| 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 | 63.7 | Low | 89.5 | Confident | 222 Ų | 222 | 129.4 Ų | 129.4 | 100% | 1.094 | 60% | 0.595 | S | S | * | * | 0 | 120.9 | 0 | -103.2 | -146.5 | -97.1 | 0 | 0 | 109.7 | |||||
| 2 | T | 83.6 | Confident | 89.8 | Confident | 84 Ų | 84 | 132.4 Ų | 132.4 | 52% | 0.515 | 60% | 0.598 | S | S | . | * | trans | -69.7 | 145 | 177.7 | 50.1 | 0 | 0 | 0 | 0 | 110.7 | R4 | T2-R4 PolarHBondContact O-N 3.01Å; T2-R4 VanDerWaalsContact O-N 3.12Å | ||
| 3 | T | 90.1 | Very high | 90.2 | Very high | 95 Ų | 95 | 128.8 Ų | 128.8 | 58% | 0.583 | 62% | 0.619 | S | S | * | * | G | 310 helix | trans | -63.1 | -19.5 | -174.9 | 49.9 | 0 | 0 | 0 | 0 | 113.6 | Y5 K6 | T3-Y5 VanDerWaalsContact C-N 3.3Å; T3-Y5 PolarHBondContact O-N 3.39Å; T3-K6 WeakPolarHBondContact O-CB 3.29Å; T3-K6 PolarHBondContact O-N 3.38Å |
| 4 | R | 92.4 | Very high | 90.5 | Very high | 174 Ų | 174 | 128.1 Ų | 128.1 | 66% | 0.657 | 62% | 0.615 | S | S | * | * | G | 310 helix | trans | -61.5 | -32.3 | -176.9 | 74.9 | -179.8 | -177.6 | -169.6 | 0.3 | 114.3 | T2 | T2-R4 PolarHBondContact O-N 3.01Å; T2-R4 VanDerWaalsContact O-N 3.12Å |
| 5 | Y | 93.3 | Very high | 90.7 | Very high | 162 Ų | 162 | 130.1 Ų | 130.1 | 64% | 0.635 | 64% | 0.637 | S | S | * | * | G | 310 helix | trans | -90.9 | 0.9 | -177.6 | -59.6 | -58.6 | 0 | 0 | 0 | 113.8 | T3 | T3-Y5 VanDerWaalsContact C-N 3.3Å; T3-Y5 PolarHBondContact O-N 3.39Å |
| 6 | K | 92.8 | Very high | 91 | Very high | 110 Ų | 110 | 125 Ų | 125 | 48% | 0.478 | 62% | 0.619 | S | S | . | * | trans | -71.5 | 135.7 | 179.7 | -66.2 | -174.6 | 177.2 | -175.3 | 0 | 110.8 | T3 T8 R9 | T3-K6 WeakPolarHBondContact O-CB 3.29Å; T3-K6 PolarHBondContact O-N 3.38Å; K6-T8 PolarHBondContact O-N 2.68Å; K6-R9 PolarHBondContact O-N 3.32Å | ||
| 7 | K | 93.6 | Very high | 91.3 | Very high | 158 Ų | 158 | 121.8 Ų | 121.8 | 69% | 0.687 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -51.6 | -33.8 | 176.3 | -165.3 | -177.9 | -177.6 | -178.7 | 0 | 112.8 | R9 K10 L11 | K7-R9 PolarHBondContact O-N 3.03Å; K7-R9 VanDerWaalsContact O-N 3.14Å; K7-K10 PolarHBondContact O-N 2.93Å; K7-L11 HydrophobicContact CD-CD1 4.05Å; K7-L11 HydrophobicContact CG-CD1 3.81Å; K7-L11 HydrophobicContact CG-CG 4.22Å; K7-L11 PolarHBondContact O-N 2.67Å; K7-L11 VanDerWaalsContact O-N 3.14Å |
| 8 | T | 94.2 | Very high | 91.5 | Very high | 76 Ų | 76 | 118.2 Ų | 118.2 | 47% | 0.466 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -50.9 | -34.9 | 175.3 | -47.8 | 0 | 0 | 0 | 0 | 113.5 | K6 L11 | K6-T8 PolarHBondContact O-N 2.68Å; T8-L11 PolarHBondContact O-N 3.02Å |
| 9 | R | 91.7 | Very high | 91.7 | Very high | 133 Ų | 133 | 117.2 Ų | 117.2 | 50% | 0.502 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -68.2 | -39.4 | 179.1 | -63 | -58.9 | -63.1 | -162.5 | -3.3 | 111.9 | K6 K7 L11 | K6-R9 PolarHBondContact O-N 3.32Å; K7-R9 PolarHBondContact O-N 3.03Å; K7-R9 VanDerWaalsContact O-N 3.14Å; R9-L11 VanDerWaalsContact C-N 3.34Å |
| 10 | K | 93.7 | Very high | 91.8 | Very high | 182 Ų | 182 | 113.4 Ų | 113.4 | 79% | 0.791 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -74.3 | -24 | 177.3 | -64.2 | -172 | 177.1 | -173.2 | 0 | 112.9 | K7 | K7-K10 PolarHBondContact O-N 2.93Å |
| 11 | L | 95.9 | Very high | 92 | Very high | 27 Ų | 27 | 118.8 Ų | 118.8 | 14% | 0.141 | 60% | 0.598 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -89.6 | 1.4 | -177.4 | -69.6 | 173.1 | 0 | 0 | 0 | 114.4 | K7 T8 R9 G13 H14 H17 | K7-L11 HydrophobicContact CD-CD1 4.05Å; K7-L11 HydrophobicContact CG-CD1 3.81Å; K7-L11 HydrophobicContact CG-CG 4.22Å; K7-L11 PolarHBondContact O-N 2.67Å; K7-L11 VanDerWaalsContact O-N 3.14Å; T8-L11 PolarHBondContact O-N 3.02Å; R9-L11 VanDerWaalsContact C-N 3.34Å; L11-G13 PolarHBondContact O-N 3.23Å; L11-H14 WeakPolarHBondContact O-CB 3.37Å; L11-H14 PolarHBondContact O-N 3.29Å; L11-H17 VanDerWaalsContact CB-CE1 3.48Å; L11-H17 WeakPolarHBondContact CB-CE1 3.45Å; L11-H17 PolarHBondContact O-ND1 3.3Å |
| 12 | R | 92.8 | Very high | 93.5 | Very high | 166 Ų | 166 | 114.5 Ų | 114.5 | 63% | 0.626 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.3 | 131.5 | 171.8 | -70.8 | -173.8 | 173.8 | -171.7 | -6 | 109.4 | ||
| 13 | G | 94.4 | Very high | 94 | Very high | 85 Ų | 85 | 113.1 Ų | 113.1 | 88% | 0.876 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 95.2 | -17.7 | -171.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | L11 | L11-G13 PolarHBondContact O-N 3.23Š|
| 14 | H | 94.6 | Very high | 94.3 | Very high | 120 Ų | 120 | 115.2 Ų | 115.2 | 56% | 0.556 | 59% | 0.587 | S | S | * | * | trans | -82.4 | 128.8 | 171.7 | -69.5 | -93.1 | 0 | 0 | 0 | 111.3 | L11 S16 | L11-H14 WeakPolarHBondContact O-CB 3.37Å; L11-H14 PolarHBondContact O-N 3.29Å; H14-S16 PolarHBondContact O-N 3.22Å | ||
| 15 | V | 93.7 | Very high | 94.5 | Very high | 157 Ų | 157 | 113.8 Ų | 113.8 | 95% | 0.952 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.4 | -40.1 | -173.9 | -177.1 | 0 | 0 | 0 | 0 | 113.8 | ||
| 16 | S | 95.2 | Very high | 94.6 | Very high | 49 Ų | 49 | 114 Ų | 114 | 34% | 0.343 | 59% | 0.588 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -109.9 | 3.8 | -172.2 | 64.3 | 0 | 0 | 0 | 0 | 115.1 | H14 G18 H19 G20 | H14-S16 PolarHBondContact O-N 3.22Å; S16-G18 PolarHBondContact O-N 2.87Å; S16-H19 PolarHBondContact O-N 3.17Å; S16-G20 WeakPolarHBondContact CB-O 3.28Å |
| 17 | H | 95.9 | Very high | 94.7 | Very high | 70 Ų | 70 | 117.9 Ų | 117.9 | 32% | 0.324 | 60% | 0.604 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 51.3 | 28.5 | -176.5 | -129.3 | 67.8 | 0 | 0 | 0 | 114.7 | L11 | L11-H17 VanDerWaalsContact CB-CE1 3.48Å; L11-H17 WeakPolarHBondContact CB-CE1 3.45Å; L11-H17 PolarHBondContact O-ND1 3.3Å |
| 18 | G | 94.9 | Very high | 94.9 | Very high | 58 Ų | 58 | 115 Ų | 115 | 60% | 0.598 | 59% | 0.593 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 85.8 | 9 | 179.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | S16 | S16-G18 PolarHBondContact O-N 2.87Š|
| 19 | H | 95.8 | Very high | 94.9 | Very high | 99 Ų | 99 | 116.7 Ų | 116.7 | 46% | 0.458 | 61% | 0.605 | S | S | . | * | S | Bend | trans | -100.7 | 14.3 | -179.2 | -63.7 | -69.8 | 0 | 0 | 0 | 114.6 | S16 H25 | S16-H19 PolarHBondContact O-N 3.17Å; H19-H25 HydrophobicContact CB-CB 3.87Å; H19-H25 AromaticContact CE1-ND1 3.89Å; H19-H25 AromaticContact NE2-ND1 3.73Å |
| 20 | G | 94.5 | Very high | 95 | Very high | 40 Ų | 40 | 111.9 Ų | 111.9 | 41% | 0.412 | 60% | 0.597 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 73.1 | 163.8 | 179 | 0 | 0 | 0 | 0 | 0 | 114.3 | S16 | S16-G20 WeakPolarHBondContact CB-O 3.28Š|
| 21 | R | 94.8 | Very high | 95.1 | Very high | 228 Ų | 228 | 105.1 Ų | 105.1 | 86% | 0.86 | 58% | 0.579 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.2 | -39.8 | -178.5 | -171.8 | 173.8 | 176.8 | 141.8 | -1.6 | 113 | K24 | R21-K24 WeakPolarHBondContact O-CE 3.16Š|
| 22 | V | 96.1 | Very high | 95.1 | Very high | 132 Ų | 132 | 112.5 Ų | 112.5 | 80% | 0.8 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.6 | -57.1 | -174.5 | -179.4 | 0 | 0 | 0 | 0 | 111.6 | K24 | V22-K24 PolarHBondContact O-N 3.05Š|
| 23 | G | 93.7 | Very high | 95.3 | Very high | 55 Ų | 55 | 108.4 Ų | 108.4 | 57% | 0.567 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.7 | -43 | -175.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 24 | K | 95.3 | Very high | 95.3 | Very high | 139 Ų | 139 | 111.1 Ų | 111.1 | 60% | 0.604 | 61% | 0.609 | S | S | * | * | trans | 58.4 | 160.4 | -176.9 | -58.2 | 176.6 | -177.9 | 171.7 | 0 | 113.4 | R21 V22 R26 | R21-K24 WeakPolarHBondContact O-CE 3.16Å; V22-K24 PolarHBondContact O-N 3.05Å; K24-R26 PolarHBondContact O-N 3.31Å | ||
| 25 | H | 96.7 | Very high | 95.4 | Very high | 143 Ų | 143 | 107.2 Ų | 107.2 | 66% | 0.662 | 60% | 0.597 | S | S | * | * | trans | -84.6 | 106.2 | 170.8 | -174.5 | -164.5 | 0 | 0 | 0 | 109.6 | H19 | H19-H25 HydrophobicContact CB-CB 3.87Å; H19-H25 AromaticContact CE1-ND1 3.89Å; H19-H25 AromaticContact NE2-ND1 3.73Å | ||
| 26 | R | 96 | Very high | 95.5 | Very high | 168 Ų | 168 | 100.5 Ų | 100.5 | 63% | 0.634 | 56% | 0.56 | S | S | * | * | trans | -101.8 | 167.3 | 177.4 | -57.3 | -148.2 | -173.5 | 147.8 | 4.3 | 111.6 | K24 | K24-R26 PolarHBondContact O-N 3.31Š| ||
| 27 | K | 95.8 | Very high | 95.5 | Very high | 190 Ų | 190 | 98.5 Ų | 98.5 | 83% | 0.826 | 55% | 0.547 | S | S | * | . | S | Bend | trans | -61.1 | -57.6 | -170.4 | -61.1 | -65.2 | -175.1 | 177.5 | 0 | 113.4 | ||
| 28 | H | 96.4 | Very high | 95.5 | Very high | 98 Ų | 98 | 100.2 Ų | 100.2 | 45% | 0.454 | 56% | 0.558 | S | S | . | * | trans | -150 | 69 | -176.9 | -58.8 | -70 | 0 | 0 | 0 | 112.8 | G30 G31 R32 | H28-G30 PolarHBondContact O-N 3.11Å; H28-G31 PolarHBondContact O-N 3.26Å; H28-R32 HydrophobicContact CB-CG 4.21Å; H28-R32 PolarHBondContact CD2-NE 3.38Å; H28-R32 PolarHBondContact CD2-NH2 2.96Å; H28-R32 PolarHBondContact NE2-NE 3.2Å; H28-R32 PolarHBondContact NE2-NH2 2.99Å; H28-R32 VanDerWaalsContact NE2-NH2 3.1Å | ||
| 29 | P | 94.7 | Very high | 95.5 | Very high | 111 Ų | 111 | 102.2 Ų | 102.2 | 72% | 0.721 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.1 | 128.9 | 171.8 | 29 | -32.6 | 0 | 0 | 0 | 110 | ||
| 30 | G | 93.7 | Very high | 95.6 | Very high | 32 Ų | 32 | 103.3 Ų | 103.3 | 33% | 0.33 | 56% | 0.564 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 84.6 | 6.6 | -178.3 | 0 | 0 | 0 | 0 | 0 | 115.4 | H28 H40 H41 | H28-G30 PolarHBondContact O-N 3.11Å; G30-H40 PolarHBondContact O-NE2 2.88Å; G30-H41 PolarHBondContact O-CE1 2.74Å |
| 31 | G | 96.2 | Very high | 95.7 | Very high | 41 Ų | 41 | 104.8 Ų | 104.8 | 42% | 0.423 | 56% | 0.56 | S | S | . | * | trans | 92.7 | -166.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | H28 | H28-G31 PolarHBondContact O-N 3.26Š| ||
| 32 | R | 97.1 | Very high | 95.8 | Very high | 182 Ų | 182 | 100.9 Ų | 100.9 | 69% | 0.687 | 55% | 0.545 | S | S | * | . | S | Bend | trans | -117.1 | 140.2 | -176.6 | -67.3 | -174.9 | 172 | 170.5 | 1.4 | 110.8 | H28 N34 A35 | H28-R32 HydrophobicContact CB-CG 4.21Å; H28-R32 PolarHBondContact CD2-NE 3.38Å; H28-R32 PolarHBondContact CD2-NH2 2.96Å; H28-R32 PolarHBondContact NE2-NE 3.2Å; H28-R32 PolarHBondContact NE2-NH2 2.99Å; H28-R32 VanDerWaalsContact NE2-NH2 3.1Å; R32-N34 PolarHBondContact O-N 2.91Å; R32-A35 WeakPolarHBondContact O-CB 3.38Å; R32-A35 PolarHBondContact O-N 3.48Å |
| 33 | G | 96 | Very high | 95.8 | Very high | 79 Ų | 79 | 101 Ų | 101 | 81% | 0.814 | 54% | 0.54 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.5 | -129.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | A35 | G33-A35 VanDerWaalsContact C-N 3.27Å; G33-A35 PolarHBondContact O-N 2.94Å |
| 34 | N | 94.9 | Very high | 95.9 | Very high | 142 Ų | 142 | 103 Ų | 103 | 76% | 0.759 | 53% | 0.534 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.3 | 25.2 | -177 | -63.6 | -19.1 | 0 | 0 | 0 | 113.6 | R32 F45 | R32-N34 PolarHBondContact O-N 2.91Å; N34-F45 HydrophobicContact CB-CZ 4.18Å |
| 35 | A | 96.5 | Very high | 96 | Very high | 38 Ų | 38 | 97.4 Ų | 97.4 | 31% | 0.314 | 51% | 0.51 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.9 | 147.7 | 178 | 0 | 0 | 0 | 0 | 0 | 112 | R32 G33 G37 H41 | R32-A35 WeakPolarHBondContact O-CB 3.38Å; R32-A35 PolarHBondContact O-N 3.48Å; G33-A35 VanDerWaalsContact C-N 3.27Å; G33-A35 PolarHBondContact O-N 2.94Å; A35-G37 VanDerWaalsContact C-N 3.29Å; A35-G37 PolarHBondContact O-N 2.89Å; A35-H41 PolarHBondContact O-ND1 3.04Å |
| 36 | G | 96.1 | Very high | 95.8 | Very high | 17 Ų | 17 | 95.3 Ų | 95.3 | 18% | 0.175 | 50% | 0.502 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 74.9 | 9.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 115.7 | L38 T39 H40 H41 | G36-L38 PolarHBondContact O-N 2.99Å; G36-L38 VanDerWaalsContact O-N 3.11Å; G36-T39 WeakPolarHBondContact CA-OG1 3.32Å; G36-T39 CarbonylContact O-C 3.42Å; G36-T39 PolarHBondContact O-N 3.01Å; G36-H40 VanDerWaalsContact CA-CE1 3.44Å; G36-H40 WeakPolarHBondContact CA-CE1 3.28Å; G36-H40 PolarHBondContact O-N 2.81Å; G36-H41 WeakPolarHBondContact O-CA 3.41Å; G36-H41 WeakPolarHBondContact O-CB 3.5Å; G36-H41 PolarHBondContact O-N 2.8Å |
| 37 | G | 95.3 | Very high | 95.9 | Very high | 6 Ų | 6 | 94 Ų | 94 | 6% | 0.062 | 50% | 0.501 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.2 | -21.5 | -172.2 | 0 | 0 | 0 | 0 | 0 | 116 | A35 R42 F45 F53 | A35-G37 VanDerWaalsContact C-N 3.29Å; A35-G37 PolarHBondContact O-N 2.89Å; G37-R42 WeakPolarHBondContact O-CA 3.2Å; G37-F45 VanDerWaalsContact CA-CE2 3.48Å; G37-F53 WeakPolarHBondContact O-CE2 3.42Å |
| 38 | L | 95.1 | Very high | 95.9 | Very high | 106 Ų | 106 | 91.4 Ų | 91.4 | 56% | 0.555 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.5 | -8.8 | 171.5 | -70.3 | 175.5 | 0 | 0 | 0 | 113.8 | G36 M46 F53 | G36-L38 PolarHBondContact O-N 2.99Å; G36-L38 VanDerWaalsContact O-N 3.11Å; L38-M46 HydrophobicContact CD2-CE 4.31Å; L38-F53 HydrophobicContact CD1-CD1 4.12Å; L38-F53 HydrophobicContact CD1-CE1 4.27Å; L38-F53 HydrophobicContact CD1-CG 4.49Å; L38-F53 HydrophobicContact CD2-CB 4.24Å; L38-F53 HydrophobicContact CD2-CD1 3.94Å; L38-F53 HydrophobicContact CD2-CD2 3.38Å; L38-F53 HydrophobicContact CD2-CE1 4.13Å; L38-F53 HydrophobicContact CD2-CE2 3.58Å; L38-F53 HydrophobicContact CD2-CG 3.57Å; L38-F53 HydrophobicContact CD2-CZ 3.97Å; L38-F53 HydrophobicContact CG-CD1 3.94Å; L38-F53 HydrophobicContact CG-CD2 4.13Å; L38-F53 HydrophobicContact CG-CE1 3.8Å; L38-F53 HydrophobicContact CG-CE2 3.98Å; L38-F53 HydrophobicContact CG-CG 4.12Å; L38-F53 HydrophobicContact CG-CZ 3.83Å |
| 39 | T | 96 | Very high | 95.9 | Very high | 100 Ų | 100 | 91.4 Ų | 91.4 | 61% | 0.613 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -116.2 | -105.6 | -175.5 | 59.6 | 0 | 0 | 0 | 0 | 110.7 | G36 H41 R42 | G36-T39 WeakPolarHBondContact CA-OG1 3.32Å; G36-T39 CarbonylContact O-C 3.42Å; G36-T39 PolarHBondContact O-N 3.01Å; T39-H41 VanDerWaalsContact C-N 3.28Å; T39-H41 PolarHBondContact O-N 2.96Å; T39-R42 WeakPolarHBondContact O-CB 2.98Å; T39-R42 PolarHBondContact O-N 3.03Å; T39-R42 VanDerWaalsContact O-N 3.13Å |
| 40 | H | 96.9 | Very high | 95.9 | Very high | 122 Ų | 122 | 90.9 Ų | 90.9 | 57% | 0.565 | 48% | 0.483 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.1 | -14.5 | -172.6 | 57.1 | -86.1 | 0 | 0 | 0 | 114 | G30 G36 | G30-H40 PolarHBondContact O-NE2 2.88Å; G36-H40 VanDerWaalsContact CA-CE1 3.44Å; G36-H40 WeakPolarHBondContact CA-CE1 3.28Å; G36-H40 PolarHBondContact O-N 2.81Å |
| 41 | H | 96.7 | Very high | 95.9 | Very high | 71 Ų | 71 | 92.2 Ų | 92.2 | 33% | 0.329 | 50% | 0.497 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -106.4 | 11.2 | 171 | -64.5 | 157.2 | 0 | 0 | 0 | 113.4 | G30 A35 G36 T39 I43 H44 F45 | G30-H41 PolarHBondContact O-CE1 2.74Å; A35-H41 PolarHBondContact O-ND1 3.04Å; G36-H41 WeakPolarHBondContact O-CA 3.41Å; G36-H41 WeakPolarHBondContact O-CB 3.5Å; G36-H41 PolarHBondContact O-N 2.8Å; T39-H41 VanDerWaalsContact C-N 3.28Å; T39-H41 PolarHBondContact O-N 2.96Å; H41-I43 VanDerWaalsContact C-N 3.29Å; H41-I43 PolarHBondContact O-N 3.44Å; H41-H44 WeakPolarHBondContact O-CB 3.35Å; H41-H44 PolarHBondContact O-N 3.49Å; H41-F45 HydrophobicContact CB-CD2 4.38Å; H41-F45 HydrophobicContact CB-CE2 4.46Å; H41-F45 PolarHBondContact O-N 3.41Å |
| 42 | R | 96.3 | Very high | 95.7 | Very high | 146 Ų | 146 | 93.9 Ų | 93.9 | 55% | 0.551 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -52.5 | -43.2 | -178.4 | -175.5 | -177.4 | 71.9 | -172.1 | 1.7 | 113.6 | G37 T39 H44 F45 M46 | G37-R42 WeakPolarHBondContact O-CA 3.2Å; T39-R42 WeakPolarHBondContact O-CB 2.98Å; T39-R42 PolarHBondContact O-N 3.03Å; T39-R42 VanDerWaalsContact O-N 3.13Å; R42-H44 VanDerWaalsContact C-N 3.27Å; R42-H44 PolarHBondContact O-N 2.69Å; R42-F45 PolarHBondContact O-N 2.78Å; R42-M46 HydrophobicContact CG-CG 3.95Å; R42-M46 WeakPolarHBondContact O-CB 3.38Å; R42-M46 VanDerWaalsContact O-CG 3.32Å; R42-M46 WeakPolarHBondContact O-CG 3.33Å; R42-M46 PolarHBondContact O-N 2.92Å |
| 43 | I | 96.8 | Very high | 95.6 | Very high | 136 Ų | 136 | 89 Ų | 89 | 70% | 0.697 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -60.6 | -40.7 | -178.4 | -62.1 | 173.2 | 0 | 0 | 0 | 110.7 | H41 K47 | H41-I43 VanDerWaalsContact C-N 3.29Å; H41-I43 PolarHBondContact O-N 3.44Å; I43-K47 WeakPolarHBondContact O-CB 3.39Å; I43-K47 PolarHBondContact O-N 3.11Å |
| 44 | H | 95.9 | Very high | 95.5 | Very high | 95 Ų | 95 | 88.5 Ų | 88.5 | 44% | 0.44 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.9 | -47 | 178.5 | -178.7 | 79.2 | 0 | 0 | 0 | 111.6 | H41 R42 Y48 H49 | H41-H44 WeakPolarHBondContact O-CB 3.35Å; H41-H44 PolarHBondContact O-N 3.49Å; R42-H44 VanDerWaalsContact C-N 3.27Å; R42-H44 PolarHBondContact O-N 2.69Å; H44-Y48 AromaticContact CE1-CD2 3.82Å; H44-Y48 AromaticContact ND1-CD2 3.61Å; H44-Y48 AromaticContact ND1-CE2 3.98Å; H44-Y48 WeakPolarHBondContact O-CD2 3.37Å; H44-Y48 PolarHBondContact O-N 3.32Å; H44-Y48 VanDerWaalsContact O-N 3.1Å; H44-H49 AromaticContact NE2-CE1 3.81Å |
| 45 | F | 96.6 | Very high | 95.5 | Very high | 22 Ų | 22 | 90.8 Ų | 90.8 | 10% | 0.096 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -67.1 | -45.2 | 179.9 | -83.1 | -93.2 | 0 | 0 | 0 | 112.4 | N34 G37 H41 R42 K47 H49 C52 F53 | N34-F45 HydrophobicContact CB-CZ 4.18Å; G37-F45 VanDerWaalsContact CA-CE2 3.48Å; H41-F45 HydrophobicContact CB-CD2 4.38Å; H41-F45 HydrophobicContact CB-CE2 4.46Å; H41-F45 PolarHBondContact O-N 3.41Å; R42-F45 PolarHBondContact O-N 2.78Å; F45-K47 VanDerWaalsContact C-N 3.32Å; F45-K47 PolarHBondContact O-N 3.21Å; F45-H49 CarbonylContact O-C 3.03Å; F45-H49 VanDerWaalsContact O-CA 3.26Å; F45-H49 WeakPolarHBondContact O-CA 3.36Å; F45-H49 PolarHBondContact O-N 3.42Å; F45-H49 VanDerWaalsContact O-O 3.11Å; F45-C52 HydrophobicContact CD1-CB 4.3Å; F45-F53 HydrophobicContact CB-CE2 3.84Å; F45-F53 AromaticContact CD1-CE2 3.83Å; F45-F53 HydrophobicContact CD1-CE2 3.83Å; F45-F53 AromaticContact CD1-CZ 3.92Å; F45-F53 HydrophobicContact CD1-CZ 3.92Å; F45-F53 HydrophobicContact CE1-CZ 4.29Å; F45-F53 AromaticContact CG-CE2 3.91Å; F45-F53 HydrophobicContact CG-CE2 3.91Å; F45-F53 HydrophobicContact CG-CZ 4.16Å |
| 46 | M | 93.8 | Very high | 95.3 | Very high | 100 Ų | 100 | 96.5 Ų | 96.5 | 49% | 0.493 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -68.1 | -32.2 | -179.3 | -65.3 | -61.6 | 144.7 | 0 | 0 | 112.6 | L38 R42 F53 | L38-M46 HydrophobicContact CD2-CE 4.31Å; R42-M46 HydrophobicContact CG-CG 3.95Å; R42-M46 WeakPolarHBondContact O-CB 3.38Å; R42-M46 VanDerWaalsContact O-CG 3.32Å; R42-M46 WeakPolarHBondContact O-CG 3.33Å; R42-M46 PolarHBondContact O-N 2.92Å; M46-F53 HydrophobicContact CE-CD2 3.77Å; M46-F53 HydrophobicContact CE-CE2 4.23Å |
| 47 | K | 96.4 | Very high | 95.3 | Very high | 141 Ų | 141 | 99 Ų | 99 | 61% | 0.613 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -77.5 | -46.9 | -179.1 | -175.8 | 174.1 | -178.9 | -178.9 | 0 | 113.1 | I43 F45 | I43-K47 WeakPolarHBondContact O-CB 3.39Å; I43-K47 PolarHBondContact O-N 3.11Å; F45-K47 VanDerWaalsContact C-N 3.32Å; F45-K47 PolarHBondContact O-N 3.21Å |
| 48 | Y | 97.6 | Very high | 95.4 | Very high | 135 Ų | 135 | 107.8 Ų | 107.8 | 53% | 0.529 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -103.9 | -22.1 | -170.4 | -62.7 | -69.5 | 0 | 0 | 0 | 113.6 | H44 P50 | H44-Y48 AromaticContact CE1-CD2 3.82Å; H44-Y48 AromaticContact ND1-CD2 3.61Å; H44-Y48 AromaticContact ND1-CE2 3.98Å; H44-Y48 WeakPolarHBondContact O-CD2 3.37Å; H44-Y48 PolarHBondContact O-N 3.32Å; H44-Y48 VanDerWaalsContact O-N 3.1Å; Y48-P50 VanDerWaalsContact C-CD 3.47Å |
| 49 | H | 95.9 | Very high | 95.4 | Very high | 98 Ų | 98 | 112 Ų | 112 | 45% | 0.454 | 58% | 0.58 | S | S | . | * | trans | -133.9 | 57.3 | -174.4 | -52 | 96.4 | 0 | 0 | 0 | 111.8 | H44 F45 G51 C52 | H44-H49 AromaticContact NE2-CE1 3.81Å; F45-H49 CarbonylContact O-C 3.03Å; F45-H49 VanDerWaalsContact O-CA 3.26Å; F45-H49 WeakPolarHBondContact O-CA 3.36Å; F45-H49 PolarHBondContact O-N 3.42Å; F45-H49 VanDerWaalsContact O-O 3.11Å; H49-G51 PolarHBondContact O-N 3.28Å; H49-C52 HydrophobicContact CB-CB 4.22Å; H49-C52 VanDerWaalsContact O-CB 3.26Å; H49-C52 WeakPolarHBondContact O-CB 3.36Å; H49-C52 PolarHBondContact O-N 3.14Å | ||
| 50 | P | 94.9 | Very high | 95.3 | Very high | 100 Ų | 100 | 112.2 Ų | 112.2 | 65% | 0.649 | 58% | 0.577 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.7 | 139.6 | 176.7 | 28.2 | -35 | 0 | 0 | 0 | 110.6 | Y48 C52 | Y48-P50 VanDerWaalsContact C-CD 3.47Å; P50-C52 VanDerWaalsContact C-N 3.33Å |
| 51 | G | 93 | Very high | 95.2 | Very high | 60 Ų | 60 | 113.1 Ų | 113.1 | 62% | 0.619 | 58% | 0.579 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 82.1 | 3.4 | -177.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | H49 F53 | H49-G51 PolarHBondContact O-N 3.28Å; G51-F53 PolarHBondContact O-N 2.81Å |
| 52 | C | 92.9 | Very high | 95.2 | Very high | 75 Ų | 75 | 116.8 Ų | 116.8 | 51% | 0.507 | 60% | 0.596 | S | S | . | * | S | Bend | trans | -62.5 | -30 | 175.1 | -175.1 | 0 | 0 | 0 | 0 | 112.7 | F45 H49 P50 | F45-C52 HydrophobicContact CD1-CB 4.3Å; H49-C52 HydrophobicContact CB-CB 4.22Å; H49-C52 VanDerWaalsContact O-CB 3.26Å; H49-C52 WeakPolarHBondContact O-CB 3.36Å; H49-C52 PolarHBondContact O-N 3.14Å; P50-C52 VanDerWaalsContact C-N 3.33Å |
| 53 | F | 94.3 | Very high | 95.1 | Very high | 79 Ų | 79 | 117.1 Ų | 117.1 | 35% | 0.346 | 60% | 0.598 | S | S | . | * | S | Bend | trans | -102.9 | 139 | 174.8 | -57.4 | -72.6 | 0 | 0 | 0 | 110.9 | G37 L38 F45 M46 G51 | G37-F53 WeakPolarHBondContact O-CE2 3.42Å; L38-F53 HydrophobicContact CD1-CD1 4.12Å; L38-F53 HydrophobicContact CD1-CE1 4.27Å; L38-F53 HydrophobicContact CD1-CG 4.49Å; L38-F53 HydrophobicContact CD2-CB 4.24Å; L38-F53 HydrophobicContact CD2-CD1 3.94Å; L38-F53 HydrophobicContact CD2-CD2 3.38Å; L38-F53 HydrophobicContact CD2-CE1 4.13Å; L38-F53 HydrophobicContact CD2-CE2 3.58Å; L38-F53 HydrophobicContact CD2-CG 3.57Å; L38-F53 HydrophobicContact CD2-CZ 3.97Å; L38-F53 HydrophobicContact CG-CD1 3.94Å; L38-F53 HydrophobicContact CG-CD2 4.13Å; L38-F53 HydrophobicContact CG-CE1 3.8Å; L38-F53 HydrophobicContact CG-CE2 3.98Å; L38-F53 HydrophobicContact CG-CG 4.12Å; L38-F53 HydrophobicContact CG-CZ 3.83Å; F45-F53 HydrophobicContact CB-CE2 3.84Å; F45-F53 AromaticContact CD1-CE2 3.83Å; F45-F53 HydrophobicContact CD1-CE2 3.83Å; F45-F53 AromaticContact CD1-CZ 3.92Å; F45-F53 HydrophobicContact CD1-CZ 3.92Å; F45-F53 HydrophobicContact CE1-CZ 4.29Å; F45-F53 AromaticContact CG-CE2 3.91Å; F45-F53 HydrophobicContact CG-CE2 3.91Å; F45-F53 HydrophobicContact CG-CZ 4.16Å; M46-F53 HydrophobicContact CE-CD2 3.77Å; M46-F53 HydrophobicContact CE-CE2 4.23Å; G51-F53 PolarHBondContact O-N 2.81Å |
| 54 | G | 93.3 | Very high | 95.1 | Very high | 69 Ų | 69 | 117 Ų | 117 | 71% | 0.711 | 59% | 0.588 | S | S | * | * | S | Bend | trans | 119.5 | 172.5 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 55 | K | 95.1 | Very high | 95 | Very high | 191 Ų | 191 | 116.1 Ų | 116.1 | 83% | 0.83 | 59% | 0.589 | S | S | * | * | trans | -123 | 131.1 | 177.8 | -177.5 | -177.6 | 176.5 | -172.8 | 0 | 108.8 | ||||
| 56 | H | 92.9 | Very high | 94.9 | Very high | 157 Ų | 157 | 121.1 Ų | 121.1 | 73% | 0.727 | 61% | 0.613 | S | S | * | * | trans | -130.8 | 143.1 | -178.4 | -57.6 | 89.7 | 0 | 0 | 0 | 110.3 | ||||
| 57 | G | 95.5 | Very high | 94.8 | Very high | 71 Ų | 71 | 121.6 Ų | 121.6 | 73% | 0.732 | 62% | 0.618 | S | S | * | * | S | Bend | trans | 73.8 | -173.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||
| 58 | M | 96.6 | Very high | 94.7 | Very high | 189 Ų | 189 | 121 Ų | 121 | 93% | 0.931 | 62% | 0.615 | S | S | * | * | trans | -106.2 | 138.6 | -178 | -63 | 170.5 | 74.6 | 0 | 0 | 111 | ||||
| 59 | R | 94.9 | Very high | 94.5 | Very high | 196 Ų | 196 | 122.6 Ų | 122.6 | 74% | 0.74 | 62% | 0.62 | S | S | * | * | trans | -79.5 | 125.6 | -179.1 | -174.7 | 164.1 | 69 | -179.6 | 2.4 | 110.7 | F61 | R59-F61 HydrophobicContact CG-CD1 4.46Å; R59-F61 HydrophobicContact CG-CE1 4.24Å; R59-F61 HydrophobicContact CG-CZ 4.39Å; R59-F61 VanDerWaalsContact CZ-CE1 3.43Å; R59-F61 VanDerWaalsContact NH2-CZ 3.28Å | ||
| 60 | N | 94.5 | Very high | 94.5 | Very high | 103 Ų | 103 | 120.2 Ų | 120.2 | 55% | 0.551 | 61% | 0.614 | S | S | * | * | trans | -103.2 | 114.6 | 173.1 | -174.8 | -8.2 | 0 | 0 | 0 | 109.8 | ||||
| 61 | F | 95.7 | Very high | 94.6 | Very high | 142 Ų | 142 | 116.8 Ų | 116.8 | 62% | 0.623 | 59% | 0.592 | S | S | * | * | S | Bend | trans | -83.3 | 149.3 | 179.9 | -59.4 | -80 | 0 | 0 | 0 | 111.6 | R59 R63 | R59-F61 HydrophobicContact CG-CD1 4.46Å; R59-F61 HydrophobicContact CG-CE1 4.24Å; R59-F61 HydrophobicContact CG-CZ 4.39Å; R59-F61 VanDerWaalsContact CZ-CE1 3.43Å; R59-F61 VanDerWaalsContact NH2-CZ 3.28Å; F61-R63 VanDerWaalsContact C-N 3.28Å; F61-R63 PolarHBondContact O-N 3.18Å |
| 62 | H | 95.7 | Very high | 94.8 | Very high | 148 Ų | 148 | 117.3 Ų | 117.3 | 69% | 0.685 | 58% | 0.583 | S | S | * | * | S | Bend | trans | 49 | 48 | 177.8 | -171.8 | 75.4 | 0 | 0 | 0 | 112.8 | R64 | H62-R64 PolarHBondContact CD2-NE 2.9Å; H62-R64 PolarHBondContact NE2-NE 3.03Å; H62-R64 PolarHBondContact NE2-NH2 3.48Å; H62-R64 PolarHBondContact O-N 3.05Å |
| 63 | R | 95 | Very high | 95.1 | Very high | 153 Ų | 153 | 114.1 Ų | 114.1 | 58% | 0.577 | 56% | 0.561 | S | S | * | * | trans | -62.9 | 109.7 | -177.7 | -178.3 | 179.1 | 175.8 | -120.5 | 0.2 | 111.1 | F61 V65 | F61-R63 VanDerWaalsContact C-N 3.28Å; F61-R63 PolarHBondContact O-N 3.18Å; R63-V65 PolarHBondContact O-N 3.11Å | ||
| 64 | R | 96 | Very high | 95.2 | Very high | 133 Ų | 133 | 112.3 Ų | 112.3 | 50% | 0.502 | 56% | 0.555 | S | S | . | * | trans | -84 | 96.8 | 172.6 | -68.9 | -177.7 | -164.7 | 172.6 | 9 | 110.7 | H62 H66 N67 F68 | H62-R64 PolarHBondContact CD2-NE 2.9Å; H62-R64 PolarHBondContact NE2-NE 3.03Å; H62-R64 PolarHBondContact NE2-NH2 3.48Å; H62-R64 PolarHBondContact O-N 3.05Å; R64-H66 PolarHBondContact O-N 3.04Å; R64-N67 PolarHBondContact O-N 3.45Å; R64-F68 VanDerWaalsContact O-CD2 3.31Å; R64-F68 WeakPolarHBondContact O-CD2 3.35Å | ||
| 65 | V | 94.6 | Very high | 95.4 | Very high | 76 Ų | 76 | 109 Ų | 109 | 46% | 0.461 | 52% | 0.521 | S | S | . | . | G | 310 helix | trans | -62.2 | -31.3 | -175.2 | -168.4 | 0 | 0 | 0 | 0 | 112.4 | R63 N67 F68 W69 | R63-V65 PolarHBondContact O-N 3.11Å; V65-N67 VanDerWaalsContact C-N 3.3Å; V65-N67 PolarHBondContact O-N 2.97Å; V65-F68 PolarHBondContact O-N 3.19Å; V65-F68 VanDerWaalsContact O-N 3.08Å; V65-W69 PolarHBondContact O-N 3.41Å |
| 66 | H | 94.3 | Very high | 95.4 | Very high | 128 Ų | 128 | 103.6 Ų | 103.6 | 59% | 0.593 | 50% | 0.499 | S | S | * | . | G | 310 helix | trans | -61.6 | -33 | -179.7 | 59.2 | -97.8 | 0 | 0 | 0 | 113.7 | R64 F68 W69 | R64-H66 PolarHBondContact O-N 3.04Å; H66-F68 PolarHBondContact O-N 3.17Å; H66-W69 VanDerWaalsContact O-CB 3.29Å; H66-W69 WeakPolarHBondContact O-CB 3.46Å; H66-W69 PolarHBondContact O-N 3.01Å; H66-W69 VanDerWaalsContact O-N 3.14Å |
| 67 | N | 92.2 | Very high | 95.5 | Very high | 110 Ų | 110 | 102.3 Ų | 102.3 | 59% | 0.588 | 49% | 0.491 | S | S | * | . | G | 310 helix | trans | -65.3 | -26.1 | 177.1 | -71.8 | -9.8 | 0 | 0 | 0 | 112.5 | R64 V65 | R64-N67 PolarHBondContact O-N 3.45Å; V65-N67 VanDerWaalsContact C-N 3.3Å; V65-N67 PolarHBondContact O-N 2.97Å |
| 68 | F | 92.9 | Very high | 95.5 | Very high | 129 Ų | 129 | 98.9 Ų | 98.9 | 57% | 0.566 | 46% | 0.456 | S | S | * | . | G | 310 helix | trans | -99.4 | 5.6 | 179.5 | -54.7 | -76.4 | 0 | 0 | 0 | 112.3 | R64 V65 H66 C70 | R64-F68 VanDerWaalsContact O-CD2 3.31Å; R64-F68 WeakPolarHBondContact O-CD2 3.35Å; V65-F68 PolarHBondContact O-N 3.19Å; V65-F68 VanDerWaalsContact O-N 3.08Å; H66-F68 PolarHBondContact O-N 3.17Å; F68-C70 PolarHBondContact O-N 2.96Å; F68-C70 VanDerWaalsContact O-N 3.09Å |
| 69 | W | 94.1 | Very high | 95.3 | Very high | 168 Ų | 168 | 90.7 Ų | 90.7 | 64% | 0.636 | 41% | 0.414 | S | S | * | . | trans | -71.8 | 106.3 | -177.2 | -171.8 | -107.9 | 0 | 0 | 0 | 110.9 | V65 H66 P71 H108 | V65-W69 PolarHBondContact O-N 3.41Å; H66-W69 VanDerWaalsContact O-CB 3.29Å; H66-W69 WeakPolarHBondContact O-CB 3.46Å; H66-W69 PolarHBondContact O-N 3.01Å; H66-W69 VanDerWaalsContact O-N 3.14Å; W69-P71 HydrophobicContact CD2-CG 4.2Å; W69-P71 VanDerWaalsContact CE2-CG 3.45Å; W69-P71 HydrophobicContact CG-CG 4.45Å; W69-P71 HydrophobicContact CZ2-CG 3.74Å; W69-H108 PolarHBondContact O-CE1 3.35Å; W69-H108 PolarHBondContact O-ND1 2.89Å | ||
| 70 | C | 95.4 | Very high | 95.3 | Very high | 48 Ų | 48 | 86 Ų | 86 | 32% | 0.324 | 41% | 0.412 | S | S | . | . | trans | -141 | 77.5 | 179.9 | -169.2 | 0 | 0 | 0 | 0 | 110.5 | F68 T72 | F68-C70 PolarHBondContact O-N 2.96Å; F68-C70 VanDerWaalsContact O-N 3.09Å; C70-T72 PolarHBondContact O-N 3.12Å | ||
| 71 | P | 97.3 | Very high | 95.3 | Very high | 28 Ų | 28 | 82.5 Ų | 82.5 | 18% | 0.182 | 39% | 0.393 | C | S | . | . | trans | -63.6 | 136.2 | 176.9 | -17.2 | 31.1 | 0 | 0 | 0 | 110.1 | W69 G106 Y107 H108 K109 | W69-P71 HydrophobicContact CD2-CG 4.2Å; W69-P71 VanDerWaalsContact CE2-CG 3.45Å; W69-P71 HydrophobicContact CG-CG 4.45Å; W69-P71 HydrophobicContact CZ2-CG 3.74Å; P71-G106 WeakPolarHBondContact CB-O 3.36Å; P71-G106 VanDerWaalsContact CG-O 3.3Å; P71-G106 WeakPolarHBondContact CG-O 3.46Å; P71-Y107 HydrophobicContact CB-CD1 4.19Å; P71-H108 PolarHBondContact O-N 3.41Å; P71-K109 PolarHBondContact O-N 3.27Å | ||
| 72 | T | 97.8 | Very high | 95.1 | Very high | 70 Ų | 70 | 77.1 Ų | 77.1 | 43% | 0.429 | 37% | 0.371 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.5 | 140.7 | -174.7 | 57.1 | 0 | 0 | 0 | 0 | 111.6 | C70 K109 L111 | C70-T72 PolarHBondContact O-N 3.12Å; T72-K109 CarbonylContact C-O 3.58Å; T72-K109 VanDerWaalsContact CA-O 3.24Å; T72-K109 WeakPolarHBondContact CA-O 3.29Å; T72-K109 HydrophobicContact CG2-CB 4.05Å; T72-K109 HydrophobicContact CG2-CD 4.42Å; T72-K109 HydrophobicContact CG2-CG 4.36Å; T72-L111 HydrophobicContact CG2-CD1 3.85Å; T72-L111 HydrophobicContact CG2-CG 4.17Å |
| 73 | I | 97.8 | Very high | 95 | Very high | 8 Ų | 8 | 74 Ų | 74 | 4% | 0.041 | 36% | 0.364 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119 | 140.3 | 168 | -170.4 | 169.1 | 0 | 0 | 0 | 110.2 | K77 V78 L81 V102 Y107 K109 V110 L111 | I73-K77 HydrophobicContact CD1-CB 4.38Å; I73-K77 HydrophobicContact CG1-CB 4.27Å; I73-V78 HydrophobicContact CD1-CG2 4.38Å; I73-V78 HydrophobicContact CG1-CG2 4.49Å; I73-V78 HydrophobicContact CG2-CG2 4.5Å; I73-L81 HydrophobicContact CD1-CD1 3.7Å; I73-L81 HydrophobicContact CD1-CD2 4.16Å; I73-L81 HydrophobicContact CD1-CG 3.99Å; I73-V102 HydrophobicContact CG2-CB 4.41Å; I73-V102 HydrophobicContact CG2-CG1 4.23Å; I73-Y107 HydrophobicContact CB-CD1 3.77Å; I73-Y107 HydrophobicContact CB-CD2 4.2Å; I73-Y107 HydrophobicContact CB-CE1 4.11Å; I73-Y107 HydrophobicContact CB-CG 3.8Å; I73-Y107 HydrophobicContact CD1-CD2 4.12Å; I73-Y107 HydrophobicContact CD1-CE2 4Å; I73-Y107 HydrophobicContact CG2-CD1 4.47Å; I73-Y107 HydrophobicContact CG2-CD2 4.5Å; I73-Y107 HydrophobicContact CG2-CG 4.09Å; I73-K109 PolarHBondContact N-O 2.93Å; I73-V110 HydrophobicContact CG2-CG2 4.02Å; I73-V110 CarbonylContact O-C 3.56Å; I73-V110 WeakPolarHBondContact O-CA 3.36Å; I73-L111 PolarHBondContact O-N 3.1Å |
| 74 | N | 97.9 | Very high | 94.8 | Very high | 42 Ų | 42 | 71.8 Ų | 71.8 | 23% | 0.225 | 36% | 0.36 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.1 | 144.9 | 172.1 | -75.5 | -55.7 | 0 | 0 | 0 | 110.7 | E76 K77 L111 K113 | N74-E76 HydrophobicContact CB-CG 4.24Å; N74-E76 PolarHBondContact O-N 3.33Å; N74-E76 VanDerWaalsContact O-N 3.11Å; N74-K77 PolarHBondContact O-N 3.44Å; N74-L111 WeakPolarHBondContact CA-O 3.3Å; N74-L111 WeakPolarHBondContact OD1-CB 3.43Å; N74-K113 HydrophobicContact CB-CB 4.01Å; N74-K113 VanDerWaalsContact CG-CB 3.48Å; N74-K113 WeakPolarHBondContact OD1-CB 3.11Å |
| 75 | I | 96.4 | Very high | 94.7 | Very high | 0 Ų | 0 | 73 Ų | 73 | 0% | 0 | 37% | 0.371 | C | S | . | . | G | 310 helix | trans | -48.3 | -39.2 | 178.6 | -83.5 | -174.8 | 0 | 0 | 0 | 113.8 | K77 V78 V110 L111 L116 A132 K135 I136 | I75-K77 PolarHBondContact O-N 3.19Å; I75-V78 WeakPolarHBondContact O-CB 3.36Å; I75-V78 PolarHBondContact O-N 3.45Å; I75-V78 VanDerWaalsContact O-N 3.17Å; I75-V110 HydrophobicContact CG1-CG1 3.75Å; I75-L111 WeakPolarHBondContact CG1-O 3.31Å; I75-L111 PolarHBondContact N-O 3.29Å; I75-L116 HydrophobicContact CG2-CB 4.43Å; I75-L116 HydrophobicContact CG2-CD1 3.76Å; I75-L116 HydrophobicContact CG2-CD2 3.47Å; I75-L116 VanDerWaalsContact CG2-CD2 3.47Å; I75-L116 HydrophobicContact CG2-CG 3.23Å; I75-A132 HydrophobicContact CD1-CB 3.62Å; I75-A132 VanDerWaalsContact CD1-O 3.28Å; I75-A132 WeakPolarHBondContact CD1-O 3.46Å; I75-A132 HydrophobicContact CG1-CB 4.2Å; I75-K135 HydrophobicContact CD1-CB 3.98Å; I75-I136 HydrophobicContact CD1-CD1 4.16Å; I75-I136 HydrophobicContact CD1-CG1 3.9Å |
| 76 | E | 95.2 | Very high | 94.5 | Very high | 77 Ų | 77 | 71.7 Ų | 71.7 | 36% | 0.36 | 36% | 0.363 | S | S | . | . | G | 310 helix | trans | -59.5 | -27.9 | 179.7 | 72.4 | -162.1 | 170.1 | 0 | 0 | 113.9 | N74 K113 G114 | N74-E76 HydrophobicContact CB-CG 4.24Å; N74-E76 PolarHBondContact O-N 3.33Å; N74-E76 VanDerWaalsContact O-N 3.11Å; E76-K113 PolarHBondContact N-O 3.3Å; E76-G114 WeakPolarHBondContact OE2-CA 3.48Å |
| 77 | K | 95.6 | Very high | 94.2 | Very high | 129 Ų | 129 | 69.9 Ų | 69.9 | 56% | 0.561 | 35% | 0.351 | S | S | * | . | G | 310 helix | trans | -97.3 | -5 | -178.6 | -63.3 | -165.2 | 174.3 | -173.5 | 0 | 113.5 | I73 N74 I75 W79 S80 | I73-K77 HydrophobicContact CD1-CB 4.38Å; I73-K77 HydrophobicContact CG1-CB 4.27Å; N74-K77 PolarHBondContact O-N 3.44Å; I75-K77 PolarHBondContact O-N 3.19Å; K77-W79 VanDerWaalsContact C-N 3.27Å; K77-W79 PolarHBondContact O-N 2.86Å; K77-S80 WeakPolarHBondContact O-CB 3.32Å; K77-S80 PolarHBondContact O-N 3.32Å |
| 78 | V | 95.3 | Very high | 94.1 | Very high | 0 Ų | 0 | 69.9 Ų | 69.9 | 0% | 0 | 35% | 0.346 | C | S | . | . | G | 310 helix | trans | -61.6 | -39 | -176 | 171 | 0 | 0 | 0 | 0 | 111.2 | I73 I75 S80 L81 I100 I123 | I73-V78 HydrophobicContact CD1-CG2 4.38Å; I73-V78 HydrophobicContact CG1-CG2 4.49Å; I73-V78 HydrophobicContact CG2-CG2 4.5Å; I75-V78 WeakPolarHBondContact O-CB 3.36Å; I75-V78 PolarHBondContact O-N 3.45Å; I75-V78 VanDerWaalsContact O-N 3.17Å; V78-S80 PolarHBondContact O-N 3.22Å; V78-L81 WeakPolarHBondContact O-CB 3.38Å; V78-L81 PolarHBondContact O-N 3.41Å; V78-I100 HydrophobicContact CG1-CB 4.36Å; V78-I100 HydrophobicContact CG1-CD1 3.61Å; V78-I100 HydrophobicContact CG1-CG2 4.05Å; V78-I123 HydrophobicContact CB-CD1 4.46Å; V78-I123 HydrophobicContact CG1-CD1 3.77Å; V78-I123 HydrophobicContact CG1-CG1 4.1Å; V78-I123 HydrophobicContact CG2-CD1 4.28Å |
| 79 | W | 93.3 | Very high | 94 | Very high | 16 Ų | 16 | 67.7 Ų | 67.7 | 6% | 0.061 | 34% | 0.343 | C | S | . | . | G | 310 helix | trans | -68.9 | -19.2 | 177.1 | -78.7 | 104.9 | 0 | 0 | 0 | 114.2 | K77 L81 L82 R87 P98 P117 Q119 V121 | K77-W79 VanDerWaalsContact C-N 3.27Å; K77-W79 PolarHBondContact O-N 2.86Å; W79-L81 PolarHBondContact O-N 3.49Å; W79-L82 HydrophobicContact CE3-CD1 4.05Å; W79-L82 HydrophobicContact CZ3-CD1 3.95Å; W79-L82 PolarHBondContact O-N 3.17Å; W79-R87 HydrophobicContact CD2-CG 4.29Å; W79-R87 HydrophobicContact CE3-CB 4.08Å; W79-R87 HydrophobicContact CE3-CG 3.63Å; W79-R87 HydrophobicContact CZ3-CB 4.34Å; W79-R87 HydrophobicContact CZ3-CG 4.05Å; W79-P98 HydrophobicContact CH2-CG 3.38Å; W79-P98 HydrophobicContact CZ2-CG 4.36Å; W79-P98 HydrophobicContact CZ3-CG 3.69Å; W79-P117 HydrophobicContact CG-CG 4.44Å; W79-Q119 HydrophobicContact CH2-CG 4.1Å; W79-Q119 HydrophobicContact CZ2-CG 3.56Å; W79-V121 HydrophobicContact CZ2-CB 3.78Å; W79-V121 HydrophobicContact CZ2-CG2 4.04Å |
| 80 | S | 93.7 | Very high | 93.7 | Very high | 97 Ų | 97 | 63.2 Ų | 63.2 | 68% | 0.678 | 33% | 0.327 | S | S | * | . | G | 310 helix | trans | -75.9 | -11.4 | 174.9 | -50.8 | 0 | 0 | 0 | 0 | 113 | K77 V78 L82 | K77-S80 WeakPolarHBondContact O-CB 3.32Å; K77-S80 PolarHBondContact O-N 3.32Å; V78-S80 PolarHBondContact O-N 3.22Å; S80-L82 VanDerWaalsContact C-N 3.26Å |
| 81 | L | 94.5 | Very high | 93.3 | Very high | 30 Ų | 30 | 63 Ų | 63 | 16% | 0.157 | 33% | 0.329 | C | S | . | . | G | 310 helix | trans | -75.1 | -20.2 | 173.9 | -62.9 | 177.8 | 0 | 0 | 0 | 112.6 | I73 V78 W79 I100 V102 Y105 Y107 | I73-L81 HydrophobicContact CD1-CD1 3.7Å; I73-L81 HydrophobicContact CD1-CD2 4.16Å; I73-L81 HydrophobicContact CD1-CG 3.99Å; V78-L81 WeakPolarHBondContact O-CB 3.38Å; V78-L81 PolarHBondContact O-N 3.41Å; W79-L81 PolarHBondContact O-N 3.49Å; L81-I100 HydrophobicContact CB-CG2 4.37Å; L81-I100 HydrophobicContact CD1-CG2 3.9Å; L81-V102 HydrophobicContact CD1-CG1 4Å; L81-Y105 HydrophobicContact CB-CD2 4.26Å; L81-Y105 HydrophobicContact CB-CE1 4.32Å; L81-Y105 HydrophobicContact CB-CE2 4.08Å; L81-Y105 HydrophobicContact CB-CG 4.47Å; L81-Y105 HydrophobicContact CD1-CD2 3.86Å; L81-Y105 HydrophobicContact CD1-CE2 4.36Å; L81-Y105 HydrophobicContact CD1-CG 4.19Å; L81-Y105 HydrophobicContact CD2-CD1 4.02Å; L81-Y105 HydrophobicContact CD2-CD2 4.33Å; L81-Y105 HydrophobicContact CD2-CG 3.86Å; L81-Y105 HydrophobicContact CG-CD2 4.39Å; L81-Y105 HydrophobicContact CG-CG 4.41Å; L81-Y105 PolarHBondContact O-OH 3.33Å; L81-Y105 VanDerWaalsContact O-OH 3.09Å; L81-Y107 HydrophobicContact CD2-CE2 4.12Å |
| 82 | L | 91.9 | Very high | 92.9 | Very high | 30 Ų | 30 | 70.7 Ų | 70.7 | 16% | 0.157 | 36% | 0.359 | C | S | . | . | S | Bend | trans | -96.9 | 147 | 176.2 | -66.4 | 177.4 | 0 | 0 | 0 | 110 | W79 S80 V86 P98 I100 | W79-L82 HydrophobicContact CE3-CD1 4.05Å; W79-L82 HydrophobicContact CZ3-CD1 3.95Å; W79-L82 PolarHBondContact O-N 3.17Å; S80-L82 VanDerWaalsContact C-N 3.26Å; L82-V86 HydrophobicContact CD1-CG1 4.32Å; L82-P98 HydrophobicContact CD1-CB 3.98Å; L82-P98 HydrophobicContact CD1-CG 4.2Å; L82-I100 HydrophobicContact CD1-CD1 3.57Å; L82-I100 HydrophobicContact CD1-CG1 3.68Å; L82-I100 HydrophobicContact CD2-CG1 4.31Å; L82-I100 HydrophobicContact CG-CD1 3.97Å; L82-I100 HydrophobicContact CG-CG1 3.98Å |
| 83 | P | 93.9 | Very high | 92.3 | Very high | 83 Ų | 83 | 70.8 Ų | 70.8 | 54% | 0.539 | 36% | 0.357 | S | S | . | . | trans | -55.7 | 147.2 | 167 | -21.6 | 32.5 | 0 | 0 | 0 | 111 | E85 V86 R87 | P83-E85 PolarHBondContact O-N 3.47Å; P83-V86 HydrophobicContact CB-CG2 4.31Å; P83-V86 HydrophobicContact CG-CG2 4.32Å; P83-V86 PolarHBondContact O-N 3.34Å; P83-R87 PolarHBondContact O-N 3.14Å | ||
| 84 | E | 91.6 | Very high | 91.6 | Very high | 106 Ų | 106 | 76.4 Ų | 76.4 | 50% | 0.495 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -62.7 | -31.8 | -175.5 | -170.5 | 176.8 | -178.7 | 0 | 0 | 112.7 | V86 R87 K88 | E84-V86 PolarHBondContact O-N 2.86Å; E84-R87 WeakPolarHBondContact O-CB 3.38Å; E84-R87 PolarHBondContact O-N 3.09Å; E84-R87 IonicContact OE1-NH2 3.37Å; E84-R87 PolarHBondContact OE1-NH2 2.98Å; E84-K88 HydrophobicContact CG-CD 4.35Å; E84-K88 WeakPolarHBondContact O-CG 3.21Å; E84-K88 PolarHBondContact O-N 3.39Å; E84-K88 WeakPolarHBondContact OE1-CE 3.43Å; E84-K88 IonicContact OE1-NZ 3.99Å; E84-K88 PolarHBondContact OE1-NZ 3.09Å; E84-K88 VanDerWaalsContact OE1-NZ 3.11Å; E84-K88 IonicContact OE2-NZ 3.11Å |
| 85 | E | 92.2 | Very high | 91.1 | Very high | 159 Ų | 159 | 79 Ų | 79 | 74% | 0.743 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -58.8 | -47.4 | 176.1 | -62.6 | -177.9 | 175.2 | 0 | 0 | 111.8 | P83 R87 K88 T89 | P83-E85 PolarHBondContact O-N 3.47Å; E85-R87 VanDerWaalsContact C-N 3.3Å; E85-R87 PolarHBondContact O-N 3.44Å; E85-K88 PolarHBondContact O-N 2.95Å; E85-K88 VanDerWaalsContact O-N 3.12Å; E85-T89 PolarHBondContact O-N 3.36Å; E85-T89 PolarHBondContact O-OG1 3.19Å |
| 86 | V | 90.9 | Very high | 90.7 | Very high | 48 Ų | 48 | 85.5 Ų | 85.5 | 29% | 0.291 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -62.9 | -40.3 | 177.4 | -176.9 | 0 | 0 | 0 | 0 | 110.2 | L82 P83 E84 K88 T89 Y90 | L82-V86 HydrophobicContact CD1-CG1 4.32Å; P83-V86 HydrophobicContact CB-CG2 4.31Å; P83-V86 HydrophobicContact CG-CG2 4.32Å; P83-V86 PolarHBondContact O-N 3.34Å; E84-V86 PolarHBondContact O-N 2.86Å; V86-K88 VanDerWaalsContact C-N 3.32Å; V86-K88 PolarHBondContact O-N 2.94Å; V86-T89 PolarHBondContact O-N 3.2Å; V86-T89 PolarHBondContact O-OG1 3.46Å; V86-Y90 HydrophobicContact CG1-CD2 3.77Å; V86-Y90 HydrophobicContact CG1-CE2 3.63Å; V86-Y90 WeakPolarHBondContact O-CD2 3.31Å; V86-Y90 PolarHBondContact O-N 3.28Å |
| 87 | R | 88.4 | Confident | 90.5 | Very high | 89 Ų | 89 | 83.3 Ų | 83.3 | 34% | 0.336 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -61.5 | -40.2 | 175.3 | -174.7 | -177.9 | 74.4 | 91.9 | -1.6 | 112 | W79 P83 E84 E85 A91 | W79-R87 HydrophobicContact CD2-CG 4.29Å; W79-R87 HydrophobicContact CE3-CB 4.08Å; W79-R87 HydrophobicContact CE3-CG 3.63Å; W79-R87 HydrophobicContact CZ3-CB 4.34Å; W79-R87 HydrophobicContact CZ3-CG 4.05Å; P83-R87 PolarHBondContact O-N 3.14Å; E84-R87 WeakPolarHBondContact O-CB 3.38Å; E84-R87 PolarHBondContact O-N 3.09Å; E84-R87 IonicContact OE1-NH2 3.37Å; E84-R87 PolarHBondContact OE1-NH2 2.98Å; E85-R87 VanDerWaalsContact C-N 3.3Å; E85-R87 PolarHBondContact O-N 3.44Å; R87-A91 WeakPolarHBondContact O-CB 3.49Å; R87-A91 PolarHBondContact O-N 3.33Å; R87-A91 VanDerWaalsContact O-N 3.14Å |
| 88 | K | 89.9 | Confident | 90.4 | Very high | 110 Ų | 110 | 77.5 Ų | 77.5 | 48% | 0.478 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -71.5 | -33.5 | -179.8 | -74.1 | 174.4 | -179.7 | 163.8 | 0 | 112.6 | E84 E85 V86 A91 K92 | E84-K88 HydrophobicContact CG-CD 4.35Å; E84-K88 WeakPolarHBondContact O-CG 3.21Å; E84-K88 PolarHBondContact O-N 3.39Å; E84-K88 WeakPolarHBondContact OE1-CE 3.43Å; E84-K88 IonicContact OE1-NZ 3.99Å; E84-K88 PolarHBondContact OE1-NZ 3.09Å; E84-K88 VanDerWaalsContact OE1-NZ 3.11Å; E84-K88 IonicContact OE2-NZ 3.11Å; E85-K88 PolarHBondContact O-N 2.95Å; E85-K88 VanDerWaalsContact O-N 3.12Å; V86-K88 VanDerWaalsContact C-N 3.32Å; V86-K88 PolarHBondContact O-N 2.94Å; K88-A91 PolarHBondContact O-N 3.27Å; K88-K92 PolarHBondContact O-N 3.01Å |
| 89 | T | 90.4 | Very high | 90.4 | Very high | 83 Ų | 83 | 81.1 Ų | 81.1 | 51% | 0.509 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -67.5 | -47.4 | 176.9 | 52.7 | 0 | 0 | 0 | 0 | 111.7 | E85 V86 A91 K92 D93 | E85-T89 PolarHBondContact O-N 3.36Å; E85-T89 PolarHBondContact O-OG1 3.19Å; V86-T89 PolarHBondContact O-N 3.2Å; V86-T89 PolarHBondContact O-OG1 3.46Å; T89-A91 PolarHBondContact O-N 3.31Å; T89-K92 PolarHBondContact O-N 3.27Å; T89-K92 VanDerWaalsContact O-N 3.11Å; T89-D93 PolarHBondContact O-N 3.08Å |
| 90 | Y | 88.1 | Confident | 90.5 | Very high | 74 Ų | 74 | 80.5 Ų | 80.5 | 29% | 0.29 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -71.9 | -13.5 | 175.8 | -71 | -72.9 | 0 | 0 | 0 | 114.1 | V86 K96 P98 | V86-Y90 HydrophobicContact CG1-CD2 3.77Å; V86-Y90 HydrophobicContact CG1-CE2 3.63Å; V86-Y90 WeakPolarHBondContact O-CD2 3.31Å; V86-Y90 PolarHBondContact O-N 3.28Å; Y90-K96 HydrophobicContact CD1-CB 4.34Å; Y90-K96 WeakPolarHBondContact CD1-O 3.35Å; Y90-K96 HydrophobicContact CE1-CB 3.92Å; Y90-P98 HydrophobicContact CD1-CG 4.44Å; Y90-P98 HydrophobicContact CD2-CB 3.81Å; Y90-P98 HydrophobicContact CD2-CG 3.88Å; Y90-P98 HydrophobicContact CE2-CB 3.75Å; Y90-P98 HydrophobicContact CE2-CG 4.32Å; Y90-P98 HydrophobicContact CG-CB 4.28Å; Y90-P98 HydrophobicContact CG-CG 3.97Å |
| 91 | A | 87.6 | Confident | 90.6 | Very high | 45 Ų | 45 | 77.7 Ų | 77.7 | 37% | 0.372 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -73.8 | -30.4 | 169.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | R87 K88 T89 Q119 | R87-A91 WeakPolarHBondContact O-CB 3.49Å; R87-A91 PolarHBondContact O-N 3.33Å; R87-A91 VanDerWaalsContact O-N 3.14Å; K88-A91 PolarHBondContact O-N 3.27Å; T89-A91 PolarHBondContact O-N 3.31Å; A91-Q119 VanDerWaalsContact CA-OE1 3.32Å |
| 92 | K | 87.9 | Confident | 90.7 | Very high | 189 Ų | 189 | 76.3 Ų | 76.3 | 82% | 0.822 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -80.9 | -47.9 | 178.8 | -67 | 179.4 | -178.8 | -176.6 | 0 | 111.7 | K88 T89 | K88-K92 PolarHBondContact O-N 3.01Å; T89-K92 PolarHBondContact O-N 3.27Å; T89-K92 VanDerWaalsContact O-N 3.11Å |
| 93 | D | 86.7 | Confident | 90.8 | Very high | 71 Ų | 71 | 77.1 Ų | 77.1 | 38% | 0.38 | 40% | 0.395 | S | S | . | . | trans | -104.6 | 106.2 | 177.9 | -177.3 | 4.5 | 0 | 0 | 0 | 110.8 | T89 S95 | T89-D93 PolarHBondContact O-N 3.08Å; D93-S95 VanDerWaalsContact OD1-CB 3.28Å; D93-S95 WeakPolarHBondContact OD1-CB 3.35Å; D93-S95 PolarHBondContact OD1-N 3.42Å; D93-S95 PolarHBondContact OD1-OG 3.02Å; D93-S95 PolarHBondContact OD2-OG 3.4Å | ||
| 94 | K | 82.8 | Confident | 90.8 | Very high | 127 Ų | 127 | 81.5 Ų | 81.5 | 55% | 0.552 | 41% | 0.406 | S | S | * | . | trans | -87.5 | -4.3 | 179.6 | -62.5 | -177 | -176.1 | 179.6 | 0 | 113.5 | K96 | K94-K96 VanDerWaalsContact C-N 3.26Å; K94-K96 PolarHBondContact O-N 3.32Å | ||
| 95 | S | 86.2 | Confident | 91 | Very high | 96 Ų | 96 | 81.5 Ų | 81.5 | 67% | 0.671 | 40% | 0.402 | S | S | * | . | S | Bend | trans | -70.3 | -27.6 | 178.8 | 73.3 | 0 | 0 | 0 | 0 | 111.9 | D93 | D93-S95 VanDerWaalsContact OD1-CB 3.28Å; D93-S95 WeakPolarHBondContact OD1-CB 3.35Å; D93-S95 PolarHBondContact OD1-N 3.42Å; D93-S95 PolarHBondContact OD1-OG 3.02Å; D93-S95 PolarHBondContact OD2-OG 3.4Å |
| 96 | K | 87.8 | Confident | 91.1 | Very high | 137 Ų | 137 | 75.9 Ų | 75.9 | 60% | 0.596 | 39% | 0.387 | S | S | * | . | S | Bend | trans | -111.7 | 144.2 | 179.2 | -63.7 | 174.9 | -175.4 | 172.2 | 0 | 110 | Y90 K94 | Y90-K96 HydrophobicContact CD1-CB 4.34Å; Y90-K96 WeakPolarHBondContact CD1-O 3.35Å; Y90-K96 HydrophobicContact CE1-CB 3.92Å; K94-K96 VanDerWaalsContact C-N 3.26Å; K94-K96 PolarHBondContact O-N 3.32Å |
| 97 | A | 91.4 | Very high | 91.4 | Very high | 30 Ų | 30 | 77.3 Ų | 77.3 | 25% | 0.248 | 39% | 0.388 | C | S | . | . | trans | -119.5 | 133.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | P120 I122 | A97-P120 HydrophobicContact CB-CB 4.07Å; A97-P120 HydrophobicContact CB-CG 4.27Å; A97-I122 HydrophobicContact CB-CD1 4.09Å; A97-I122 HydrophobicContact CB-CG1 3.93Å | ||
| 98 | P | 94.1 | Very high | 91.8 | Very high | 7 Ų | 7 | 75.1 Ų | 75.1 | 5% | 0.045 | 38% | 0.381 | C | S | . | . | trans | -70.3 | 142.2 | 175.8 | 26.2 | -28.7 | 0 | 0 | 0 | 110.6 | W79 L82 Y90 I122 | W79-P98 HydrophobicContact CH2-CG 3.38Å; W79-P98 HydrophobicContact CZ2-CG 4.36Å; W79-P98 HydrophobicContact CZ3-CG 3.69Å; L82-P98 HydrophobicContact CD1-CB 3.98Å; L82-P98 HydrophobicContact CD1-CG 4.2Å; Y90-P98 HydrophobicContact CD1-CG 4.44Å; Y90-P98 HydrophobicContact CD2-CB 3.81Å; Y90-P98 HydrophobicContact CD2-CG 3.88Å; Y90-P98 HydrophobicContact CE2-CB 3.75Å; Y90-P98 HydrophobicContact CE2-CG 4.32Å; Y90-P98 HydrophobicContact CG-CB 4.28Å; Y90-P98 HydrophobicContact CG-CG 3.97Å; P98-I122 PolarHBondContact O-N 3.06Å | ||
| 99 | V | 94.6 | Very high | 92.1 | Very high | 77 Ų | 77 | 73.5 Ų | 73.5 | 47% | 0.467 | 37% | 0.374 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.2 | 109.4 | 173.6 | -178.4 | 0 | 0 | 0 | 0 | 109.3 | I122 K124 | V99-I122 CarbonylContact C-O 3.59Å; V99-I122 WeakPolarHBondContact CA-O 3.33Å; V99-I122 HydrophobicContact CG1-CG2 4.38Å; V99-I122 HydrophobicContact CG2-CB 4.07Å; V99-I122 HydrophobicContact CG2-CD1 4.13Å; V99-I122 HydrophobicContact CG2-CG2 4.16Å; V99-K124 HydrophobicContact CG1-CD 3.75Å; V99-K124 HydrophobicContact CG1-CG 4.13Å |
| 100 | I | 95.6 | Very high | 92.5 | Very high | 2 Ų | 2 | 69.5 Ų | 69.5 | 1% | 0.01 | 35% | 0.35 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.8 | 107.1 | 177.8 | -57 | 175.2 | 0 | 0 | 0 | 108.6 | V78 L81 L82 V102 V121 I122 I123 K124 | V78-I100 HydrophobicContact CG1-CB 4.36Å; V78-I100 HydrophobicContact CG1-CD1 3.61Å; V78-I100 HydrophobicContact CG1-CG2 4.05Å; L81-I100 HydrophobicContact CB-CG2 4.37Å; L81-I100 HydrophobicContact CD1-CG2 3.9Å; L82-I100 HydrophobicContact CD1-CD1 3.57Å; L82-I100 HydrophobicContact CD1-CG1 3.68Å; L82-I100 HydrophobicContact CD2-CG1 4.31Å; L82-I100 HydrophobicContact CG-CD1 3.97Å; L82-I100 HydrophobicContact CG-CG1 3.98Å; I100-V102 HydrophobicContact CG2-CG1 4.17Å; I100-V102 PolarHBondContact O-N 3.11Å; I100-V121 HydrophobicContact CD1-CG2 3.62Å; I100-V121 HydrophobicContact CG1-CG2 4.16Å; I100-I122 PolarHBondContact N-O 3.21Å; I100-I123 WeakPolarHBondContact O-CA 3.36Å; I100-K124 PolarHBondContact O-N 2.85Å |
| 101 | N | 95.7 | Very high | 93 | Very high | 39 Ų | 39 | 68.3 Ų | 68.3 | 21% | 0.209 | 35% | 0.348 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.2 | 100.6 | 173.4 | -175.1 | -7.9 | 0 | 0 | 0 | 110.3 | L103 K104 Y105 K124 | N101-L103 PolarHBondContact O-N 3.49Å; N101-L103 WeakPolarHBondContact OD1-CB 3.22Å; N101-L103 PolarHBondContact OD1-N 3.37Å; N101-K104 HydrophobicContact CB-CD 4.34Å; N101-K104 HydrophobicContact CB-CG 4.23Å; N101-K104 PolarHBondContact O-N 3.22Å; N101-Y105 WeakPolarHBondContact O-CD2 3.17Å; N101-K124 HydrophobicContact CB-CB 4.25Å |
| 102 | V | 96.5 | Very high | 93.4 | Very high | 0 Ų | 0 | 66.5 Ų | 66.5 | 0% | 0 | 33% | 0.334 | C | S | . | . | G | 310 helix | trans | -71.4 | -19.9 | -176.9 | -54.9 | 0 | 0 | 0 | 0 | 112.8 | I73 L81 I100 K104 Y105 G106 Y107 V110 I123 K124 A125 | I73-V102 HydrophobicContact CG2-CB 4.41Å; I73-V102 HydrophobicContact CG2-CG1 4.23Å; L81-V102 HydrophobicContact CD1-CG1 4Å; I100-V102 HydrophobicContact CG2-CG1 4.17Å; I100-V102 PolarHBondContact O-N 3.11Å; V102-K104 VanDerWaalsContact C-N 3.31Å; V102-K104 PolarHBondContact O-N 3.04Å; V102-Y105 CarbonylContact O-C 3.57Å; V102-Y105 PolarHBondContact O-N 3.23Å; V102-G106 PolarHBondContact O-N 3.34Å; V102-Y107 CarbonylContact C-O 3.54Å; V102-Y107 PolarHBondContact O-N 3.27Å; V102-V110 HydrophobicContact CG1-CG2 4.38Å; V102-V110 HydrophobicContact CG2-CG2 3.99Å; V102-I123 HydrophobicContact CG1-CG2 3.94Å; V102-K124 WeakPolarHBondContact CG2-O 3.4Å; V102-K124 PolarHBondContact N-O 3.37Å; V102-A125 HydrophobicContact CG2-CB 3.5Å; V102-A125 VanDerWaalsContact CG2-CB 3.5Å |
| 103 | L | 94.7 | Very high | 93.9 | Very high | 47 Ų | 47 | 63.8 Ų | 63.8 | 25% | 0.246 | 32% | 0.322 | C | S | . | . | G | 310 helix | trans | -63.6 | -38.1 | 174 | -81 | 70.4 | 0 | 0 | 0 | 111.5 | N101 Y105 G106 Y107 K126 V146 | N101-L103 PolarHBondContact O-N 3.49Å; N101-L103 WeakPolarHBondContact OD1-CB 3.22Å; N101-L103 PolarHBondContact OD1-N 3.37Å; L103-Y105 PolarHBondContact O-N 3.24Å; L103-G106 PolarHBondContact O-N 3.49Å; L103-Y107 WeakPolarHBondContact CA-O 3.44Å; L103-Y107 PolarHBondContact N-O 3.03Å; L103-K126 HydrophobicContact CD1-CG 4.13Å; L103-K126 HydrophobicContact CD2-CD 4.49Å; L103-K126 HydrophobicContact CD2-CG 4.03Å; L103-K126 HydrophobicContact CG-CG 4.3Å; L103-V146 HydrophobicContact CD2-CG1 4.18Å |
| 104 | K | 94.2 | Very high | 94.3 | Very high | 176 Ų | 176 | 61.5 Ų | 61.5 | 77% | 0.765 | 32% | 0.315 | S | S | * | . | G | 310 helix | trans | -61.4 | -27 | 178.1 | -71.6 | -172.2 | 175.1 | -171.3 | 0 | 112.4 | N101 V102 | N101-K104 HydrophobicContact CB-CD 4.34Å; N101-K104 HydrophobicContact CB-CG 4.23Å; N101-K104 PolarHBondContact O-N 3.22Å; V102-K104 VanDerWaalsContact C-N 3.31Å; V102-K104 PolarHBondContact O-N 3.04Å |
| 105 | Y | 95.4 | Very high | 94.8 | Very high | 106 Ų | 106 | 66 Ų | 66 | 42% | 0.416 | 33% | 0.329 | S | S | . | . | G | 310 helix | trans | -95.5 | 10.6 | 177.2 | -57.5 | -84 | 0 | 0 | 0 | 112.8 | L81 N101 V102 L103 Y107 | L81-Y105 HydrophobicContact CB-CD2 4.26Å; L81-Y105 HydrophobicContact CB-CE1 4.32Å; L81-Y105 HydrophobicContact CB-CE2 4.08Å; L81-Y105 HydrophobicContact CB-CG 4.47Å; L81-Y105 HydrophobicContact CD1-CD2 3.86Å; L81-Y105 HydrophobicContact CD1-CE2 4.36Å; L81-Y105 HydrophobicContact CD1-CG 4.19Å; L81-Y105 HydrophobicContact CD2-CD1 4.02Å; L81-Y105 HydrophobicContact CD2-CD2 4.33Å; L81-Y105 HydrophobicContact CD2-CG 3.86Å; L81-Y105 HydrophobicContact CG-CD2 4.39Å; L81-Y105 HydrophobicContact CG-CG 4.41Å; L81-Y105 PolarHBondContact O-OH 3.33Å; L81-Y105 VanDerWaalsContact O-OH 3.09Å; N101-Y105 WeakPolarHBondContact O-CD2 3.17Å; V102-Y105 CarbonylContact O-C 3.57Å; V102-Y105 PolarHBondContact O-N 3.23Å; L103-Y105 PolarHBondContact O-N 3.24Å; Y105-Y107 WeakPolarHBondContact O-CD2 3.37Å; Y105-Y107 WeakPolarHBondContact O-CE2 3.24Å |
| 106 | G | 94.9 | Very high | 95.2 | Very high | 41 Ų | 41 | 62.2 Ų | 62.2 | 42% | 0.423 | 30% | 0.301 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 82.7 | 14.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | P71 V102 L103 | P71-G106 WeakPolarHBondContact CB-O 3.36Å; P71-G106 VanDerWaalsContact CG-O 3.3Å; P71-G106 WeakPolarHBondContact CG-O 3.46Å; V102-G106 PolarHBondContact O-N 3.34Å; L103-G106 PolarHBondContact O-N 3.49Å |
| 107 | Y | 97 | Very high | 95.4 | Very high | 78 Ų | 78 | 58.2 Ų | 58.2 | 31% | 0.306 | 29% | 0.289 | S | S | . | . | trans | -105.7 | 138.8 | 177.3 | -56.8 | -79.3 | 0 | 0 | 0 | 112.2 | P71 I73 L81 V102 L103 Y105 | P71-Y107 HydrophobicContact CB-CD1 4.19Å; I73-Y107 HydrophobicContact CB-CD1 3.77Å; I73-Y107 HydrophobicContact CB-CD2 4.2Å; I73-Y107 HydrophobicContact CB-CE1 4.11Å; I73-Y107 HydrophobicContact CB-CG 3.8Å; I73-Y107 HydrophobicContact CD1-CD2 4.12Å; I73-Y107 HydrophobicContact CD1-CE2 4Å; I73-Y107 HydrophobicContact CG2-CD1 4.47Å; I73-Y107 HydrophobicContact CG2-CD2 4.5Å; I73-Y107 HydrophobicContact CG2-CG 4.09Å; L81-Y107 HydrophobicContact CD2-CE2 4.12Å; V102-Y107 CarbonylContact C-O 3.54Å; V102-Y107 PolarHBondContact O-N 3.27Å; L103-Y107 WeakPolarHBondContact CA-O 3.44Å; L103-Y107 PolarHBondContact N-O 3.03Å; Y105-Y107 WeakPolarHBondContact O-CD2 3.37Å; Y105-Y107 WeakPolarHBondContact O-CE2 3.24Å | ||
| 108 | H | 96 | Very high | 95.3 | Very high | 42 Ų | 42 | 63.3 Ų | 63.3 | 19% | 0.194 | 31% | 0.312 | C | S | . | . | trans | -102.6 | -37.3 | 179.3 | -69.2 | 179.9 | 0 | 0 | 0 | 112.2 | W69 P71 K126 F127 | W69-H108 PolarHBondContact O-CE1 3.35Å; W69-H108 PolarHBondContact O-ND1 2.89Å; P71-H108 PolarHBondContact O-N 3.41Å; H108-K126 WeakPolarHBondContact O-CB 3.44Å; H108-K126 PolarHBondContact O-N 3.41Å; H108-F127 PolarHBondContact O-N 2.89Å | ||
| 109 | K | 97.1 | Very high | 95.2 | Very high | 76 Ų | 76 | 63.4 Ų | 63.4 | 33% | 0.33 | 31% | 0.312 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.5 | 132.3 | -171.4 | -178.8 | 169 | -172.4 | 175.1 | 0 | 112.9 | P71 T72 I73 L111 F127 | P71-K109 PolarHBondContact O-N 3.27Å; T72-K109 CarbonylContact C-O 3.58Å; T72-K109 VanDerWaalsContact CA-O 3.24Å; T72-K109 WeakPolarHBondContact CA-O 3.29Å; T72-K109 HydrophobicContact CG2-CB 4.05Å; T72-K109 HydrophobicContact CG2-CD 4.42Å; T72-K109 HydrophobicContact CG2-CG 4.36Å; I73-K109 PolarHBondContact N-O 2.93Å; K109-L111 HydrophobicContact CD-CD2 4.22Å; K109-L111 HydrophobicContact CG-CD2 4.14Å; K109-F127 CarbonylContact C-O 3.36Å; K109-F127 VanDerWaalsContact CA-O 3.31Å; K109-F127 WeakPolarHBondContact CA-O 3.2Å; K109-F127 HydrophobicContact CB-CB 3.91Å; K109-F127 HydrophobicContact CB-CD2 4.41Å; K109-F127 HydrophobicContact CD-CB 4.11Å; K109-F127 HydrophobicContact CG-CB 3.8Å |
| 110 | V | 98 | Very high | 95.1 | Very high | 0 Ų | 0 | 60.8 Ų | 60.8 | 0% | 0 | 30% | 0.296 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.2 | 125.1 | 175.5 | -176.6 | 0 | 0 | 0 | 0 | 110.1 | I73 I75 V102 I123 A125 F127 F128 S129 A132 | I73-V110 HydrophobicContact CG2-CG2 4.02Å; I73-V110 CarbonylContact O-C 3.56Å; I73-V110 WeakPolarHBondContact O-CA 3.36Å; I75-V110 HydrophobicContact CG1-CG1 3.75Å; V102-V110 HydrophobicContact CG1-CG2 4.38Å; V102-V110 HydrophobicContact CG2-CG2 3.99Å; V110-I123 HydrophobicContact CG2-CG2 3.96Å; V110-A125 HydrophobicContact CG2-CB 3.69Å; V110-F127 PolarHBondContact N-O 2.89Å; V110-F128 HydrophobicContact CB-CD1 3.68Å; V110-F128 HydrophobicContact CB-CE1 3.81Å; V110-F128 HydrophobicContact CG1-CD1 4.23Å; V110-F128 HydrophobicContact CG1-CE1 4.31Å; V110-F128 HydrophobicContact CG2-CD1 4.13Å; V110-F128 HydrophobicContact CG2-CE1 3.76Å; V110-F128 HydrophobicContact CG2-CZ 4.45Å; V110-S129 PolarHBondContact O-N 3.34Å; V110-A132 HydrophobicContact CG1-CB 4.24Å |
| 111 | L | 98.4 | Very high | 95.1 | Very high | 49 Ų | 49 | 60.7 Ų | 60.7 | 26% | 0.257 | 30% | 0.296 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.1 | 153.1 | -178.9 | -64.6 | -177.8 | 0 | 0 | 0 | 111.6 | T72 I73 N74 I75 K109 K113 | T72-L111 HydrophobicContact CG2-CD1 3.85Å; T72-L111 HydrophobicContact CG2-CG 4.17Å; I73-L111 PolarHBondContact O-N 3.1Å; N74-L111 WeakPolarHBondContact CA-O 3.3Å; N74-L111 WeakPolarHBondContact OD1-CB 3.43Å; I75-L111 WeakPolarHBondContact CG1-O 3.31Å; I75-L111 PolarHBondContact N-O 3.29Å; K109-L111 HydrophobicContact CD-CD2 4.22Å; K109-L111 HydrophobicContact CG-CD2 4.14Å; L111-K113 PolarHBondContact O-N 3.11Å |
| 112 | G | 96.7 | Very high | 95.1 | Very high | 7 Ų | 7 | 61 Ų | 61 | 7% | 0.072 | 30% | 0.297 | C | S | . | . | trans | -94 | 23.7 | -166.6 | 0 | 0 | 0 | 0 | 0 | 116.1 | S129 K135 | G112-S129 PolarHBondContact N-OG 3.32Å; G112-K135 PolarHBondContact O-NZ 2.91Å | ||
| 113 | K | 97.9 | Very high | 95.1 | Very high | 131 Ų | 131 | 61 Ų | 61 | 57% | 0.57 | 30% | 0.297 | S | S | * | . | trans | -72.5 | 143.5 | 174.7 | -169 | -174.6 | 172.7 | -171.9 | 0 | 110.7 | N74 E76 L111 | N74-K113 HydrophobicContact CB-CB 4.01Å; N74-K113 VanDerWaalsContact CG-CB 3.48Å; N74-K113 WeakPolarHBondContact OD1-CB 3.11Å; E76-K113 PolarHBondContact N-O 3.3Å; L111-K113 PolarHBondContact O-N 3.11Å | ||
| 114 | G | 95.5 | Very high | 95.2 | Very high | 24 Ų | 24 | 62.4 Ų | 62.4 | 25% | 0.247 | 30% | 0.301 | C | S | . | . | S | Bend | trans | 77.9 | -161.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | E76 K135 | E76-G114 WeakPolarHBondContact OE2-CA 3.48Å; G114-K135 PolarHBondContact O-NZ 3.24Å |
| 115 | R | 93.8 | Very high | 95.4 | Very high | 221 Ų | 221 | 54 Ų | 54 | 83% | 0.834 | 27% | 0.265 | S | S | * | . | trans | -127.9 | 149.7 | -176.7 | -64.1 | -178.9 | -177.2 | -179.3 | -2 | 109.9 | ||||
| 116 | L | 93.3 | Very high | 95.4 | Very high | 17 Ų | 17 | 52 Ų | 52 | 9% | 0.089 | 26% | 0.258 | C | S | . | . | trans | -90 | 147.1 | 165.8 | -74.5 | 168.3 | 0 | 0 | 0 | 109.2 | I75 V121 I136 V139 | I75-L116 HydrophobicContact CG2-CB 4.43Å; I75-L116 HydrophobicContact CG2-CD1 3.76Å; I75-L116 HydrophobicContact CG2-CD2 3.47Å; I75-L116 VanDerWaalsContact CG2-CD2 3.47Å; I75-L116 HydrophobicContact CG2-CG 3.23Å; L116-V121 HydrophobicContact CD1-CG1 4.07Å; L116-I136 HydrophobicContact CD1-CG1 4.03Å; L116-V139 HydrophobicContact CB-CG1 3.82Å; L116-V139 HydrophobicContact CB-CG2 4.11Å; L116-V139 HydrophobicContact CD1-CG2 3.64Å; L116-V139 HydrophobicContact CG-CG2 4.48Å | ||
| 117 | P | 92.3 | Very high | 95.5 | Very high | 53 Ų | 53 | 55.2 Ų | 55.2 | 34% | 0.344 | 26% | 0.261 | S | S | . | . | trans | -60 | 155.2 | 162.8 | 26.7 | -32.5 | 0 | 0 | 0 | 110.4 | W79 Q119 | W79-P117 HydrophobicContact CG-CG 4.44Å; P117-Q119 HydrophobicContact CB-CG 3.97Å; P117-Q119 HydrophobicContact CG-CG 3.69Å; P117-Q119 PolarHBondContact O-N 3.13Å | ||
| 118 | N | 90.2 | Very high | 95.5 | Very high | 136 Ų | 136 | 53.2 Ų | 53.2 | 73% | 0.727 | 25% | 0.254 | S | S | * | . | S | Bend | trans | -73.5 | 59.9 | 177.2 | -77.4 | -8.8 | 0 | 0 | 0 | 111.8 | ||
| 119 | Q | 90.9 | Very high | 95.6 | Very high | 10 Ų | 10 | 52.6 Ų | 52.6 | 5% | 0.047 | 25% | 0.254 | C | S | . | . | S | Bend | trans | -138.9 | 136.5 | 174 | 55.2 | -176.9 | 20.7 | 0 | 0 | 108.8 | W79 A91 P117 | W79-Q119 HydrophobicContact CH2-CG 4.1Å; W79-Q119 HydrophobicContact CZ2-CG 3.56Å; A91-Q119 VanDerWaalsContact CA-OE1 3.32Å; P117-Q119 HydrophobicContact CB-CG 3.97Å; P117-Q119 HydrophobicContact CG-CG 3.69Å; P117-Q119 PolarHBondContact O-N 3.13Å |
| 120 | P | 93.9 | Very high | 95.6 | Very high | 21 Ų | 21 | 58.2 Ų | 58.2 | 14% | 0.136 | 28% | 0.278 | C | S | . | . | trans | -67.9 | 144.4 | -176.3 | 28 | -33.9 | 0 | 0 | 0 | 111 | A97 V139 G140 | A97-P120 HydrophobicContact CB-CB 4.07Å; A97-P120 HydrophobicContact CB-CG 4.27Å; P120-V139 WeakPolarHBondContact CA-O 3.44Å; P120-G140 WeakPolarHBondContact CB-O 3.4Å | ||
| 121 | V | 95.1 | Very high | 95.6 | Very high | 0 Ų | 0 | 66.5 Ų | 66.5 | 0% | 0 | 31% | 0.31 | C | S | . | . | trans | -144.4 | 135.1 | 179.6 | 63.6 | 0 | 0 | 0 | 0 | 110.8 | W79 I100 L116 I123 G141 A142 | W79-V121 HydrophobicContact CZ2-CB 3.78Å; W79-V121 HydrophobicContact CZ2-CG2 4.04Å; I100-V121 HydrophobicContact CD1-CG2 3.62Å; I100-V121 HydrophobicContact CG1-CG2 4.16Å; L116-V121 HydrophobicContact CD1-CG1 4.07Å; V121-I123 HydrophobicContact CG1-CD1 4.11Å; V121-I123 HydrophobicContact CG1-CG1 4.19Å; V121-I123 HydrophobicContact CG2-CG1 3.94Å; V121-G141 CarbonylContact O-C 3.59Å; V121-G141 WeakPolarHBondContact O-CA 3.46Å; V121-A142 PolarHBondContact O-N 2.97Å | ||
| 122 | I | 95.6 | Very high | 95.6 | Very high | 46 Ų | 46 | 64.2 Ų | 64.2 | 24% | 0.236 | 30% | 0.298 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.6 | 116.8 | 175 | -59.2 | 172.1 | 0 | 0 | 0 | 107.3 | A97 P98 V99 I100 A142 L144 | A97-I122 HydrophobicContact CB-CD1 4.09Å; A97-I122 HydrophobicContact CB-CG1 3.93Å; P98-I122 PolarHBondContact O-N 3.06Å; V99-I122 CarbonylContact C-O 3.59Å; V99-I122 WeakPolarHBondContact CA-O 3.33Å; V99-I122 HydrophobicContact CG1-CG2 4.38Å; V99-I122 HydrophobicContact CG2-CB 4.07Å; V99-I122 HydrophobicContact CG2-CD1 4.13Å; V99-I122 HydrophobicContact CG2-CG2 4.16Å; I100-I122 PolarHBondContact N-O 3.21Å; I122-A142 CarbonylContact C-O 3.46Å; I122-A142 WeakPolarHBondContact CA-O 3.49Å; I122-A142 HydrophobicContact CG1-CB 4.33Å; I122-A142 HydrophobicContact CG2-CB 4.49Å; I122-L144 HydrophobicContact CG2-CD1 3.46Å; I122-L144 VanDerWaalsContact CG2-CD1 3.46Å; I122-L144 HydrophobicContact CG2-CG 3.98Å |
| 123 | I | 96.8 | Very high | 95.6 | Very high | 0 Ų | 0 | 67.2 Ų | 67.2 | 0% | 0 | 31% | 0.31 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.7 | 125.3 | -178.2 | -57.9 | 173.9 | 0 | 0 | 0 | 108.7 | V78 I100 V102 V110 V121 F128 I136 A142 L144 | V78-I123 HydrophobicContact CB-CD1 4.46Å; V78-I123 HydrophobicContact CG1-CD1 3.77Å; V78-I123 HydrophobicContact CG1-CG1 4.1Å; V78-I123 HydrophobicContact CG2-CD1 4.28Å; I100-I123 WeakPolarHBondContact O-CA 3.36Å; V102-I123 HydrophobicContact CG1-CG2 3.94Å; V110-I123 HydrophobicContact CG2-CG2 3.96Å; V121-I123 HydrophobicContact CG1-CD1 4.11Å; V121-I123 HydrophobicContact CG1-CG1 4.19Å; V121-I123 HydrophobicContact CG2-CG1 3.94Å; I123-F128 HydrophobicContact CB-CE1 4.09Å; I123-F128 HydrophobicContact CB-CZ 4.26Å; I123-F128 HydrophobicContact CG2-CE1 3.79Å; I123-F128 HydrophobicContact CG2-CZ 3.98Å; I123-F128 WeakPolarHBondContact O-CZ 3.26Å; I123-I136 HydrophobicContact CD1-CD1 3.7Å; I123-I136 HydrophobicContact CD1-CG1 3.89Å; I123-A142 PolarHBondContact N-O 3.18Å; I123-L144 PolarHBondContact O-N 3.48Å |
| 124 | K | 97.1 | Very high | 95.5 | Very high | 77 Ų | 77 | 63 Ų | 63 | 34% | 0.335 | 30% | 0.303 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.6 | 118.2 | 173.5 | -73.7 | 179.3 | 178.7 | -174.5 | 0 | 109.6 | V99 I100 N101 V102 L144 V146 | V99-K124 HydrophobicContact CG1-CD 3.75Å; V99-K124 HydrophobicContact CG1-CG 4.13Å; I100-K124 PolarHBondContact O-N 2.85Å; N101-K124 HydrophobicContact CB-CB 4.25Å; V102-K124 WeakPolarHBondContact CG2-O 3.4Å; V102-K124 PolarHBondContact N-O 3.37Å; K124-L144 WeakPolarHBondContact CA-O 3.42Å; K124-L144 HydrophobicContact CG-CB 3.84Å; K124-L144 HydrophobicContact CG-CD1 3.99Å; K124-V146 HydrophobicContact CB-CG2 3.8Å; K124-V146 HydrophobicContact CG-CG2 4.29Å |
| 125 | A | 97.1 | Very high | 95.6 | Very high | 0 Ų | 0 | 64 Ų | 64 | 0% | 0 | 30% | 0.301 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.5 | 163.9 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | V102 V110 F128 L144 L145 V146 | V102-A125 HydrophobicContact CG2-CB 3.5Å; V102-A125 VanDerWaalsContact CG2-CB 3.5Å; V110-A125 HydrophobicContact CG2-CB 3.69Å; A125-F128 HydrophobicContact CB-CD2 4.42Å; A125-F128 HydrophobicContact CB-CE1 4.04Å; A125-F128 HydrophobicContact CB-CE2 3.67Å; A125-F128 HydrophobicContact CB-CZ 3.44Å; A125-F128 VanDerWaalsContact CB-CZ 3.44Å; A125-L144 PolarHBondContact N-O 3.34Å; A125-L145 WeakPolarHBondContact O-CA 3.48Å; A125-V146 PolarHBondContact O-N 3.34Å |
| 126 | K | 95.8 | Very high | 95.7 | Very high | 63 Ų | 63 | 53.5 Ų | 53.5 | 27% | 0.274 | 26% | 0.261 | S | S | . | . | S | Bend | trans | -74.3 | -34.8 | 172.2 | -72.3 | -170 | 169 | -178.8 | 0 | 112 | L103 H108 L145 | L103-K126 HydrophobicContact CD1-CG 4.13Å; L103-K126 HydrophobicContact CD2-CD 4.49Å; L103-K126 HydrophobicContact CD2-CG 4.03Å; L103-K126 HydrophobicContact CG-CG 4.3Å; H108-K126 WeakPolarHBondContact O-CB 3.44Å; H108-K126 PolarHBondContact O-N 3.41Å; K126-L145 WeakPolarHBondContact O-CD2 3.47Å |
| 127 | F | 96.7 | Very high | 95.8 | Very high | 109 Ų | 109 | 58.7 Ų | 58.7 | 48% | 0.478 | 28% | 0.283 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.2 | 145.6 | -177.5 | -53.3 | -72.9 | 0 | 0 | 0 | 112 | H108 K109 V110 | H108-F127 PolarHBondContact O-N 2.89Å; K109-F127 CarbonylContact C-O 3.36Å; K109-F127 VanDerWaalsContact CA-O 3.31Å; K109-F127 WeakPolarHBondContact CA-O 3.2Å; K109-F127 HydrophobicContact CB-CB 3.91Å; K109-F127 HydrophobicContact CB-CD2 4.41Å; K109-F127 HydrophobicContact CD-CB 4.11Å; K109-F127 HydrophobicContact CG-CB 3.8Å; V110-F127 PolarHBondContact N-O 2.89Å |
| 128 | F | 97.6 | Very high | 96 | Very high | 36 Ų | 36 | 65.1 Ų | 65.1 | 16% | 0.158 | 31% | 0.306 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125 | 145.6 | 169.8 | -67 | -89.3 | 0 | 0 | 0 | 109.9 | V110 I123 A125 I136 A143 L144 L145 | V110-F128 HydrophobicContact CB-CD1 3.68Å; V110-F128 HydrophobicContact CB-CE1 3.81Å; V110-F128 HydrophobicContact CG1-CD1 4.23Å; V110-F128 HydrophobicContact CG1-CE1 4.31Å; V110-F128 HydrophobicContact CG2-CD1 4.13Å; V110-F128 HydrophobicContact CG2-CE1 3.76Å; V110-F128 HydrophobicContact CG2-CZ 4.45Å; I123-F128 HydrophobicContact CB-CE1 4.09Å; I123-F128 HydrophobicContact CB-CZ 4.26Å; I123-F128 HydrophobicContact CG2-CE1 3.79Å; I123-F128 HydrophobicContact CG2-CZ 3.98Å; I123-F128 WeakPolarHBondContact O-CZ 3.26Å; A125-F128 HydrophobicContact CB-CD2 4.42Å; A125-F128 HydrophobicContact CB-CE1 4.04Å; A125-F128 HydrophobicContact CB-CE2 3.67Å; A125-F128 HydrophobicContact CB-CZ 3.44Å; A125-F128 VanDerWaalsContact CB-CZ 3.44Å; F128-I136 HydrophobicContact CD1-CD1 3.95Å; F128-I136 HydrophobicContact CE1-CD1 3.88Å; F128-A143 HydrophobicContact CD1-CB 3.98Å; F128-A143 HydrophobicContact CD2-CB 4.13Å; F128-A143 HydrophobicContact CE1-CB 3.87Å; F128-A143 HydrophobicContact CE2-CB 4.03Å; F128-A143 HydrophobicContact CG-CB 4.13Å; F128-A143 HydrophobicContact CZ-CB 3.9Å; F128-L144 WeakPolarHBondContact CE2-O 3.43Å; F128-L145 HydrophobicContact CD2-CD2 3.75Å; F128-L145 HydrophobicContact CD2-CG 4.44Å; F128-L145 HydrophobicContact CE2-CD2 4.1Å |
| 129 | S | 98 | Very high | 96.1 | Very high | 29 Ų | 29 | 59.9 Ų | 59.9 | 20% | 0.203 | 28% | 0.278 | C | S | . | . | trans | -80.8 | 150.6 | 163 | 76.6 | 0 | 0 | 0 | 0 | 110.6 | V110 G112 R131 A132 E133 | V110-S129 PolarHBondContact O-N 3.34Å; G112-S129 PolarHBondContact N-OG 3.32Å; S129-R131 PolarHBondContact O-N 3.18Å; S129-R131 VanDerWaalsContact O-N 3.17Å; S129-A132 WeakPolarHBondContact O-CA 3.16Å; S129-A132 WeakPolarHBondContact O-CB 3.32Å; S129-A132 PolarHBondContact O-N 3.18Å; S129-A132 WeakPolarHBondContact OG-CB 3.12Å; S129-A132 PolarHBondContact OG-N 3.37Å; S129-E133 PolarHBondContact O-N 3.42Å | ||
| 130 | K | 97.5 | Very high | 96.2 | Very high | 193 Ų | 193 | 62.1 Ų | 62.1 | 84% | 0.839 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -51 | -42.2 | 176.9 | -175.6 | 175.1 | -177.6 | 175.3 | 0 | 112.5 | A132 G134 | K130-A132 VanDerWaalsContact C-N 3.35Å; K130-G134 PolarHBondContact O-N 3.39Å |
| 131 | R | 97.5 | Very high | 96.2 | Very high | 175 Ų | 175 | 61.7 Ų | 61.7 | 66% | 0.66 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -67.2 | -35.2 | 176.8 | -169.7 | 176.6 | -170.6 | 176.8 | 1.2 | 112.5 | S129 K135 | S129-R131 PolarHBondContact O-N 3.18Å; S129-R131 VanDerWaalsContact O-N 3.17Å; R131-K135 WeakPolarHBondContact O-CG 3.4Å; R131-K135 PolarHBondContact O-N 3.5Å |
| 132 | A | 97.5 | Very high | 96.3 | Very high | 0 Ų | 0 | 63.6 Ų | 63.6 | 0% | 0 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -67.4 | -52.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | I75 V110 S129 K130 G134 K135 I136 | I75-A132 HydrophobicContact CD1-CB 3.62Å; I75-A132 VanDerWaalsContact CD1-O 3.28Å; I75-A132 WeakPolarHBondContact CD1-O 3.46Å; I75-A132 HydrophobicContact CG1-CB 4.2Å; V110-A132 HydrophobicContact CG1-CB 4.24Å; S129-A132 WeakPolarHBondContact O-CA 3.16Å; S129-A132 WeakPolarHBondContact O-CB 3.32Å; S129-A132 PolarHBondContact O-N 3.18Å; S129-A132 WeakPolarHBondContact OG-CB 3.12Å; S129-A132 PolarHBondContact OG-N 3.37Å; K130-A132 VanDerWaalsContact C-N 3.35Å; A132-G134 VanDerWaalsContact C-N 3.35Å; A132-G134 PolarHBondContact O-N 3.2Å; A132-K135 PolarHBondContact O-N 3.02Å; A132-K135 VanDerWaalsContact O-N 3.11Å; A132-I136 WeakPolarHBondContact O-CD1 3.26Å; A132-I136 VanDerWaalsContact O-CG1 3.32Å; A132-I136 WeakPolarHBondContact O-CG1 3.32Å; A132-I136 PolarHBondContact O-N 3.4Å |
| 133 | E | 96.9 | Very high | 96.3 | Very high | 70 Ų | 70 | 62.6 Ų | 62.6 | 33% | 0.327 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -55.9 | -47.4 | 177.9 | -172.1 | -173.7 | 175.5 | 0 | 0 | 112 | S129 K135 I136 K137 A143 | S129-E133 PolarHBondContact O-N 3.42Å; E133-K135 VanDerWaalsContact C-N 3.29Å; E133-K135 PolarHBondContact O-N 3.39Å; E133-I136 PolarHBondContact O-N 3.1Å; E133-K137 HydrophobicContact CG-CD 4.29Å; E133-K137 WeakPolarHBondContact O-CG 3.48Å; E133-K137 PolarHBondContact O-N 3.12Å; E133-K137 WeakPolarHBondContact OE1-CE 3.42Å; E133-K137 IonicContact OE1-NZ 2.67Å; E133-K137 PolarHBondContact OE1-NZ 3.31Å; E133-A143 HydrophobicContact CG-CB 4.15Å |
| 134 | G | 96.9 | Very high | 96.3 | Very high | 42 Ų | 42 | 66.1 Ų | 66.1 | 43% | 0.433 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -60 | -36.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | K130 A132 K138 | K130-G134 PolarHBondContact O-N 3.39Å; A132-G134 VanDerWaalsContact C-N 3.35Å; A132-G134 PolarHBondContact O-N 3.2Å; G134-K138 VanDerWaalsContact O-CB 3.29Å; G134-K138 WeakPolarHBondContact O-CB 3.48Å; G134-K138 PolarHBondContact O-N 3.08Å |
| 135 | K | 96.7 | Very high | 96.2 | Very high | 47 Ų | 47 | 68.5 Ų | 68.5 | 20% | 0.204 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -72 | -38 | 176.2 | -76.6 | 178.5 | 177.2 | -178.7 | 0 | 112.8 | I75 G112 G114 R131 A132 E133 K138 V139 | I75-K135 HydrophobicContact CD1-CB 3.98Å; G112-K135 PolarHBondContact O-NZ 2.91Å; G114-K135 PolarHBondContact O-NZ 3.24Å; R131-K135 WeakPolarHBondContact O-CG 3.4Å; R131-K135 PolarHBondContact O-N 3.5Å; A132-K135 PolarHBondContact O-N 3.02Å; A132-K135 VanDerWaalsContact O-N 3.11Å; E133-K135 VanDerWaalsContact C-N 3.29Å; E133-K135 PolarHBondContact O-N 3.39Å; K135-K138 PolarHBondContact O-N 3.14Å; K135-V139 PolarHBondContact O-N 3.14Å |
| 136 | I | 96.6 | Very high | 96 | Very high | 0 Ų | 0 | 70.7 Ų | 70.7 | 0% | 0 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -64.5 | -48.3 | 176.7 | -65.7 | 159.9 | 0 | 0 | 0 | 109.5 | I75 L116 I123 F128 A132 E133 K138 V139 G141 A143 | I75-I136 HydrophobicContact CD1-CD1 4.16Å; I75-I136 HydrophobicContact CD1-CG1 3.9Å; L116-I136 HydrophobicContact CD1-CG1 4.03Å; I123-I136 HydrophobicContact CD1-CD1 3.7Å; I123-I136 HydrophobicContact CD1-CG1 3.89Å; F128-I136 HydrophobicContact CD1-CD1 3.95Å; F128-I136 HydrophobicContact CE1-CD1 3.88Å; A132-I136 WeakPolarHBondContact O-CD1 3.26Å; A132-I136 VanDerWaalsContact O-CG1 3.32Å; A132-I136 WeakPolarHBondContact O-CG1 3.32Å; A132-I136 PolarHBondContact O-N 3.4Å; E133-I136 PolarHBondContact O-N 3.1Å; I136-K138 VanDerWaalsContact C-N 3.3Å; I136-K138 PolarHBondContact O-N 3.42Å; I136-V139 WeakPolarHBondContact O-CG2 3.43Å; I136-V139 PolarHBondContact O-N 3.03Å; I136-G141 WeakPolarHBondContact O-CA 3.4Å; I136-G141 PolarHBondContact O-N 3.31Å; I136-A143 HydrophobicContact CD1-CB 4.23Å |
| 137 | K | 95.9 | Very high | 95.3 | Very high | 125 Ų | 125 | 73.9 Ų | 73.9 | 54% | 0.543 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -59.8 | -40.1 | 175.4 | -69.9 | -178.9 | -178 | 176.1 | 0 | 111.9 | E133 V139 G140 | E133-K137 HydrophobicContact CG-CD 4.29Å; E133-K137 WeakPolarHBondContact O-CG 3.48Å; E133-K137 PolarHBondContact O-N 3.12Å; E133-K137 WeakPolarHBondContact OE1-CE 3.42Å; E133-K137 IonicContact OE1-NZ 2.67Å; E133-K137 PolarHBondContact OE1-NZ 3.31Å; K137-V139 VanDerWaalsContact C-N 3.28Å; K137-V139 PolarHBondContact O-N 3.07Å; K137-G140 PolarHBondContact O-N 3.03Å |
| 138 | K | 95.4 | Very high | 93.5 | Very high | 189 Ų | 189 | 75.6 Ų | 75.6 | 82% | 0.822 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -61.7 | -30.8 | 179.1 | -173.6 | 171.5 | -177.4 | 172.8 | 0 | 113.9 | G134 K135 I136 G140 | G134-K138 VanDerWaalsContact O-CB 3.29Å; G134-K138 WeakPolarHBondContact O-CB 3.48Å; G134-K138 PolarHBondContact O-N 3.08Å; K135-K138 PolarHBondContact O-N 3.14Å; I136-K138 VanDerWaalsContact C-N 3.3Å; I136-K138 PolarHBondContact O-N 3.42Å; K138-G140 VanDerWaalsContact C-N 3.29Å |
| 139 | V | 93.5 | Very high | 93.3 | Very high | 25 Ų | 25 | 77.6 Ų | 77.6 | 15% | 0.152 | 44% | 0.438 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89.9 | 10.9 | 176 | -61.1 | 0 | 0 | 0 | 0 | 113.4 | L116 P120 K135 I136 K137 G141 | L116-V139 HydrophobicContact CB-CG1 3.82Å; L116-V139 HydrophobicContact CB-CG2 4.11Å; L116-V139 HydrophobicContact CD1-CG2 3.64Å; L116-V139 HydrophobicContact CG-CG2 4.48Å; P120-V139 WeakPolarHBondContact CA-O 3.44Å; K135-V139 PolarHBondContact O-N 3.14Å; I136-V139 WeakPolarHBondContact O-CG2 3.43Å; I136-V139 PolarHBondContact O-N 3.03Å; K137-V139 VanDerWaalsContact C-N 3.28Å; K137-V139 PolarHBondContact O-N 3.07Å; V139-G141 VanDerWaalsContact C-N 3.29Å |
| 140 | G | 92.7 | Very high | 93 | Very high | 58 Ų | 58 | 80.1 Ų | 80.1 | 60% | 0.598 | 45% | 0.45 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 77 | 15 | -176.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | P120 K137 K138 | P120-G140 WeakPolarHBondContact CB-O 3.4Å; K137-G140 PolarHBondContact O-N 3.03Å; K138-G140 VanDerWaalsContact C-N 3.29Å |
| 141 | G | 94.5 | Very high | 92.8 | Very high | 11 Ų | 11 | 73.8 Ų | 73.8 | 11% | 0.113 | 43% | 0.429 | C | S | . | . | trans | -87.6 | 171.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | V121 I136 V139 | V121-G141 CarbonylContact O-C 3.59Å; V121-G141 WeakPolarHBondContact O-CA 3.46Å; I136-G141 WeakPolarHBondContact O-CA 3.4Å; I136-G141 PolarHBondContact O-N 3.31Å; V139-G141 VanDerWaalsContact C-N 3.29Å | ||
| 142 | A | 95.9 | Very high | 92.5 | Very high | 40 Ų | 40 | 67.9 Ų | 67.9 | 33% | 0.331 | 42% | 0.415 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.5 | 136.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | V121 I122 I123 | V121-A142 PolarHBondContact O-N 2.97Å; I122-A142 CarbonylContact C-O 3.46Å; I122-A142 WeakPolarHBondContact CA-O 3.49Å; I122-A142 HydrophobicContact CG1-CB 4.33Å; I122-A142 HydrophobicContact CG2-CB 4.49Å; I123-A142 PolarHBondContact N-O 3.18Å |
| 143 | A | 96.4 | Very high | 92.2 | Very high | 26 Ų | 26 | 72.1 Ų | 72.1 | 22% | 0.215 | 44% | 0.441 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99 | 110.8 | 172 | 0 | 0 | 0 | 0 | 0 | 108.7 | F128 E133 I136 | F128-A143 HydrophobicContact CD1-CB 3.98Å; F128-A143 HydrophobicContact CD2-CB 4.13Å; F128-A143 HydrophobicContact CE1-CB 3.87Å; F128-A143 HydrophobicContact CE2-CB 4.03Å; F128-A143 HydrophobicContact CG-CB 4.13Å; F128-A143 HydrophobicContact CZ-CB 3.9Å; E133-A143 HydrophobicContact CG-CB 4.15Å; I136-A143 HydrophobicContact CD1-CB 4.23Å |
| 144 | L | 95.9 | Very high | 91.8 | Very high | 73 Ų | 73 | 72.3 Ų | 72.3 | 38% | 0.382 | 45% | 0.449 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.1 | 121.3 | -179.3 | -66.4 | 179.1 | 0 | 0 | 0 | 109.9 | I122 I123 K124 A125 F128 | I122-L144 HydrophobicContact CG2-CD1 3.46Å; I122-L144 VanDerWaalsContact CG2-CD1 3.46Å; I122-L144 HydrophobicContact CG2-CG 3.98Å; I123-L144 PolarHBondContact O-N 3.48Å; K124-L144 WeakPolarHBondContact CA-O 3.42Å; K124-L144 HydrophobicContact CG-CB 3.84Å; K124-L144 HydrophobicContact CG-CD1 3.99Å; A125-L144 PolarHBondContact N-O 3.34Å; F128-L144 WeakPolarHBondContact CE2-O 3.43Å |
| 145 | L | 96.3 | Very high | 91.5 | Very high | 128 Ų | 128 | 74.4 Ų | 74.4 | 67% | 0.67 | 45% | 0.45 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -77.2 | 134.6 | 172 | -71.1 | 170.8 | 0 | 0 | 0 | 109.9 | A125 K126 F128 | A125-L145 WeakPolarHBondContact O-CA 3.48Å; K126-L145 WeakPolarHBondContact O-CD2 3.47Å; F128-L145 HydrophobicContact CD2-CD2 3.75Å; F128-L145 HydrophobicContact CD2-CG 4.44Å; F128-L145 HydrophobicContact CE2-CD2 4.1Å |
| 146 | V | 93 | Very high | 91.1 | Very high | 46 Ų | 46 | 76.5 Ų | 76.5 | 28% | 0.279 | 47% | 0.469 | S | S | . | . | trans | -110.6 | 116.8 | 174 | -178.9 | 0 | 0 | 0 | 0 | 107.9 | L103 K124 A125 | L103-V146 HydrophobicContact CD2-CG1 4.18Å; K124-V146 HydrophobicContact CB-CG2 3.8Å; K124-V146 HydrophobicContact CG-CG2 4.29Å; A125-V146 PolarHBondContact O-N 3.34Å | ||
| 147 | T | 79.4 | Confident | 90.6 | Very high | 130 Ų | 130 | 82.9 Ų | 82.9 | 80% | 0.798 | 51% | 0.508 | S | S | * | . | trans | -72 | 144.1 | 167.5 | 45.9 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 148 | A | 58.9 | Low | 90.1 | Very high | 144 Ų | 144 | 79.1 Ų | 79.1 | 100% | 1.19 | 50% | 0.504 | S | S | * | . | trans | -61.8 | 0 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111 |
Retrieved 148 of 148 residues in 194.8 ms
(Link to these results)