60 PolarHBondContact O-N 2.82Å; A60-G62 PolarHBondContact O-N 3.42Å; A60-G62 VanDerWaalsContact O-N 3.11Å; A60-Y63 HydrophobicContact CB-CD2 3.42Å; A60-Y63 VanDerWaalsContact CB-CD2 3.42Å; A60-Y63 HydrophobicContact CB-CE2 3.97Å; A60-Y63 HydrophobicContact CB-CG 3.86Å; A60-Y63 WeakPolarHBondContact O-CD2 3.49Å; A60-Y63 PolarHBondContact O-N 3.01Å; A60-Y63 VanDerWaalsContact O-N 3.09Å | ||
| 61 | F | 38 | Very low | 45.8 | Very low | 190 Ų | 190 | 110.2 Ų | 110.2 | 83% | 0.833 | 56% | 0.555 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.8 | 120.8 | 177 | -77 | -87 | 0 | 0 | 0 | 109.2 | R59 Y63 | R59-F61 PolarHBondContact O-N 3.23Å; F61-Y63 WeakPolarHBondContact O-CD2 2.99Å |
| 62 | G | 48.8 | Very low | 43.9 | Very low | 82 Ų | 82 | 116.6 Ų | 116.6 | 85% | 0.845 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 102.6 | -0.3 | -177.6 | 0 | 0 | 0 | 0 | 0 | 116.2 | A60 | A60-G62 PolarHBondContact O-N 3.42Å; A60-G62 VanDerWaalsContact O-N 3.11Å |
| 63 | Y | 38 | Very low | 42.7 | Very low | 98 Ų | 98 | 124 Ų | 124 | 38% | 0.384 | 64% | 0.641 | S | S | . | * | trans | -117.5 | 130.6 | -174.3 | -61.8 | -111.8 | 0 | 0 | 0 | 111.1 | Y48 A60 F61 | Y48-Y63 VanDerWaalsContact C-CD1 3.44Å; Y48-Y63 WeakPolarHBondContact O-CD1 3.2Å; Y48-Y63 WeakPolarHBondContact O-CE1 3.49Å; A60-Y63 HydrophobicContact CB-CD2 3.42Å; A60-Y63 VanDerWaalsContact CB-CD2 3.42Å; A60-Y63 HydrophobicContact CB-CE2 3.97Å; A60-Y63 HydrophobicContact CB-CG 3.86Å; A60-Y63 WeakPolarHBondContact O-CD2 3.49Å; A60-Y63 PolarHBondContact O-N 3.01Å; A60-Y63 VanDerWaalsContact O-N 3.09Å; F61-Y63 WeakPolarHBondContact O-CD2 2.99Å | ||
| 64 | E | 42.4 | Very low | 41.7 | Very low | 154 Ų | 154 | 127.5 Ų | 127.5 | 72% | 0.72 | 66% | 0.655 | S | S | * | * | trans | -79.1 | 129.2 | 165.9 | -76.7 | -172.5 | 160.1 | 0 | 0 | 109.4 | T49 | T49-E64 VanDerWaalsContact CG2-O 3.24Å; T49-E64 WeakPolarHBondContact CG2-O 3.43Å; T49-E64 PolarHBondContact OG1-O 3.05Å | ||
| 65 | I | 39.9 | Very low | 40.8 | Very low | 76 Ų | 76 | 127.8 Ų | 127.8 | 39% | 0.39 | 66% | 0.659 | S | S | . | * | trans | -80.7 | 124.6 | -179.6 | -58.7 | 175.5 | 0 | 0 | 0 | 108.8 | ||||
| 66 | A | 43.6 | Very low | 40.2 | Very low | 52 Ų | 52 | 132 Ų | 132 | 43% | 0.43 | 67% | 0.666 | S | S | . | * | trans | -110.4 | 132.3 | 172.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | T49 L51 | T49-A66 HydrophobicContact CG2-CB 4.12Å; L51-A66 HydrophobicContact CD2-CB 4.1Å | ||
| 67 | Y | 42.6 | Very low | 39.9 | Very low | 176 Ų | 176 | 132.5 Ų | 132.5 | 69% | 0.69 | 67% | 0.671 | S | S | * | * | trans | -88.7 | 125.9 | 179.9 | -57.2 | -88.4 | 0 | 0 | 0 | 110.1 | ||||
| 68 | L | 42.7 | Very low | 39.5 | Very low | 85 Ų | 85 | 131.9 Ų | 131.9 | 45% | 0.445 | 67% | 0.672 | S | S | . | * | trans | -84.1 | 111.2 | 165.7 | -67.2 | 170.3 | 0 | 0 | 0 | 107.6 | L51 | L51-L68 HydrophobicContact CB-CD1 4.28Å; L51-L68 HydrophobicContact CD1-CD1 4.41Å | ||
| 69 | T | 38.5 | Very low | 39.6 | Very low | 124 Ų | 124 | 134.1 Ų | 134.1 | 76% | 0.761 | 69% | 0.687 | S | S | * | * | trans | -93 | 108.9 | 171.7 | -52 | 0 | 0 | 0 | 0 | 108.3 | R71 | T69-R71 PolarHBondContact O-N 2.98Š| ||
| 70 | E | 37.7 | Very low | 39.7 | Very low | 157 Ų | 157 | 129.5 Ų | 129.5 | 73% | 0.734 | 68% | 0.682 | S | S | * | * | trans | -63.6 | 115 | 168 | -74.1 | -179.1 | 172.3 | 0 | 0 | 108.7 | L72 | E70-L72 PolarHBondContact O-N 3.03Š| ||
| 71 | R | 32 | Very low | 39.8 | Very low | 241 Ų | 241 | 136.8 Ų | 136.8 | 91% | 0.909 | 71% | 0.713 | S | S | * | * | trans | -82.3 | 99.9 | 160.9 | -80.2 | -169.1 | -171.5 | 175.6 | 3.4 | 107.2 | T69 S73 | T69-R71 PolarHBondContact O-N 2.98Å; R71-S73 PolarHBondContact O-N 3.42Å | ||
| 72 | L | 31.9 | Very low | 40 | Very low | 157 Ų | 157 | 132.4 Ų | 132.4 | 82% | 0.822 | 70% | 0.703 | S | S | * | * | trans | -65.9 | 109.1 | 162 | -62.9 | 170.9 | 0 | 0 | 0 | 107.2 | E70 | E70-L72 PolarHBondContact O-N 3.03Š| ||
| 73 | S | 41.8 | Very low | 39.2 | Very low | 187 Ų | 187 | 137 Ų | 137 | 100% | 1.308 | 69% | 0.69 | S | S | * | * | trans | -80.4 | 0 | 162.9 | 65.7 | 0 | 0 | 0 | 0 | 110.1 | R71 | R71-S73 PolarHBondContact O-N 3.42Š|
Retrieved 73 of 73 residues in 35.8 ms
(Link to these results)