| 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 | 55.1 | Low | 59.4 | Low | 195 Ų | 195 | 116.2 Ų | 116.2 | 96% | 0.961 | 63% | 0.633 | S | S | * | * | 0 | -34.4 | 0 | -63.7 | -52.3 | -151.7 | 0 | 0 | 114.1 | L3 H5 | M1-L3 PolarHBondContact O-N 3.37Å; M1-H5 PolarHBondContact O-CD2 3Å; M1-H5 VanDerWaalsContact O-CD2 3.3Å | |||
| 2 | A | 56.8 | Low | 59.3 | Low | 76 Ų | 76 | 115.9 Ų | 115.9 | 63% | 0.628 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -68.4 | -28.9 | -177.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | R4 H5 L6 | A2-R4 PolarHBondContact O-N 3.48Å; A2-H5 PolarHBondContact O-N 3.43Å; A2-L6 PolarHBondContact O-N 2.92Å |
| 3 | L | 54.8 | Low | 59 | Low | 143 Ų | 143 | 117.1 Ų | 117.1 | 75% | 0.749 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -71.5 | -31.7 | -174.4 | -158.3 | 71.2 | 0 | 0 | 0 | 113.3 | M1 L6 A7 | M1-L3 PolarHBondContact O-N 3.37Å; L3-L6 PolarHBondContact O-N 3.3Å; L3-A7 PolarHBondContact O-N 3.01Å |
| 4 | R | 57 | Low | 58.9 | Low | 196 Ų | 196 | 115.6 Ų | 115.6 | 74% | 0.74 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -69 | -35.3 | 176.5 | -71.4 | -176 | 172.2 | 174.7 | -3.1 | 111.7 | A2 A7 F8 | A2-R4 PolarHBondContact O-N 3.48Å; R4-A7 PolarHBondContact O-N 3.12Å; R4-F8 WeakPolarHBondContact O-CD2 3.34Å; R4-F8 PolarHBondContact O-N 3.48Å; R4-F8 VanDerWaalsContact O-N 3.12Å |
| 5 | H | 56.5 | Low | 58.2 | Low | 131 Ų | 131 | 110.7 Ų | 110.7 | 61% | 0.606 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -69.1 | -35.9 | 175.6 | -70.8 | -71 | 0 | 0 | 0 | 112.6 | M1 A2 F8 L9 | M1-H5 PolarHBondContact O-CD2 3Å; M1-H5 VanDerWaalsContact O-CD2 3.3Å; A2-H5 PolarHBondContact O-N 3.43Å; H5-F8 PolarHBondContact O-N 3Å; H5-L9 WeakPolarHBondContact O-CB 3.45Å; H5-L9 VanDerWaalsContact O-CG 3.31Å; H5-L9 WeakPolarHBondContact O-CG 3.44Å; H5-L9 PolarHBondContact O-N 2.97Å |
| 6 | L | 59.3 | Low | 57.7 | Low | 112 Ų | 112 | 111 Ų | 111 | 59% | 0.586 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -66.6 | -39.2 | 175.6 | -76.7 | 168.4 | 0 | 0 | 0 | 112.4 | A2 L3 L9 A10 | A2-L6 PolarHBondContact O-N 2.92Å; L3-L6 PolarHBondContact O-N 3.3Å; L6-L9 PolarHBondContact O-N 3.3Å; L6-A10 WeakPolarHBondContact O-CB 3.31Å; L6-A10 PolarHBondContact O-N 3.35Å |
| 7 | A | 66.9 | Low | 57 | Low | 66 Ų | 66 | 109.4 Ų | 109.4 | 55% | 0.545 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -67.9 | -40 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | L3 R4 A10 G11 | L3-A7 PolarHBondContact O-N 3.01Å; R4-A7 PolarHBondContact O-N 3.12Å; A7-A10 PolarHBondContact O-N 3.16Å; A7-G11 PolarHBondContact O-N 3.38Å |
| 8 | F | 63.1 | Low | 56.4 | Low | 158 Ų | 158 | 108.1 Ų | 108.1 | 69% | 0.693 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -65.5 | -39.1 | 174.9 | -98.2 | -83.7 | 0 | 0 | 0 | 112.6 | R4 H5 G11 L12 | R4-F8 WeakPolarHBondContact O-CD2 3.34Å; R4-F8 PolarHBondContact O-N 3.48Å; R4-F8 VanDerWaalsContact O-N 3.12Å; H5-F8 PolarHBondContact O-N 3Å; F8-G11 PolarHBondContact O-N 3.42Å; F8-L12 PolarHBondContact O-N 3.47Å |
| 9 | L | 61.6 | Low | 55.9 | Low | 101 Ų | 101 | 112.4 Ų | 112.4 | 53% | 0.529 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -66.7 | -40.2 | 175 | -75.6 | 169.7 | 0 | 0 | 0 | 112 | H5 L6 L12 L13 | H5-L9 WeakPolarHBondContact O-CB 3.45Å; H5-L9 VanDerWaalsContact O-CG 3.31Å; H5-L9 WeakPolarHBondContact O-CG 3.44Å; H5-L9 PolarHBondContact O-N 2.97Å; L6-L9 PolarHBondContact O-N 3.3Å; L9-L12 PolarHBondContact O-N 2.98Å; L9-L13 VanDerWaalsContact O-CG 3.29Å; L9-L13 WeakPolarHBondContact O-CG 3.45Å; L9-L13 PolarHBondContact O-N 3.16Å |
| 10 | A | 61.3 | Low | 55.1 | Low | 54 Ų | 54 | 112.4 Ų | 112.4 | 45% | 0.446 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -64.7 | -40.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112 | L6 A7 L13 V14 | L6-A10 WeakPolarHBondContact O-CB 3.31Å; L6-A10 PolarHBondContact O-N 3.35Å; A7-A10 PolarHBondContact O-N 3.16Å; A10-L13 PolarHBondContact O-N 3.41Å; A10-V14 WeakPolarHBondContact O-CG2 3.44Å; A10-V14 PolarHBondContact O-N 3.23Å; A10-V14 VanDerWaalsContact O-N 3.08Å |
| 11 | G | 61 | Low | 54.5 | Low | 46 Ų | 46 | 114.7 Ų | 114.7 | 47% | 0.474 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -65.2 | -39.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | A7 F8 V14 G15 | A7-G11 PolarHBondContact O-N 3.38Å; F8-G11 PolarHBondContact O-N 3.42Å; G11-V14 PolarHBondContact O-N 3.14Å; G11-G15 PolarHBondContact O-N 3.11Å |
| 12 | L | 58.8 | Low | 53.9 | Low | 113 Ų | 113 | 114.8 Ų | 114.8 | 59% | 0.592 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -65.4 | -39.1 | 174.3 | -82.3 | 165.6 | 0 | 0 | 0 | 112.1 | F8 L9 G15 V16 | F8-L12 PolarHBondContact O-N 3.47Å; L9-L12 PolarHBondContact O-N 2.98Å; L12-G15 PolarHBondContact O-N 3.01Å; L12-V16 VanDerWaalsContact O-CG2 3.27Å; L12-V16 WeakPolarHBondContact O-CG2 3.4Å; L12-V16 PolarHBondContact O-N 3.38Å |
| 13 | L | 55.1 | Low | 52.8 | Low | 131 Ų | 131 | 118 Ų | 118 | 69% | 0.686 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -68.3 | -36.1 | 178.1 | -71 | 169.4 | 0 | 0 | 0 | 112.6 | L9 A10 A17 | L9-L13 VanDerWaalsContact O-CG 3.29Å; L9-L13 WeakPolarHBondContact O-CG 3.45Å; L9-L13 PolarHBondContact O-N 3.16Å; A10-L13 PolarHBondContact O-N 3.41Å; L13-A17 PolarHBondContact O-N 3.46Å |
| 14 | V | 57.5 | Low | 51.8 | Low | 96 Ų | 96 | 119 Ų | 119 | 58% | 0.582 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -74.2 | -35.1 | 175.6 | 173.7 | 0 | 0 | 0 | 0 | 111.8 | A10 G11 S18 | A10-V14 WeakPolarHBondContact O-CG2 3.44Å; A10-V14 PolarHBondContact O-N 3.23Å; A10-V14 VanDerWaalsContact O-N 3.08Å; G11-V14 PolarHBondContact O-N 3.14Å; V14-S18 PolarHBondContact O-N 2.96Å; V14-S18 PolarHBondContact O-OG 3.08Å |
| 15 | G | 48.8 | Very low | 50.8 | Low | 43 Ų | 43 | 113.4 Ų | 113.4 | 44% | 0.443 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -68.8 | -35.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114 | G11 L12 | G11-G15 PolarHBondContact O-N 3.11Å; L12-G15 PolarHBondContact O-N 3.01Å |
| 16 | V | 50.3 | Low | 50 | Low | 115 Ų | 115 | 116 Ų | 116 | 70% | 0.697 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -74.8 | -31.7 | 177.1 | 173.5 | 0 | 0 | 0 | 0 | 111.8 | L12 S18 | L12-V16 VanDerWaalsContact O-CG2 3.27Å; L12-V16 WeakPolarHBondContact O-CG2 3.4Å; L12-V16 PolarHBondContact O-N 3.38Å; V16-S18 VanDerWaalsContact C-N 3.32Å; V16-S18 PolarHBondContact O-N 3.42Å |
| 17 | A | 45.5 | Very low | 48.9 | Very low | 83 Ų | 83 | 116.3 Ų | 116.3 | 69% | 0.686 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -73.2 | -23.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | L13 | L13-A17 PolarHBondContact O-N 3.46Å |
| 18 | S | 45.6 | Very low | 48.1 | Very low | 87 Ų | 87 | 117.4 Ų | 117.4 | 61% | 0.608 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -96 | -12.2 | -171.3 | -53.6 | 0 | 0 | 0 | 0 | 114.2 | V14 V16 | V14-S18 PolarHBondContact O-N 2.96Å; V14-S18 PolarHBondContact O-OG 3.08Å; V16-S18 VanDerWaalsContact C-N 3.32Å; V16-S18 PolarHBondContact O-N 3.42Å |
| 19 | K | 46.7 | Very low | 47.7 | Very low | 189 Ų | 189 | 114.7 Ų | 114.7 | 82% | 0.822 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -108.3 | 46.2 | -176.4 | -153.1 | 170.2 | -180 | 74.4 | 0 | 113 | ||
| 20 | S | 39.7 | Very low | 47.8 | Very low | 112 Ų | 112 | 110.4 Ų | 110.4 | 78% | 0.783 | 64% | 0.637 | S | S | * | * | S | Bend | trans | -145.7 | 37.1 | 166.3 | -173.8 | 0 | 0 | 0 | 0 | 111.1 | ||
| 21 | M | 43.4 | Very low | 47.8 | Very low | 162 Ų | 162 | 109.6 Ų | 109.6 | 80% | 0.798 | 63% | 0.627 | S | S | * | * | S | Bend | trans | -116.4 | 140 | 157.2 | -88.7 | 166.8 | 51.6 | 0 | 0 | 105.5 | ||
| 22 | E | 41.7 | Very low | 47.6 | Very low | 197 Ų | 197 | 113.1 Ų | 113.1 | 92% | 0.921 | 64% | 0.639 | S | S | * | * | S | Bend | trans | 89.5 | 60.3 | -178.8 | -47.6 | 174.7 | 129.2 | 0 | 0 | 116.2 | ||
| 23 | N | 34 | Very low | 47.3 | Very low | 143 Ų | 143 | 113.6 Ų | 113.6 | 77% | 0.765 | 64% | 0.642 | S | S | * | * | trans | -171 | 87.7 | 132.2 | -156.8 | -40.9 | 0 | 0 | 0 | 110.4 | ||||
| 24 | M | 33.8 | Very low | 47.3 | Very low | 164 Ų | 164 | 113.7 Ų | 113.7 | 81% | 0.808 | 65% | 0.648 | S | S | * | * | trans | -148.4 | 65.3 | 156.5 | -75.1 | -54.4 | -175 | 0 | 0 | 107.7 | Q26 | M24-Q26 PolarHBondContact O-N 3.36Š| ||
| 25 | A | 35.3 | Very low | 47.1 | Very low | 78 Ų | 78 | 113.1 Ų | 113.1 | 65% | 0.645 | 65% | 0.645 | S | S | * | * | trans | -66.5 | 115.4 | 157.1 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 26 | Q | 40.9 | Very low | 47.2 | Very low | 187 Ų | 187 | 112.4 Ų | 112.4 | 87% | 0.874 | 64% | 0.637 | S | S | * | * | trans | 57 | 77.3 | 154.3 | -65.4 | 151.8 | -39.8 | 0 | 0 | 116.6 | M24 | M24-Q26 PolarHBondContact O-N 3.36Š| ||
| 27 | L | 35.1 | Very low | 47.3 | Very low | 118 Ų | 118 | 114.3 Ų | 114.3 | 62% | 0.618 | 65% | 0.649 | S | S | * | * | trans | -123.1 | 122.4 | 148.1 | -166.9 | 69.6 | 0 | 0 | 0 | 107.4 | E29 | L27-E29 HydrophobicContact CB-CG 4.2Å; L27-E29 HydrophobicContact CD2-CG 3.91Å; L27-E29 HydrophobicContact CG-CG 4.18Å; L27-E29 PolarHBondContact O-N 3Å | ||
| 28 | P | 51.4 | Low | 47.5 | Very low | 89 Ų | 89 | 116.8 Ų | 116.8 | 58% | 0.578 | 65% | 0.651 | S | S | * | * | trans | -75 | 80.7 | 170.7 | 29.6 | -29 | 0 | 0 | 0 | 108.2 | C30 V35 | P28-C30 PolarHBondContact O-N 3.04Å; P28-V35 HydrophobicContact CG-CG2 4.43Å | ||
| 29 | E | 54.5 | Low | 47.7 | Very low | 101 Ų | 101 | 116.4 Ų | 116.4 | 47% | 0.472 | 65% | 0.653 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -67.9 | 31.6 | 177.2 | -68.1 | -179.5 | 137.1 | 0 | 0 | 113.8 | L27 R65 | L27-E29 HydrophobicContact CB-CG 4.2Å; L27-E29 HydrophobicContact CD2-CG 3.91Å; L27-E29 HydrophobicContact CG-CG 4.18Å; L27-E29 PolarHBondContact O-N 3Å; E29-R65 IonicContact OE2-CZ 3.09Å; E29-R65 IonicContact OE2-NH1 3.86Å; E29-R65 IonicContact OE2-NH2 3.69Å; E29-R65 PolarHBondContact OE2-NH2 3.47Å; E29-R65 VanDerWaalsContact OE2-NH2 3.09Å |
| 30 | C | 63.2 | Low | 48 | Very low | 11 Ų | 11 | 110 Ų | 110 | 7% | 0.074 | 63% | 0.632 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -102.4 | -16.8 | 179.3 | -73.8 | 0 | 0 | 0 | 0 | 113.8 | P28 G48 C51 C63 | P28-C30 PolarHBondContact O-N 3.04Å; C30-G48 PolarHBondContact O-N 3.42Å; C30-C51 WeakPolarHBondContact CA-SG 3.09Å; C30-C51 HydrophobicContact CB-CB 3.69Å; C30-C51 WeakPolarHBondContact CB-SG 3.26Å; C30-C51 WeakPolarHBondContact SG-CB 3.29Å; C30-C51 CovalentContact SG-SG 2.03Å; C30-C51 PolarHBondContact SG-SG 3.5Å; C30-C63 HydrophobicContact CB-CB 4.02Å |
| 31 | C | 61.2 | Low | 48.5 | Very low | 37 Ų | 37 | 106.5 Ų | 106.5 | 25% | 0.25 | 61% | 0.607 | C | S | . | * | trans | -102.1 | 131.3 | 172.7 | -55.6 | 0 | 0 | 0 | 0 | 109 | D33 C41 | C31-D33 PolarHBondContact O-N 3.07Å; C31-C41 HydrophobicContact CB-CB 3.87Å; C31-C41 WeakPolarHBondContact CB-SG 3.45Å; C31-C41 WeakPolarHBondContact SG-CB 3.45Å; C31-C41 CovalentContact SG-SG 2.03Å; C31-C41 PolarHBondContact SG-SG 2.68Å | ||
| 32 | V | 57.7 | Low | 48.8 | Very low | 119 Ų | 119 | 103.1 Ų | 103.1 | 72% | 0.721 | 60% | 0.597 | S | S | * | * | S | Bend | trans | -71.9 | -20.6 | -179.7 | 175.6 | 0 | 0 | 0 | 0 | 111.8 | ||
| 33 | D | 52.5 | Low | 49.1 | Very low | 123 Ų | 123 | 96.9 Ų | 96.9 | 66% | 0.658 | 59% | 0.586 | S | S | * | * | S | Bend | trans | -132.3 | 155.2 | 176 | -77.6 | -52.2 | 0 | 0 | 0 | 113.3 | C31 | C31-D33 PolarHBondContact O-N 3.07Š|
| 34 | V | 54.3 | Low | 50 | Low | 133 Ų | 133 | 94.5 Ų | 94.5 | 81% | 0.806 | 59% | 0.585 | S | S | * | * | trans | -36.1 | 127.2 | -170.1 | -178.4 | 0 | 0 | 0 | 0 | 113.3 | G36 | V34-G36 PolarHBondContact O-N 3.45Å; V34-G36 VanDerWaalsContact O-N 3.07Å | ||
| 35 | V | 53.3 | Low | 51 | Low | 85 Ų | 85 | 90.7 Ų | 90.7 | 52% | 0.515 | 58% | 0.575 | S | S | . | * | trans | -47.4 | 111.9 | 176.1 | 171.3 | 0 | 0 | 0 | 0 | 110.3 | P28 | P28-V35 HydrophobicContact CG-CG2 4.43Š| ||
| 36 | G | 52.1 | Low | 52.2 | Low | 28 Ų | 28 | 94.3 Ų | 94.3 | 29% | 0.289 | 58% | 0.583 | S | S | . | * | trans | -63.7 | 149.5 | 160.1 | 0 | 0 | 0 | 0 | 0 | 109.5 | V34 N38 A39 | V34-G36 PolarHBondContact O-N 3.45Å; V34-G36 VanDerWaalsContact O-N 3.07Å; G36-N38 PolarHBondContact O-N 2.79Å; G36-A39 PolarHBondContact O-N 3.49Å | ||
| 37 | V | 52.2 | Low | 53.6 | Low | 154 Ų | 154 | 87 Ų | 87 | 93% | 0.933 | 55% | 0.552 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -50.5 | -14.6 | -172.2 | -161.7 | 0 | 0 | 0 | 0 | 114.6 | ||
| 38 | N | 50 | Low | 55.1 | Low | 136 Ų | 136 | 81.7 Ų | 81.7 | 73% | 0.727 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -113.3 | 23.5 | -179.1 | -77.9 | -4.9 | 0 | 0 | 0 | 115.5 | G36 S40 | G36-N38 PolarHBondContact O-N 2.79Å; N38-S40 PolarHBondContact O-N 3.32Å; N38-S40 PolarHBondContact O-OG 3.32Å |
| 39 | A | 49.4 | Very low | 55.7 | Low | 79 Ų | 79 | 84 Ų | 84 | 65% | 0.653 | 54% | 0.541 | S | S | * | . | S | Bend | trans | 55.3 | 16.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | G36 | G36-A39 PolarHBondContact O-N 3.49Š|
| 40 | S | 52.3 | Low | 56.2 | Low | 54 Ų | 54 | 80.7 Ų | 80.7 | 38% | 0.378 | 53% | 0.534 | S | S | . | . | trans | -104.9 | 121.2 | 179.4 | 9.5 | 0 | 0 | 0 | 0 | 107.4 | N38 P42 | N38-S40 PolarHBondContact O-N 3.32Å; N38-S40 PolarHBondContact O-OG 3.32Å; S40-P42 VanDerWaalsContact O-CD 3.31Å; S40-P42 WeakPolarHBondContact O-CD 3.27Å | ||
| 41 | C | 51.3 | Low | 56.7 | Low | 39 Ų | 39 | 80.6 Ų | 80.6 | 26% | 0.264 | 53% | 0.533 | S | S | . | . | trans | -64.3 | 121.2 | -179.3 | -48.7 | 0 | 0 | 0 | 0 | 109 | C31 | C31-C41 HydrophobicContact CB-CB 3.87Å; C31-C41 WeakPolarHBondContact CB-SG 3.45Å; C31-C41 WeakPolarHBondContact SG-CB 3.45Å; C31-C41 CovalentContact SG-SG 2.03Å; C31-C41 PolarHBondContact SG-SG 2.68Å | ||
| 42 | P | 49.4 | Very low | 57.1 | Low | 91 Ų | 91 | 81.1 Ų | 81.1 | 59% | 0.591 | 53% | 0.53 | S | S | * | . | trans | -84.8 | 118.3 | 173.9 | 32 | -25.8 | 0 | 0 | 0 | 108.3 | S40 | S40-P42 VanDerWaalsContact O-CD 3.31Å; S40-P42 WeakPolarHBondContact O-CD 3.27Å | ||
| 43 | G | 47.4 | Very low | 57.9 | Low | 66 Ų | 66 | 80.8 Ų | 80.8 | 68% | 0.68 | 52% | 0.516 | S | S | * | . | S | Bend | trans | 131.7 | 118.1 | 170.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | S45 | G43-S45 PolarHBondContact O-N 3.32Š|
| 44 | A | 51.8 | Low | 59 | Low | 92 Ų | 92 | 79 Ų | 79 | 76% | 0.76 | 50% | 0.503 | S | S | * | . | S | Bend | trans | 12.4 | 89.8 | 162.7 | 0 | 0 | 0 | 0 | 0 | 118.6 | L46 | A44-L46 PolarHBondContact O-N 2.83Š|
| 45 | S | 55.7 | Low | 60.1 | Low | 85 Ų | 85 | 79.8 Ų | 79.8 | 59% | 0.594 | 49% | 0.492 | S | S | * | . | S | Bend | trans | 64.5 | -0.6 | 137.6 | 60.2 | 0 | 0 | 0 | 0 | 122.4 | G43 | G43-S45 PolarHBondContact O-N 3.32Š|
| 46 | L | 60.8 | Low | 60.9 | Low | 154 Ų | 154 | 78.1 Ų | 78.1 | 81% | 0.806 | 48% | 0.48 | S | S | * | . | trans | -136.7 | 114.3 | 178.5 | -66.8 | 166 | 0 | 0 | 0 | 111.8 | A44 | A44-L46 PolarHBondContact O-N 2.83Š| ||
| 47 | C | 69.8 | Low | 62 | Low | 33 Ų | 33 | 82 Ų | 82 | 22% | 0.223 | 51% | 0.51 | C | S | . | . | P | Polyproline II helix | trans | -69.3 | 153.2 | 170.7 | -61.6 | 0 | 0 | 0 | 0 | 110.5 | C51 C63 | C47-C51 HydrophobicContact CB-CB 4.23Å; C47-C63 VanDerWaalsContact CA-SG 3.59Å; C47-C63 HydrophobicContact CB-CB 3.79Å; C47-C63 WeakPolarHBondContact CB-SG 3.33Å; C47-C63 WeakPolarHBondContact SG-CB 3.28Å; C47-C63 CovalentContact SG-SG 2.04Å; C47-C63 PolarHBondContact SG-SG 3.38Å |
| 48 | G | 67.3 | Low | 63.2 | Low | 7 Ų | 7 | 81.9 Ų | 81.9 | 7% | 0.072 | 50% | 0.503 | C | S | . | . | P | Polyproline II helix | trans | -58.7 | 158.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | C30 G50 C51 | C30-G48 PolarHBondContact O-N 3.42Å; G48-G50 PolarHBondContact O-N 3.2Å; G48-C51 PolarHBondContact O-N 3.42Å; G48-C51 VanDerWaalsContact O-N 3.11Å |
| 49 | P | 62.6 | Low | 64 | Low | 138 Ų | 138 | 77 Ų | 77 | 90% | 0.896 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.4 | 125.5 | -178.7 | 23.8 | -32.8 | 0 | 0 | 0 | 111.4 | ||
| 50 | G | 66.2 | Low | 64.9 | Low | 31 Ų | 31 | 75.5 Ų | 75.5 | 32% | 0.32 | 47% | 0.471 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 96.5 | -0.6 | -177.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | G48 C66 | G48-G50 PolarHBondContact O-N 3.2Å; G50-C66 PolarHBondContact O-N 3.19Å |
| 51 | C | 72.5 | Confident | 65.7 | Low | 8 Ų | 8 | 74.3 Ų | 74.3 | 5% | 0.054 | 46% | 0.464 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.4 | 151.6 | 175.5 | -48.9 | 0 | 0 | 0 | 0 | 111 | C30 C47 G48 V64 | C30-C51 WeakPolarHBondContact CA-SG 3.09Å; C30-C51 HydrophobicContact CB-CB 3.69Å; C30-C51 WeakPolarHBondContact CB-SG 3.26Å; C30-C51 WeakPolarHBondContact SG-CB 3.29Å; C30-C51 CovalentContact SG-SG 2.03Å; C30-C51 PolarHBondContact SG-SG 3.5Å; C47-C51 HydrophobicContact CB-CB 4.23Å; G48-C51 PolarHBondContact O-N 3.42Å; G48-C51 VanDerWaalsContact O-N 3.11Å; C51-V64 CarbonylContact C-O 3.57Å; C51-V64 VanDerWaalsContact CA-O 3.27Å; C51-V64 WeakPolarHBondContact CA-O 3.17Å; C51-V64 WeakPolarHBondContact CB-O 3.47Å |
| 52 | Y | 69.9 | Low | 66.7 | Low | 48 Ų | 48 | 73.6 Ų | 73.6 | 19% | 0.188 | 46% | 0.459 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.7 | 156.6 | 176.8 | 78.6 | -80.8 | 0 | 0 | 0 | 110.3 | H54 C63 V64 G76 S77 C79 | Y52-H54 HydrophobicContact CE2-CB 3.99Å; Y52-C63 CarbonylContact O-C 3.47Å; Y52-C63 WeakPolarHBondContact O-CA 3.29Å; Y52-V64 HydrophobicContact CD1-CB 4.13Å; Y52-V64 WeakPolarHBondContact CD1-O 3.32Å; Y52-V64 HydrophobicContact CE1-CB 3.57Å; Y52-V64 HydrophobicContact CE1-CG1 3.73Å; Y52-V64 PolarHBondContact N-O 2.75Å; Y52-V64 PolarHBondContact O-N 2.85Å; Y52-G76 CarbonylContact C-O 3.54Å; Y52-G76 VanDerWaalsContact CA-O 3.3Å; Y52-G76 WeakPolarHBondContact CA-O 3.18Å; Y52-G76 VanDerWaalsContact CB-O 3.31Å; Y52-G76 WeakPolarHBondContact CB-O 3.35Å; Y52-S77 VanDerWaalsContact CD2-O 3.3Å; Y52-S77 WeakPolarHBondContact CD2-O 3.33Å; Y52-C79 WeakPolarHBondContact CD1-SG 3.16Å; Y52-C79 WeakPolarHBondContact CE1-SG 3.08Å |
| 53 | R | 75.4 | Confident | 67.9 | Low | 113 Ų | 113 | 70.9 Ų | 70.9 | 43% | 0.426 | 44% | 0.442 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.6 | 115.2 | 178 | -169.5 | 179.4 | -179.5 | -176.4 | 1.3 | 109.5 | A61 S62 G76 | R53-A61 HydrophobicContact CG-CB 3.86Å; R53-S62 CarbonylContact C-O 3.58Å; R53-S62 WeakPolarHBondContact CA-O 3.27Å; R53-G76 PolarHBondContact N-O 2.85Å |
| 54 | H | 74.8 | Confident | 69.1 | Low | 84 Ų | 84 | 70.3 Ų | 70.3 | 39% | 0.389 | 43% | 0.425 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.2 | 134.3 | 170.9 | -175.4 | 63.7 | 0 | 0 | 0 | 109.7 | Y52 A61 S62 V64 | Y52-H54 HydrophobicContact CE2-CB 3.99Å; H54-A61 CarbonylContact O-C 3.53Å; H54-A61 WeakPolarHBondContact O-CA 3.23Å; H54-S62 PolarHBondContact N-O 3.46Å; H54-S62 PolarHBondContact O-N 2.73Å; H54-V64 HydrophobicContact CB-CG2 3.82Å |
| 55 | W | 76.9 | Confident | 70.1 | Confident | 151 Ų | 151 | 73.1 Ų | 73.1 | 57% | 0.572 | 42% | 0.416 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -99.4 | 118.5 | 178.2 | -167 | -96 | 0 | 0 | 0 | 109.3 | G59 A61 | W55-G59 WeakPolarHBondContact CH2-O 3.07Å; W55-G59 VanDerWaalsContact CZ2-C 3.45Å; W55-G59 WeakPolarHBondContact CZ2-O 3.49Å; W55-A61 HydrophobicContact CE3-CB 3.89Å; W55-A61 HydrophobicContact CZ3-CB 4.01Å |
| 56 | N | 70.5 | Confident | 70.8 | Confident | 50 Ų | 50 | 69.9 Ų | 69.9 | 27% | 0.267 | 39% | 0.393 | S | S | . | . | P | Polyproline II helix | trans | -79.6 | 158 | 177.4 | -57 | -52.4 | 0 | 0 | 0 | 110.1 | D58 G59 S60 | N56-D58 PolarHBondContact O-N 3.47Å; N56-D58 VanDerWaalsContact O-N 3.13Å; N56-G59 PolarHBondContact O-N 2.78Å; N56-S60 WeakPolarHBondContact CB-OG 3.22Å; N56-S60 PolarHBondContact N-O 3.4Å; N56-S60 PolarHBondContact ND2-O 3.21Å; N56-S60 PolarHBondContact ND2-OG 2.91Å |
| 57 | A | 75.9 | Confident | 71.1 | Confident | 110 Ų | 110 | 64.8 Ų | 64.8 | 91% | 0.909 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.7 | -30 | 178 | 0 | 0 | 0 | 0 | 0 | 113 | G59 | A57-G59 PolarHBondContact O-N 2.83Š|
| 58 | D | 76.1 | Confident | 70.6 | Confident | 150 Ų | 150 | 71.9 Ų | 71.9 | 80% | 0.802 | 41% | 0.413 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.7 | -1.1 | 180 | -50 | -39.6 | 0 | 0 | 0 | 113.7 | N56 S60 | N56-D58 PolarHBondContact O-N 3.47Å; N56-D58 VanDerWaalsContact O-N 3.13Å; D58-S60 VanDerWaalsContact C-N 3.34Å |
| 59 | G | 67.8 | Low | 70.2 | Confident | 35 Ų | 35 | 73.9 Ų | 73.9 | 36% | 0.361 | 44% | 0.435 | S | S | . | . | S | Bend | trans | 82.9 | 9 | -176.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | W55 N56 A57 | W55-G59 WeakPolarHBondContact CH2-O 3.07Å; W55-G59 VanDerWaalsContact CZ2-C 3.45Å; W55-G59 WeakPolarHBondContact CZ2-O 3.49Å; N56-G59 PolarHBondContact O-N 2.78Å; A57-G59 PolarHBondContact O-N 2.83Å |
| 60 | S | 69.2 | Low | 70.2 | Confident | 47 Ų | 47 | 68.7 Ų | 68.7 | 33% | 0.329 | 40% | 0.4 | S | S | . | . | trans | -91.1 | 152.4 | 175 | 64.9 | 0 | 0 | 0 | 0 | 111.2 | N56 D58 | N56-S60 WeakPolarHBondContact CB-OG 3.22Å; N56-S60 PolarHBondContact N-O 3.4Å; N56-S60 PolarHBondContact ND2-O 3.21Å; N56-S60 PolarHBondContact ND2-OG 2.91Å; D58-S60 VanDerWaalsContact C-N 3.34Å | ||
| 61 | A | 68.4 | Low | 69.9 | Low | 29 Ų | 29 | 72.1 Ų | 72.1 | 24% | 0.24 | 41% | 0.411 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108 | 126.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | R53 H54 W55 | R53-A61 HydrophobicContact CG-CB 3.86Å; H54-A61 CarbonylContact O-C 3.53Å; H54-A61 WeakPolarHBondContact O-CA 3.23Å; W55-A61 HydrophobicContact CE3-CB 3.89Å; W55-A61 HydrophobicContact CZ3-CB 4.01Å |
| 62 | S | 71.3 | Confident | 69.3 | Low | 24 Ų | 24 | 73.8 Ų | 73.8 | 17% | 0.168 | 42% | 0.421 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.4 | 146.6 | 172.8 | 57.3 | 0 | 0 | 0 | 0 | 110.3 | R53 H54 | R53-S62 CarbonylContact C-O 3.58Å; R53-S62 WeakPolarHBondContact CA-O 3.27Å; H54-S62 PolarHBondContact N-O 3.46Å; H54-S62 PolarHBondContact O-N 2.73Å |
| 63 | C | 74.4 | Confident | 69 | Low | 33 Ų | 33 | 72.6 Ų | 72.6 | 22% | 0.223 | 42% | 0.421 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.8 | 118.2 | 174.3 | -67.2 | 0 | 0 | 0 | 0 | 109.2 | C30 C47 Y52 | C30-C63 HydrophobicContact CB-CB 4.02Å; C47-C63 VanDerWaalsContact CA-SG 3.59Å; C47-C63 HydrophobicContact CB-CB 3.79Å; C47-C63 WeakPolarHBondContact CB-SG 3.33Å; C47-C63 WeakPolarHBondContact SG-CB 3.28Å; C47-C63 CovalentContact SG-SG 2.04Å; C47-C63 PolarHBondContact SG-SG 3.38Å; Y52-C63 CarbonylContact O-C 3.47Å; Y52-C63 WeakPolarHBondContact O-CA 3.29Å |
| 64 | V | 73.5 | Confident | 68.2 | Low | 54 Ų | 54 | 78.2 Ų | 78.2 | 33% | 0.327 | 44% | 0.444 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114 | 138.5 | -176.9 | -176.7 | 0 | 0 | 0 | 0 | 109.6 | C51 Y52 H54 | C51-V64 CarbonylContact C-O 3.57Å; C51-V64 VanDerWaalsContact CA-O 3.27Å; C51-V64 WeakPolarHBondContact CA-O 3.17Å; C51-V64 WeakPolarHBondContact CB-O 3.47Å; Y52-V64 HydrophobicContact CD1-CB 4.13Å; Y52-V64 WeakPolarHBondContact CD1-O 3.32Å; Y52-V64 HydrophobicContact CE1-CB 3.57Å; Y52-V64 HydrophobicContact CE1-CG1 3.73Å; Y52-V64 PolarHBondContact N-O 2.75Å; Y52-V64 PolarHBondContact O-N 2.85Å; H54-V64 HydrophobicContact CB-CG2 3.82Å |
| 65 | R | 74 | Confident | 67.4 | Low | 152 Ų | 152 | 80.8 Ų | 80.8 | 57% | 0.574 | 46% | 0.461 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -75 | 133.6 | 178.5 | -160.6 | 175.3 | -150.4 | 152 | 11.6 | 110.4 | E29 | E29-R65 IonicContact OE2-CZ 3.09Å; E29-R65 IonicContact OE2-NH1 3.86Å; E29-R65 IonicContact OE2-NH2 3.69Å; E29-R65 PolarHBondContact OE2-NH2 3.47Å; E29-R65 VanDerWaalsContact OE2-NH2 3.09Å |
| 66 | C | 70.1 | Confident | 66.6 | Low | 16 Ų | 16 | 74.7 Ų | 74.7 | 11% | 0.108 | 45% | 0.445 | C | S | . | . | P | Polyproline II helix | trans | -70.9 | 137.8 | 171.7 | -75.9 | 0 | 0 | 0 | 0 | 110.9 | G50 T70 C79 | G50-C66 PolarHBondContact O-N 3.19Å; C66-T70 VanDerWaalsContact CB-OG1 3.3Å; C66-T70 WeakPolarHBondContact CB-OG1 2.97Å; C66-C79 WeakPolarHBondContact CA-SG 3.2Å; C66-C79 HydrophobicContact CB-CB 3.89Å; C66-C79 WeakPolarHBondContact CB-SG 3.13Å; C66-C79 VanDerWaalsContact SG-CA 3.59Å; C66-C79 WeakPolarHBondContact SG-CB 3.21Å; C66-C79 CovalentContact SG-SG 2.03Å; C66-C79 PolarHBondContact SG-SG 2.87Å |
| 67 | G | 67.2 | Low | 66.2 | Low | 47 Ų | 47 | 75.3 Ų | 75.3 | 49% | 0.485 | 45% | 0.453 | S | S | . | . | P | Polyproline II helix | trans | -66 | 159.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113 | G69 T70 | G67-G69 PolarHBondContact O-N 3.43Å; G67-T70 PolarHBondContact N-OG1 3.37Å; G67-T70 VanDerWaalsContact N-OG1 3.13Å; G67-T70 PolarHBondContact O-N 2.76Å; G67-T70 PolarHBondContact O-OG1 3.28Å |
| 68 | N | 59.3 | Low | 65.7 | Low | 182 Ų | 182 | 75.7 Ų | 75.7 | 97% | 0.973 | 44% | 0.436 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.7 | 124.8 | -178.4 | -91.2 | -20.1 | 0 | 0 | 0 | 111.9 | ||
| 69 | G | 57.2 | Low | 65.3 | Low | 50 Ų | 50 | 70.6 Ų | 70.6 | 52% | 0.515 | 41% | 0.412 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 86.6 | 11.3 | -177.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | G67 F82 | G67-G69 PolarHBondContact O-N 3.43Å; G69-F82 VanDerWaalsContact O-CD2 3.29Å; G69-F82 WeakPolarHBondContact O-CD2 3.28Å; G69-F82 PolarHBondContact O-N 2.97Å |
| 70 | T | 63.1 | Low | 65.2 | Low | 29 Ų | 29 | 76.3 Ų | 76.3 | 18% | 0.178 | 42% | 0.423 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.1 | 133.2 | 173.1 | 66.8 | 0 | 0 | 0 | 0 | 110.3 | C66 G67 R80 | C66-T70 VanDerWaalsContact CB-OG1 3.3Å; C66-T70 WeakPolarHBondContact CB-OG1 2.97Å; G67-T70 PolarHBondContact N-OG1 3.37Å; G67-T70 VanDerWaalsContact N-OG1 3.13Å; G67-T70 PolarHBondContact O-N 2.76Å; G67-T70 PolarHBondContact O-OG1 3.28Å; T70-R80 VanDerWaalsContact CA-O 3.25Å; T70-R80 WeakPolarHBondContact CA-O 3.13Å |
| 71 | L | 59.6 | Low | 64.6 | Low | 102 Ų | 102 | 77.6 Ų | 77.6 | 53% | 0.534 | 43% | 0.432 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.5 | 147.1 | 174.6 | -71.1 | 174.4 | 0 | 0 | 0 | 109.4 | A73 R80 F82 | L71-A73 PolarHBondContact O-N 2.88Å; L71-R80 PolarHBondContact N-O 3.47Å; L71-R80 PolarHBondContact O-N 3.34Å; L71-F82 HydrophobicContact CD1-CE2 3.89Å; L71-F82 HydrophobicContact CD1-CZ 3.54Å; L71-F82 HydrophobicContact CG-CE2 4Å; L71-F82 HydrophobicContact CG-CZ 4.18Å |
| 72 | P | 61.6 | Low | 64.1 | Low | 43 Ų | 43 | 83.7 Ų | 83.7 | 28% | 0.279 | 45% | 0.453 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -59.6 | 131 | 171.7 | 24.9 | -31.6 | 0 | 0 | 0 | 108.7 | ||
| 73 | A | 61.7 | Low | 63.1 | Low | 23 Ų | 23 | 87.3 Ų | 87.3 | 19% | 0.19 | 48% | 0.484 | C | S | . | . | trans | -58 | 157.3 | 171 | 0 | 0 | 0 | 0 | 0 | 109.8 | L71 N75 G76 E78 R80 | L71-A73 PolarHBondContact O-N 2.88Å; A73-N75 PolarHBondContact O-N 2.86Å; A73-G76 WeakPolarHBondContact O-CA 3.49Å; A73-G76 PolarHBondContact O-N 3.09Å; A73-E78 WeakPolarHBondContact CB-O 3.4Å; A73-E78 PolarHBondContact N-O 3.45Å; A73-R80 HydrophobicContact CB-CG 4.48Å | ||
| 74 | Y | 58.8 | Low | 61.9 | Low | 232 Ų | 232 | 88.5 Ų | 88.5 | 91% | 0.91 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.5 | -25.4 | 177.6 | -178 | -97 | 0 | 0 | 0 | 113.4 | ||
| 75 | N | 59.1 | Low | 60.9 | Low | 137 Ų | 137 | 95.5 Ų | 95.5 | 73% | 0.733 | 52% | 0.522 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.9 | -0.6 | 177.6 | -66.4 | -10.8 | 0 | 0 | 0 | 114 | A73 S77 | A73-N75 PolarHBondContact O-N 2.86Å; N75-S77 PolarHBondContact O-N 3.4Å |
| 76 | G | 59.9 | Low | 59.3 | Low | 24 Ų | 24 | 91.6 Ų | 91.6 | 25% | 0.247 | 53% | 0.529 | C | S | . | . | S | Bend | trans | 63.5 | 9.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 115.8 | Y52 R53 A73 | Y52-G76 CarbonylContact C-O 3.54Å; Y52-G76 VanDerWaalsContact CA-O 3.3Å; Y52-G76 WeakPolarHBondContact CA-O 3.18Å; Y52-G76 VanDerWaalsContact CB-O 3.31Å; Y52-G76 WeakPolarHBondContact CB-O 3.35Å; R53-G76 PolarHBondContact N-O 2.85Å; A73-G76 WeakPolarHBondContact O-CA 3.49Å; A73-G76 PolarHBondContact O-N 3.09Å |
| 77 | S | 61.9 | Low | 57.9 | Low | 62 Ų | 62 | 94.4 Ų | 94.4 | 43% | 0.434 | 55% | 0.554 | S | S | . | * | S | Bend | trans | -102.6 | -13.2 | -175.7 | 60.2 | 0 | 0 | 0 | 0 | 114.5 | Y52 N75 | Y52-S77 VanDerWaalsContact CD2-O 3.3Å; Y52-S77 WeakPolarHBondContact CD2-O 3.33Å; N75-S77 PolarHBondContact O-N 3.4Å |
| 78 | E | 65.1 | Low | 57.1 | Low | 119 Ų | 119 | 98.1 Ų | 98.1 | 56% | 0.556 | 57% | 0.569 | S | S | * | * | trans | -146.6 | 143.3 | -173.9 | -66.1 | 177.9 | 176.4 | 0 | 0 | 110.9 | A73 | A73-E78 WeakPolarHBondContact CB-O 3.4Å; A73-E78 PolarHBondContact N-O 3.45Å | ||
| 79 | C | 67.5 | Low | 56.1 | Low | 42 Ų | 42 | 96.9 Ų | 96.9 | 28% | 0.284 | 56% | 0.555 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -85.4 | 126 | 168.7 | -58.8 | 0 | 0 | 0 | 0 | 109.5 | Y52 C66 | Y52-C79 WeakPolarHBondContact CD1-SG 3.16Å; Y52-C79 WeakPolarHBondContact CE1-SG 3.08Å; C66-C79 WeakPolarHBondContact CA-SG 3.2Å; C66-C79 HydrophobicContact CB-CB 3.89Å; C66-C79 WeakPolarHBondContact CB-SG 3.13Å; C66-C79 VanDerWaalsContact SG-CA 3.59Å; C66-C79 WeakPolarHBondContact SG-CB 3.21Å; C66-C79 CovalentContact SG-SG 2.03Å; C66-C79 PolarHBondContact SG-SG 2.87Å |
| 80 | R | 66.3 | Low | 55.5 | Low | 156 Ų | 156 | 100.9 Ų | 100.9 | 59% | 0.589 | 57% | 0.572 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -101.8 | 124.3 | 173.3 | -75 | -171.7 | 175.5 | -167.8 | -2.8 | 110.8 | T70 L71 A73 | T70-R80 VanDerWaalsContact CA-O 3.25Å; T70-R80 WeakPolarHBondContact CA-O 3.13Å; L71-R80 PolarHBondContact N-O 3.47Å; L71-R80 PolarHBondContact O-N 3.34Å; A73-R80 HydrophobicContact CB-CG 4.48Å |
| 81 | S | 56.7 | Low | 54.7 | Low | 74 Ų | 74 | 106.7 Ų | 106.7 | 52% | 0.517 | 60% | 0.599 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -67.7 | 135 | 167 | -51 | 0 | 0 | 0 | 0 | 110.6 | A83 G84 | S81-A83 PolarHBondContact O-N 2.84Å; S81-G84 PolarHBondContact O-N 3.4Å |
| 82 | F | 57.4 | Low | 53.7 | Low | 157 Ų | 157 | 110 Ų | 110 | 69% | 0.689 | 62% | 0.617 | S | S | * | * | G | 310 helix | trans | -55.2 | -24.2 | 171.3 | -84.4 | -79.5 | 0 | 0 | 0 | 112.8 | G69 L71 G84 | G69-F82 VanDerWaalsContact O-CD2 3.29Å; G69-F82 WeakPolarHBondContact O-CD2 3.28Å; G69-F82 PolarHBondContact O-N 2.97Å; L71-F82 HydrophobicContact CD1-CE2 3.89Å; L71-F82 HydrophobicContact CD1-CZ 3.54Å; L71-F82 HydrophobicContact CG-CE2 4Å; L71-F82 HydrophobicContact CG-CZ 4.18Å; F82-G84 VanDerWaalsContact C-N 3.32Å; F82-G84 PolarHBondContact O-N 2.83Å |
| 83 | A | 51.1 | Low | 53.5 | Low | 100 Ų | 100 | 119.5 Ų | 119.5 | 83% | 0.826 | 65% | 0.648 | S | S | * | * | G | 310 helix | trans | -72.7 | -10.8 | -178.2 | 0 | 0 | 0 | 0 | 0 | 115.6 | S81 | S81-A83 PolarHBondContact O-N 2.84Š|
| 84 | G | 48.3 | Very low | 52.9 | Low | 57 Ų | 57 | 123.9 Ų | 123.9 | 59% | 0.588 | 68% | 0.677 | S | S | * | * | G | 310 helix | trans | -96.7 | 9.4 | -169.3 | 0 | 0 | 0 | 0 | 0 | 117.1 | S81 F82 G86 | S81-G84 PolarHBondContact O-N 3.4Å; F82-G84 VanDerWaalsContact C-N 3.32Å; F82-G84 PolarHBondContact O-N 2.83Å; G84-G86 PolarHBondContact O-N 2.97Å; G84-G86 VanDerWaalsContact O-N 3.13Å |
| 85 | R | 52.3 | Low | 52.2 | Low | 202 Ų | 202 | 118.3 Ų | 118.3 | 76% | 0.762 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.8 | 18 | -175.2 | -145.9 | -178.2 | -146.4 | -144.1 | 9.2 | 114.8 | P103 | R85-P103 VanDerWaalsContact CZ-CG 3.44Å; R85-P103 VanDerWaalsContact NH1-CB 3.35Å; R85-P103 VanDerWaalsContact NH2-CG 3.28Å |
| 86 | G | 41.8 | Very low | 52.2 | Low | 69 Ų | 69 | 115.8 Ų | 115.8 | 71% | 0.711 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -131.4 | -0.7 | -171 | 0 | 0 | 0 | 0 | 0 | 116.1 | G84 P88 | G84-G86 PolarHBondContact O-N 2.97Å; G84-G86 VanDerWaalsContact O-N 3.13Å; G86-P88 WeakPolarHBondContact O-CD 3.4Å |
| 87 | A | 40.9 | Very low | 51.2 | Low | 76 Ų | 76 | 120.6 Ų | 120.6 | 63% | 0.628 | 70% | 0.703 | S | S | * | * | P | Polyproline II helix | trans | -88.4 | 118.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | F89 | A87-F89 PolarHBondContact O-N 3Š|
| 88 | P | 48.7 | Very low | 50.7 | Low | 124 Ų | 124 | 123.6 Ų | 123.6 | 81% | 0.805 | 72% | 0.721 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 128.2 | 174.3 | -13.5 | 27.7 | 0 | 0 | 0 | 109.9 | G86 | G86-P88 WeakPolarHBondContact O-CD 3.4Š|
| 89 | F | 38.9 | Very low | 49.7 | Very low | 157 Ų | 157 | 121.6 Ų | 121.6 | 69% | 0.689 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 138.7 | 166.6 | -63.5 | -88.4 | 0 | 0 | 0 | 109.1 | A87 M91 | A87-F89 PolarHBondContact O-N 3Å; F89-M91 HydrophobicContact CB-CE 4.1Å; F89-M91 HydrophobicContact CB-CG 4.48Å; F89-M91 HydrophobicContact CD2-CE 4.39Å; F89-M91 PolarHBondContact O-N 3.32Å |
| 90 | P | 45.7 | Very low | 48.8 | Very low | 133 Ų | 133 | 129.7 Ų | 129.7 | 86% | 0.864 | 76% | 0.757 | S | S | * | * | trans | -70.6 | 100.7 | 170.8 | 28.8 | -29.8 | 0 | 0 | 0 | 108.1 | N92 | P90-N92 PolarHBondContact O-N 2.86Š| ||
| 91 | M | 46.2 | Very low | 48.1 | Very low | 152 Ų | 152 | 127.6 Ų | 127.6 | 75% | 0.749 | 76% | 0.763 | S | S | * | * | trans | -89.3 | 105.2 | -178 | -78.9 | 146.2 | 175.1 | 0 | 0 | 110.3 | F89 R93 | F89-M91 HydrophobicContact CB-CE 4.1Å; F89-M91 HydrophobicContact CB-CG 4.48Å; F89-M91 HydrophobicContact CD2-CE 4.39Å; F89-M91 PolarHBondContact O-N 3.32Å; M91-R93 PolarHBondContact O-N 2.95Å | ||
| 92 | N | 37.1 | Very low | 47.9 | Very low | 171 Ų | 171 | 131.1 Ų | 131.1 | 91% | 0.914 | 77% | 0.772 | S | S | * | * | trans | -72.1 | 112.7 | 158.5 | -86.8 | -20 | 0 | 0 | 0 | 108.6 | P90 S94 | P90-N92 PolarHBondContact O-N 2.86Å; N92-S94 PolarHBondContact O-N 3.42Å | ||
| 93 | R | 58.7 | Low | 47.8 | Very low | 243 Ų | 243 | 127.7 Ų | 127.7 | 92% | 0.917 | 77% | 0.765 | S | S | * | * | trans | -80.6 | 94.6 | -170.3 | -173.7 | -177.5 | -169.9 | 137 | -0.5 | 110.3 | M91 | M91-R93 PolarHBondContact O-N 2.95Š| ||
| 94 | S | 49.1 | Very low | 48 | Very low | 115 Ų | 115 | 125.2 Ų | 125.2 | 80% | 0.804 | 75% | 0.75 | S | S | * | * | trans | -166 | 85.6 | 163.6 | -69.3 | 0 | 0 | 0 | 0 | 111.6 | N92 | N92-S94 PolarHBondContact O-N 3.42Š| ||
| 95 | S | 43.4 | Very low | 48.5 | Very low | 114 Ų | 114 | 125 Ų | 125 | 80% | 0.797 | 74% | 0.742 | S | S | * | * | trans | 161 | 112.4 | 149.1 | -81.2 | 0 | 0 | 0 | 0 | 109 | T97 | S95-T97 PolarHBondContact O-N 3.4Š| ||
| 96 | G | 58.9 | Low | 49.1 | Very low | 85 Ų | 85 | 119.5 Ų | 119.5 | 88% | 0.876 | 73% | 0.732 | S | S | * | * | trans | -61.7 | 132.4 | 171.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 97 | T | 38.8 | Very low | 50.4 | Low | 125 Ų | 125 | 126.6 Ų | 126.6 | 77% | 0.767 | 74% | 0.738 | S | S | * | * | trans | -141 | 155.6 | 168.6 | 36.4 | 0 | 0 | 0 | 0 | 109.9 | S95 | S95-T97 PolarHBondContact O-N 3.4Š| ||
| 98 | P | 51.2 | Low | 52.1 | Low | 125 Ų | 125 | 127.7 Ų | 127.7 | 81% | 0.812 | 74% | 0.736 | S | S | * | * | trans | -63 | 137 | -162.4 | -16.6 | 29.7 | 0 | 0 | 0 | 111.3 | R100 | P98-R100 PolarHBondContact O-N 2.91Š| ||
| 99 | G | 44.3 | Very low | 53.5 | Low | 77 Ų | 77 | 123.8 Ų | 123.8 | 79% | 0.794 | 72% | 0.715 | S | S | * | * | trans | -49.7 | 112.4 | -175.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 100 | R | 49.4 | Very low | 55.5 | Low | 211 Ų | 211 | 119.1 Ų | 119.1 | 80% | 0.796 | 71% | 0.705 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 122.4 | 165.1 | -177.1 | 172.2 | -178.4 | 157.1 | 2.9 | 108.2 | P98 H102 | P98-R100 PolarHBondContact O-N 2.91Å; R100-H102 PolarHBondContact O-N 3.42Å; R100-H102 PolarHBondContact O-ND1 2.91Å |
| 101 | P | 51.1 | Low | 57.3 | Low | 112 Ų | 112 | 116.7 Ų | 116.7 | 73% | 0.727 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 125.1 | -179.5 | 23.7 | -30.5 | 0 | 0 | 0 | 108.9 | ||
| 102 | H | 52.9 | Low | 59.4 | Low | 149 Ų | 149 | 114.8 Ų | 114.8 | 69% | 0.69 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 131.5 | -178.5 | -72.8 | 51.7 | 0 | 0 | 0 | 108.9 | R100 G104 A105 | R100-H102 PolarHBondContact O-N 3.42Å; R100-H102 PolarHBondContact O-ND1 2.91Å; H102-G104 PolarHBondContact O-N 3.48Å; H102-A105 WeakPolarHBondContact O-CB 3.18Å; H102-A105 PolarHBondContact O-N 3.31Å |
| 103 | P | 55.4 | Low | 61.7 | Low | 84 Ų | 84 | 112.7 Ų | 112.7 | 55% | 0.545 | 67% | 0.666 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -68.5 | 7.4 | 177.9 | 26.4 | -33.6 | 0 | 0 | 0 | 114.5 | R85 | R85-P103 VanDerWaalsContact CZ-CG 3.44Å; R85-P103 VanDerWaalsContact NH1-CB 3.35Å; R85-P103 VanDerWaalsContact NH2-CG 3.28Å |
| 104 | G | 55.1 | Low | 63 | Low | 49 Ų | 49 | 106.2 Ų | 106.2 | 51% | 0.505 | 65% | 0.65 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -96 | -14.9 | 168.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | H102 P106 | H102-G104 PolarHBondContact O-N 3.48Å; G104-P106 VanDerWaalsContact C-CD 3.4Å |
| 105 | A | 58.5 | Low | 65.1 | Low | 52 Ų | 52 | 102.1 Ų | 102.1 | 43% | 0.43 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -66 | -33.6 | 179.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | H102 R107 V108 A109 | H102-A105 WeakPolarHBondContact O-CB 3.18Å; H102-A105 PolarHBondContact O-N 3.31Å; A105-R107 VanDerWaalsContact C-N 3.31Å; A105-R107 PolarHBondContact O-N 2.87Å; A105-V108 PolarHBondContact O-N 3.12Å; A105-A109 WeakPolarHBondContact O-CB 3.44Å; A105-A109 PolarHBondContact O-N 3.49Å |
| 106 | P | 64.4 | Low | 67.5 | Low | 86 Ų | 86 | 99.9 Ų | 99.9 | 56% | 0.558 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -64.5 | -34.6 | -176.3 | -20.8 | 31 | 0 | 0 | 0 | 113.2 | G104 A110 | G104-P106 VanDerWaalsContact C-CD 3.4Å; P106-A110 WeakPolarHBondContact O-CB 3.38Å; P106-A110 PolarHBondContact O-N 2.85Å |
| 107 | R | 69.8 | Low | 69.1 | Low | 218 Ų | 218 | 102.5 Ų | 102.5 | 82% | 0.823 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -73.1 | -37.7 | -177.8 | -153 | 178 | -154.2 | -148.8 | 4.4 | 111.8 | A105 S111 | A105-R107 VanDerWaalsContact C-N 3.31Å; A105-R107 PolarHBondContact O-N 2.87Å; R107-S111 VanDerWaalsContact O-CB 3.31Å; R107-S111 WeakPolarHBondContact O-CB 3.11Å; R107-S111 PolarHBondContact O-N 3.01Å |
| 108 | V | 75.5 | Confident | 71.7 | Confident | 99 Ų | 99 | 103.5 Ų | 103.5 | 60% | 0.6 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -70.4 | -44.2 | 176.2 | -177.7 | 0 | 0 | 0 | 0 | 110.2 | A105 S111 L112 | A105-V108 PolarHBondContact O-N 3.12Å; V108-S111 PolarHBondContact O-N 3.07Å; V108-L112 WeakPolarHBondContact O-CB 3.46Å; V108-L112 PolarHBondContact O-N 3.13Å |
| 109 | A | 79.1 | Confident | 73.7 | Confident | 43 Ų | 43 | 103 Ų | 103 | 36% | 0.355 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -61.9 | -47.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | A105 S111 L112 F113 | A105-A109 WeakPolarHBondContact O-CB 3.44Å; A105-A109 PolarHBondContact O-N 3.49Å; A109-S111 VanDerWaalsContact C-N 3.34Å; A109-S111 PolarHBondContact O-N 2.68Å; A109-L112 PolarHBondContact O-N 3.22Å; A109-L112 VanDerWaalsContact O-N 3.14Å; A109-F113 HydrophobicContact CB-CE2 4.3Å; A109-F113 WeakPolarHBondContact O-CD2 3.28Å; A109-F113 PolarHBondContact O-N 2.67Å |
| 110 | A | 80.9 | Confident | 76.2 | Confident | 58 Ų | 58 | 101.8 Ų | 101.8 | 48% | 0.479 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -60.5 | -41.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | P106 L112 F113 L114 | P106-A110 WeakPolarHBondContact O-CB 3.38Å; P106-A110 PolarHBondContact O-N 2.85Å; A110-L112 VanDerWaalsContact C-N 3.32Å; A110-L112 PolarHBondContact O-N 2.97Å; A110-F113 PolarHBondContact O-N 2.82Å; A110-L114 VanDerWaalsContact O-CB 3.28Å; A110-L114 WeakPolarHBondContact O-CB 3.48Å; A110-L114 PolarHBondContact O-N 3.43Å |
| 111 | S | 84 | Confident | 78.3 | Confident | 82 Ų | 82 | 94.3 Ų | 94.3 | 57% | 0.573 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -64.3 | -36 | 175.3 | -173.3 | 0 | 0 | 0 | 0 | 112.5 | R107 V108 A109 G115 | R107-S111 VanDerWaalsContact O-CB 3.31Å; R107-S111 WeakPolarHBondContact O-CB 3.11Å; R107-S111 PolarHBondContact O-N 3.01Å; V108-S111 PolarHBondContact O-N 3.07Å; A109-S111 VanDerWaalsContact C-N 3.34Å; A109-S111 PolarHBondContact O-N 2.68Å; S111-G115 PolarHBondContact O-N 2.87Å |
| 112 | L | 89.1 | Confident | 80.4 | Confident | 112 Ų | 112 | 90.8 Ų | 90.8 | 59% | 0.586 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -71.7 | -44.2 | 179.3 | -162.7 | 147.6 | 0 | 0 | 0 | 110.8 | V108 A109 A110 G115 T116 | V108-L112 WeakPolarHBondContact O-CB 3.46Å; V108-L112 PolarHBondContact O-N 3.13Å; A109-L112 PolarHBondContact O-N 3.22Å; A109-L112 VanDerWaalsContact O-N 3.14Å; A110-L112 VanDerWaalsContact C-N 3.32Å; A110-L112 PolarHBondContact O-N 2.97Å; L112-G115 PolarHBondContact O-N 3.46Å; L112-T116 HydrophobicContact CD2-CG2 4.17Å; L112-T116 VanDerWaalsContact O-CG2 3.31Å; L112-T116 WeakPolarHBondContact O-CG2 3.2Å; L112-T116 PolarHBondContact O-N 3.41Å; L112-T116 PolarHBondContact O-OG1 3.49Å; L112-T116 VanDerWaalsContact O-OG1 3.08Å |
| 113 | F | 85.9 | Confident | 82.4 | Confident | 127 Ų | 127 | 89 Ų | 89 | 56% | 0.557 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -60.5 | -49.1 | 172.3 | -72.3 | -63.9 | 0 | 0 | 0 | 111.4 | A109 A110 G115 T116 F117 | A109-F113 HydrophobicContact CB-CE2 4.3Å; A109-F113 WeakPolarHBondContact O-CD2 3.28Å; A109-F113 PolarHBondContact O-N 2.67Å; A110-F113 PolarHBondContact O-N 2.82Å; F113-G115 VanDerWaalsContact C-N 3.31Å; F113-G115 PolarHBondContact O-N 2.96Å; F113-T116 PolarHBondContact O-N 2.89Å; F113-T116 PolarHBondContact O-OG1 3.39Å; F113-F117 HydrophobicContact CB-CD2 4.49Å; F113-F117 WeakPolarHBondContact O-CB 3.3Å; F113-F117 WeakPolarHBondContact O-CD2 3.29Å; F113-F117 PolarHBondContact O-N 2.89Å |
| 114 | L | 86.4 | Confident | 84.2 | Confident | 108 Ų | 108 | 90.4 Ų | 90.4 | 57% | 0.565 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -62.9 | -41.2 | -179.7 | -150.2 | 76.4 | 0 | 0 | 0 | 111.2 | A110 F117 F118 | A110-L114 VanDerWaalsContact O-CB 3.28Å; A110-L114 WeakPolarHBondContact O-CB 3.48Å; A110-L114 PolarHBondContact O-N 3.43Å; L114-F117 PolarHBondContact O-N 3.26Å; L114-F118 HydrophobicContact CD1-CE2 4.45Å; L114-F118 HydrophobicContact CD2-CE2 3.93Å; L114-F118 HydrophobicContact CG-CD2 4.01Å; L114-F118 HydrophobicContact CG-CE2 3.72Å; L114-F118 WeakPolarHBondContact O-CD2 3.25Å; L114-F118 PolarHBondContact O-N 2.98Å |
| 115 | G | 93.1 | Very high | 86.1 | Confident | 28 Ų | 28 | 93.6 Ų | 93.6 | 29% | 0.289 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62 | -47.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | S111 L112 F113 F117 F118 I119 | S111-G115 PolarHBondContact O-N 2.87Å; L112-G115 PolarHBondContact O-N 3.46Å; F113-G115 VanDerWaalsContact C-N 3.31Å; F113-G115 PolarHBondContact O-N 2.96Å; G115-F117 VanDerWaalsContact C-N 3.35Å; G115-F117 PolarHBondContact O-N 3.14Å; G115-F118 PolarHBondContact O-N 3.38Å; G115-I119 WeakPolarHBondContact O-CB 3.03Å; G115-I119 WeakPolarHBondContact O-CD1 3.17Å; G115-I119 WeakPolarHBondContact O-CG1 3.32Å; G115-I119 PolarHBondContact O-N 2.85Å |
| 116 | T | 93.6 | Very high | 87.7 | Confident | 67 Ų | 67 | 95 Ų | 95 | 41% | 0.411 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -67.2 | -36.3 | 177.8 | 57.1 | 0 | 0 | 0 | 0 | 111.8 | L112 F113 I119 S120 | L112-T116 HydrophobicContact CD2-CG2 4.17Å; L112-T116 VanDerWaalsContact O-CG2 3.31Å; L112-T116 WeakPolarHBondContact O-CG2 3.2Å; L112-T116 PolarHBondContact O-N 3.41Å; L112-T116 PolarHBondContact O-OG1 3.49Å; L112-T116 VanDerWaalsContact O-OG1 3.08Å; F113-T116 PolarHBondContact O-N 2.89Å; F113-T116 PolarHBondContact O-OG1 3.39Å; T116-I119 PolarHBondContact O-N 2.03Å; T116-S120 WeakPolarHBondContact O-CB 3.31Å; T116-S120 PolarHBondContact O-N 3.11Å; T116-S120 PolarHBondContact O-OG 3.26Å |
| 117 | F | 92.8 | Very high | 89.2 | Confident | 140 Ų | 140 | 94.8 Ų | 94.8 | 61% | 0.614 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -61.9 | -46.2 | 172.3 | -88.3 | -67.6 | 0 | 0 | 0 | 111.7 | F113 L114 G115 S120 S121 | F113-F117 HydrophobicContact CB-CD2 4.49Å; F113-F117 WeakPolarHBondContact O-CB 3.3Å; F113-F117 WeakPolarHBondContact O-CD2 3.29Å; F113-F117 PolarHBondContact O-N 2.89Å; L114-F117 PolarHBondContact O-N 3.26Å; G115-F117 VanDerWaalsContact C-N 3.35Å; G115-F117 PolarHBondContact O-N 3.14Å; F117-S120 WeakPolarHBondContact CA-OG 3.13Å; F117-S120 PolarHBondContact O-OG 2.92Å; F117-S120 VanDerWaalsContact O-OG 3.12Å; F117-S121 WeakPolarHBondContact O-CA 3.27Å; F117-S121 WeakPolarHBondContact O-CB 3.05Å; F117-S121 PolarHBondContact O-N 3.08Å |
| 118 | F | 92.4 | Very high | 90.2 | Very high | 146 Ų | 146 | 86.9 Ų | 86.9 | 64% | 0.64 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -65.3 | -41.6 | 177.6 | -84.8 | -64.5 | 0 | 0 | 0 | 112.6 | L114 G115 G122 | L114-F118 HydrophobicContact CD1-CE2 4.45Å; L114-F118 HydrophobicContact CD2-CE2 3.93Å; L114-F118 HydrophobicContact CG-CD2 4.01Å; L114-F118 HydrophobicContact CG-CE2 3.72Å; L114-F118 WeakPolarHBondContact O-CD2 3.25Å; L114-F118 PolarHBondContact O-N 2.98Å; G115-F118 PolarHBondContact O-N 3.38Å; F118-G122 PolarHBondContact O-N 3.34Å |
| 119 | I | 94.1 | Very high | 90.8 | Very high | 114 Ų | 114 | 83.3 Ų | 83.3 | 59% | 0.585 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -67 | -49.2 | 178.6 | -65.3 | 163.3 | 0 | 0 | 0 | 110.3 | G115 T116 G122 L123 | G115-I119 WeakPolarHBondContact O-CB 3.03Å; G115-I119 WeakPolarHBondContact O-CD1 3.17Å; G115-I119 WeakPolarHBondContact O-CG1 3.32Å; G115-I119 PolarHBondContact O-N 2.85Å; T116-I119 PolarHBondContact O-N 2.03Å; I119-G122 PolarHBondContact O-N 2.94Å; I119-L123 HydrophobicContact CG2-CD1 4.12Å; I119-L123 WeakPolarHBondContact O-CB 3.5Å; I119-L123 VanDerWaalsContact O-CG 3.28Å; I119-L123 WeakPolarHBondContact O-CG 3.01Å; I119-L123 PolarHBondContact O-N 2.04Å |
| 120 | S | 95.8 | Very high | 91.1 | Very high | 52 Ų | 52 | 87 Ų | 87 | 36% | 0.364 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.7 | -47.3 | 179.6 | 58 | 0 | 0 | 0 | 0 | 112 | T116 F117 G122 L123 I124 | T116-S120 WeakPolarHBondContact O-CB 3.31Å; T116-S120 PolarHBondContact O-N 3.11Å; T116-S120 PolarHBondContact O-OG 3.26Å; F117-S120 WeakPolarHBondContact CA-OG 3.13Å; F117-S120 PolarHBondContact O-OG 2.92Å; F117-S120 VanDerWaalsContact O-OG 3.12Å; S120-G122 PolarHBondContact O-N 2.03Å; S120-L123 PolarHBondContact O-N 3.18Å; S120-I124 WeakPolarHBondContact O-CD1 3.42Å; S120-I124 WeakPolarHBondContact O-CG1 3.38Å; S120-I124 PolarHBondContact O-N 3.35Å |
| 121 | S | 94.8 | Very high | 91.3 | Very high | 54 Ų | 54 | 90.2 Ų | 90.2 | 38% | 0.378 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -56.6 | -48.2 | 174.2 | 172.8 | 0 | 0 | 0 | 0 | 111.4 | F117 L123 I124 L125 | F117-S121 WeakPolarHBondContact O-CA 3.27Å; F117-S121 WeakPolarHBondContact O-CB 3.05Å; F117-S121 PolarHBondContact O-N 3.08Å; S121-L123 PolarHBondContact O-N 2.75Å; S121-I124 PolarHBondContact O-N 2.88Å; S121-L125 WeakPolarHBondContact O-CB 3.15Å; S121-L125 VanDerWaalsContact O-CG 3.28Å; S121-L125 WeakPolarHBondContact O-CG 3.06Å; S121-L125 PolarHBondContact O-N 3Å |
| 122 | G | 94.3 | Very high | 91.3 | Very high | 38 Ų | 38 | 94.5 Ų | 94.5 | 39% | 0.392 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.4 | -42.9 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | F118 I119 S120 S126 | F118-G122 PolarHBondContact O-N 3.34Å; I119-G122 PolarHBondContact O-N 2.94Å; S120-G122 PolarHBondContact O-N 2.03Å; G122-S126 WeakPolarHBondContact O-CB 3.07Å; G122-S126 PolarHBondContact O-N 2.98Å |
| 123 | L | 94.9 | Very high | 90.8 | Very high | 111 Ų | 111 | 92.3 Ų | 92.3 | 58% | 0.581 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -64.4 | -44.9 | 176.7 | -71.5 | 175.9 | 0 | 0 | 0 | 111.8 | I119 S120 S121 S126 V127 | I119-L123 HydrophobicContact CG2-CD1 4.12Å; I119-L123 WeakPolarHBondContact O-CB 3.5Å; I119-L123 VanDerWaalsContact O-CG 3.28Å; I119-L123 WeakPolarHBondContact O-CG 3.01Å; I119-L123 PolarHBondContact O-N 2.04Å; S120-L123 PolarHBondContact O-N 3.18Å; S121-L123 PolarHBondContact O-N 2.75Å; L123-S126 PolarHBondContact O-N 3.31Å; L123-V127 WeakPolarHBondContact O-CG2 3.1Å; L123-V127 PolarHBondContact O-N 3.07Å |
| 124 | I | 94.6 | Very high | 90.3 | Very high | 114 Ų | 114 | 93.2 Ų | 93.2 | 59% | 0.585 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -64.6 | -47.3 | 179.2 | -64.9 | 162.4 | 0 | 0 | 0 | 110.5 | S120 S121 S126 V127 A128 | S120-I124 WeakPolarHBondContact O-CD1 3.42Å; S120-I124 WeakPolarHBondContact O-CG1 3.38Å; S120-I124 PolarHBondContact O-N 3.35Å; S121-I124 PolarHBondContact O-N 2.88Å; I124-S126 VanDerWaalsContact C-N 3.32Å; I124-S126 PolarHBondContact O-N 3.38Å; I124-V127 PolarHBondContact O-N 3.19Å; I124-A128 WeakPolarHBondContact O-CB 3.31Å; I124-A128 PolarHBondContact O-N 2.03Å |
| 125 | L | 93.3 | Very high | 89.5 | Confident | 117 Ų | 117 | 98.9 Ų | 98.9 | 61% | 0.613 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -66.7 | -33.5 | 178.5 | -70.5 | 175.2 | 0 | 0 | 0 | 112.4 | S121 G129 | S121-L125 WeakPolarHBondContact O-CB 3.15Å; S121-L125 VanDerWaalsContact O-CG 3.28Å; S121-L125 WeakPolarHBondContact O-CG 3.06Å; S121-L125 PolarHBondContact O-N 3Å; L125-G129 VanDerWaalsContact O-CA 3.22Å; L125-G129 WeakPolarHBondContact O-CA 3.12Å; L125-G129 PolarHBondContact O-N 2.91Å |
| 126 | S | 92.9 | Very high | 88.1 | Confident | 80 Ų | 80 | 99.3 Ų | 99.3 | 56% | 0.559 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -66.1 | -47.8 | 174.9 | -178.6 | 0 | 0 | 0 | 0 | 111.3 | G122 L123 I124 F130 | G122-S126 WeakPolarHBondContact O-CB 3.07Å; G122-S126 PolarHBondContact O-N 2.98Å; L123-S126 PolarHBondContact O-N 3.31Å; I124-S126 VanDerWaalsContact C-N 3.32Å; I124-S126 PolarHBondContact O-N 3.38Å; S126-F130 WeakPolarHBondContact O-CB 3.31Å; S126-F130 PolarHBondContact O-N 2.84Å |
| 127 | V | 95.6 | Very high | 86.4 | Confident | 82 Ų | 82 | 101.2 Ų | 101.2 | 50% | 0.497 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -67.6 | -50.1 | 178.8 | 175.5 | 0 | 0 | 0 | 0 | 110.7 | L123 I124 G129 F130 F131 | L123-V127 WeakPolarHBondContact O-CG2 3.1Å; L123-V127 PolarHBondContact O-N 3.07Å; I124-V127 PolarHBondContact O-N 3.19Å; V127-G129 VanDerWaalsContact C-N 3.32Å; V127-G129 PolarHBondContact O-N 2.95Å; V127-F130 WeakPolarHBondContact O-CB 3.34Å; V127-F130 PolarHBondContact O-N 2.71Å; V127-F131 HydrophobicContact CG1-CD2 3.82Å; V127-F131 HydrophobicContact CG1-CE2 3.65Å; V127-F131 WeakPolarHBondContact O-CD2 3.16Å; V127-F131 PolarHBondContact O-N 3.32Å |
| 128 | A | 91.8 | Very high | 84.8 | Confident | 53 Ų | 53 | 102.4 Ų | 102.4 | 44% | 0.438 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.5 | -42.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | I124 F131 Y132 | I124-A128 WeakPolarHBondContact O-CB 3.31Å; I124-A128 PolarHBondContact O-N 2.03Å; A128-F131 PolarHBondContact O-N 2.97Å; A128-Y132 VanDerWaalsContact O-CB 3.27Å; A128-Y132 WeakPolarHBondContact O-CB 3.42Å; A128-Y132 PolarHBondContact O-N 2.79Å |
| 129 | G | 87.1 | Confident | 83.2 | Confident | 23 Ų | 23 | 98.6 Ų | 98.6 | 24% | 0.237 | 52% | 0.518 | C | S | . | . | H | α-helix | trans | -61.5 | -43.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | L125 V127 F131 Y132 L133 | L125-G129 VanDerWaalsContact O-CA 3.22Å; L125-G129 WeakPolarHBondContact O-CA 3.12Å; L125-G129 PolarHBondContact O-N 2.91Å; V127-G129 VanDerWaalsContact C-N 3.32Å; V127-G129 PolarHBondContact O-N 2.95Å; G129-F131 PolarHBondContact O-N 3Å; G129-Y132 CarbonylContact O-C 3.59Å; G129-Y132 WeakPolarHBondContact O-CB 3.07Å; G129-Y132 PolarHBondContact O-N 2.77Å; G129-L133 VanDerWaalsContact O-CB 3.23Å; G129-L133 WeakPolarHBondContact O-CB 3.38Å; G129-L133 WeakPolarHBondContact O-CD1 3.4Å; G129-L133 WeakPolarHBondContact O-CG 3.49Å; G129-L133 PolarHBondContact O-N 3.3Å |
| 130 | F | 85.5 | Confident | 81.1 | Confident | 120 Ų | 120 | 96.9 Ų | 96.9 | 53% | 0.526 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -60.6 | -45.1 | 175.8 | 176.6 | -99.7 | 0 | 0 | 0 | 111.6 | S126 V127 L133 K134 | S126-F130 WeakPolarHBondContact O-CB 3.31Å; S126-F130 PolarHBondContact O-N 2.84Å; V127-F130 WeakPolarHBondContact O-CB 3.34Å; V127-F130 PolarHBondContact O-N 2.71Å; F130-L133 PolarHBondContact O-N 2.97Å; F130-K134 HydrophobicContact CE1-CD 3.98Å; F130-K134 HydrophobicContact CZ-CD 4.24Å; F130-K134 WeakPolarHBondContact O-CB 3.3Å; F130-K134 PolarHBondContact O-N 3.24Å |
| 131 | F | 86.1 | Confident | 79.1 | Confident | 126 Ų | 126 | 104.8 Ų | 104.8 | 55% | 0.553 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -65.5 | -39.3 | 174.6 | -78.4 | -72.2 | 0 | 0 | 0 | 112.5 | V127 A128 G129 R135 | V127-F131 HydrophobicContact CG1-CD2 3.82Å; V127-F131 HydrophobicContact CG1-CE2 3.65Å; V127-F131 WeakPolarHBondContact O-CD2 3.16Å; V127-F131 PolarHBondContact O-N 3.32Å; A128-F131 PolarHBondContact O-N 2.97Å; G129-F131 PolarHBondContact O-N 3Å; F131-R135 VanDerWaalsContact O-CB 3.29Å; F131-R135 WeakPolarHBondContact O-CB 3.31Å; F131-R135 PolarHBondContact O-N 2.91Å |
| 132 | Y | 82.9 | Confident | 77.3 | Confident | 173 Ų | 173 | 107.7 Ų | 107.7 | 68% | 0.678 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -63.8 | -42.9 | 175.3 | -177.4 | -96.3 | 0 | 0 | 0 | 111.8 | A128 G129 S136 | A128-Y132 VanDerWaalsContact O-CB 3.27Å; A128-Y132 WeakPolarHBondContact O-CB 3.42Å; A128-Y132 PolarHBondContact O-N 2.79Å; G129-Y132 CarbonylContact O-C 3.59Å; G129-Y132 WeakPolarHBondContact O-CB 3.07Å; G129-Y132 PolarHBondContact O-N 2.77Å; Y132-S136 WeakPolarHBondContact O-CB 3.3Å; Y132-S136 PolarHBondContact O-N 3.17Å; Y132-S136 PolarHBondContact O-OG 2.82Å |
| 133 | L | 79.1 | Confident | 75.4 | Confident | 65 Ų | 65 | 113.6 Ų | 113.6 | 34% | 0.34 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -72.2 | -39.1 | 179 | -68.4 | 163.2 | 0 | 0 | 0 | 111.7 | G129 F130 S136 S137 L139 | G129-L133 VanDerWaalsContact O-CB 3.23Å; G129-L133 WeakPolarHBondContact O-CB 3.38Å; G129-L133 WeakPolarHBondContact O-CD1 3.4Å; G129-L133 WeakPolarHBondContact O-CG 3.49Å; G129-L133 PolarHBondContact O-N 3.3Å; F130-L133 PolarHBondContact O-N 2.97Å; L133-S136 WeakPolarHBondContact CA-OG 3.49Å; L133-S136 PolarHBondContact O-N 3.13Å; L133-S136 PolarHBondContact O-OG 2.83Å; L133-S137 PolarHBondContact O-N 3.02Å; L133-L139 HydrophobicContact CB-CD1 3.85Å; L133-L139 HydrophobicContact CB-CG 4.33Å; L133-L139 HydrophobicContact CD1-CD1 3.64Å; L133-L139 HydrophobicContact CD2-CD1 3.81Å; L133-L139 HydrophobicContact CD2-CD2 4.31Å; L133-L139 HydrophobicContact CD2-CG 3.83Å; L133-L139 HydrophobicContact CG-CD1 3.95Å; L133-L139 HydrophobicContact CG-CG 4.44Å |
| 134 | K | 74.4 | Confident | 73.3 | Confident | 146 Ų | 146 | 116.3 Ų | 116.3 | 64% | 0.635 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -63.5 | -41.7 | 174.2 | -174.4 | 174.6 | -176.7 | 178.5 | 0 | 111.3 | F130 | F130-K134 HydrophobicContact CE1-CD 3.98Å; F130-K134 HydrophobicContact CZ-CD 4.24Å; F130-K134 WeakPolarHBondContact O-CB 3.3Å; F130-K134 PolarHBondContact O-N 3.24Å |
| 135 | R | 69.6 | Low | 71.2 | Confident | 228 Ų | 228 | 121.2 Ų | 121.2 | 86% | 0.86 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -76.6 | -34.5 | 177.4 | -169.7 | 176.6 | -175.4 | 179.2 | 2 | 113 | F131 S137 | F131-R135 VanDerWaalsContact O-CB 3.29Å; F131-R135 WeakPolarHBondContact O-CB 3.31Å; F131-R135 PolarHBondContact O-N 2.91Å; R135-S137 VanDerWaalsContact C-N 3.25Å; R135-S137 PolarHBondContact O-N 2.9Å |
| 136 | S | 63.9 | Low | 69.3 | Low | 36 Ų | 36 | 121.2 Ų | 121.2 | 25% | 0.252 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -79 | -6.3 | -179.5 | 58.5 | 0 | 0 | 0 | 0 | 113.7 | Y132 L133 K138 | Y132-S136 WeakPolarHBondContact O-CB 3.3Å; Y132-S136 PolarHBondContact O-N 3.17Å; Y132-S136 PolarHBondContact O-OG 2.82Å; L133-S136 WeakPolarHBondContact CA-OG 3.49Å; L133-S136 PolarHBondContact O-N 3.13Å; L133-S136 PolarHBondContact O-OG 2.83Å; S136-K138 WeakPolarHBondContact O-CG 3.37Å; S136-K138 PolarHBondContact O-N 3.49Å |
| 137 | S | 58.7 | Low | 67.4 | Low | 108 Ų | 108 | 121.1 Ų | 121.1 | 76% | 0.755 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 45.5 | 24.2 | -177.6 | 58.9 | 0 | 0 | 0 | 0 | 113.9 | L133 R135 | L133-S137 PolarHBondContact O-N 3.02Å; R135-S137 VanDerWaalsContact C-N 3.25Å; R135-S137 PolarHBondContact O-N 2.9Å |
| 138 | K | 58.4 | Low | 65.2 | Low | 165 Ų | 165 | 125.9 Ų | 125.9 | 72% | 0.717 | 61% | 0.605 | S | S | * | * | trans | -98.6 | 16.6 | -172.4 | -80.3 | -97 | -179.5 | 170 | 0 | 113.1 | S136 | S136-K138 WeakPolarHBondContact O-CG 3.37Å; S136-K138 PolarHBondContact O-N 3.49Å | ||
| 139 | L | 58.7 | Low | 62.8 | Low | 65 Ų | 65 | 128.2 Ų | 128.2 | 34% | 0.34 | 62% | 0.624 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -117.1 | 104.6 | 162.2 | -66.9 | -179.9 | 0 | 0 | 0 | 107.2 | L133 V142 F143 | L133-L139 HydrophobicContact CB-CD1 3.85Å; L133-L139 HydrophobicContact CB-CG 4.33Å; L133-L139 HydrophobicContact CD1-CD1 3.64Å; L133-L139 HydrophobicContact CD2-CD1 3.81Å; L133-L139 HydrophobicContact CD2-CD2 4.31Å; L133-L139 HydrophobicContact CD2-CG 3.83Å; L133-L139 HydrophobicContact CG-CD1 3.95Å; L133-L139 HydrophobicContact CG-CG 4.44Å; L139-V142 HydrophobicContact CD2-CB 4.5Å; L139-F143 HydrophobicContact CD1-CD2 4.18Å; L139-F143 HydrophobicContact CD1-CE2 3.94Å; L139-F143 HydrophobicContact CD2-CD2 4.14Å; L139-F143 HydrophobicContact CD2-CE2 4.31Å |
| 140 | P | 51.6 | Low | 61.2 | Low | 78 Ų | 78 | 132.3 Ų | 132.3 | 51% | 0.506 | 65% | 0.647 | S | S | . | * | T | Hydrogen-bonded Turn | -144.2 | 72.6 | 75 | 42.4 | -25.2 | 0 | 0 | 0 | 112.2 | Y144 | P140-Y144 HydrophobicContact CB-CD2 4.07Å; P140-Y144 HydrophobicContact CB-CG 4.42Å; P140-Y144 VanDerWaalsContact O-CB 3.26Å; P140-Y144 WeakPolarHBondContact O-CB 3.5Å | |
| 141 | R | 53.8 | Low | 59.4 | Low | 218 Ų | 218 | 131 Ų | 131 | 82% | 0.823 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -99.4 | -19.2 | 167.8 | -133.6 | -176.6 | -175.8 | 177.7 | 2.7 | 114 | R145 | R141-R145 WeakPolarHBondContact O-CB 3.32Š|
| 142 | V | 56.2 | Low | 57.4 | Low | 115 Ų | 115 | 132 Ų | 132 | 70% | 0.697 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -96.3 | -40.9 | 175.7 | -177.4 | 0 | 0 | 0 | 0 | 111.1 | L139 | L139-V142 HydrophobicContact CD2-CB 4.5Š|
| 143 | F | 54.8 | Low | 55.6 | Low | 163 Ų | 163 | 130.1 Ų | 130.1 | 72% | 0.715 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.3 | -16.8 | 179 | -66.7 | -72 | 0 | 0 | 0 | 115.1 | L139 | L139-F143 HydrophobicContact CD1-CD2 4.18Å; L139-F143 HydrophobicContact CD1-CE2 3.94Å; L139-F143 HydrophobicContact CD2-CD2 4.14Å; L139-F143 HydrophobicContact CD2-CE2 4.31Å |
| 144 | Y | 49.8 | Very low | 54.1 | Low | 168 Ų | 168 | 133.2 Ų | 133.2 | 66% | 0.659 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.3 | 5.4 | 178.2 | -121.3 | -93.7 | 0 | 0 | 0 | 114 | P140 S146 | P140-Y144 HydrophobicContact CB-CD2 4.07Å; P140-Y144 HydrophobicContact CB-CG 4.42Å; P140-Y144 VanDerWaalsContact O-CB 3.26Å; P140-Y144 WeakPolarHBondContact O-CB 3.5Å; Y144-S146 VanDerWaalsContact C-N 3.31Å |
| 145 | R | 51.8 | Low | 53.1 | Low | 216 Ų | 216 | 128.7 Ų | 128.7 | 82% | 0.815 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.3 | 8.8 | 175.3 | -157.2 | -172 | 172.8 | 178.9 | -1.5 | 112.7 | R141 | R141-R145 WeakPolarHBondContact O-CB 3.32Š|
| 146 | S | 53.3 | Low | 52.3 | Low | 117 Ų | 117 | 122.9 Ų | 122.9 | 82% | 0.818 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.2 | 26.7 | 174.3 | -161.1 | 0 | 0 | 0 | 0 | 112.7 | Y144 | Y144-S146 VanDerWaalsContact C-N 3.31Š|
| 147 | S | 52.4 | Low | 51.7 | Low | 78 Ų | 78 | 124.5 Ų | 124.5 | 55% | 0.545 | 68% | 0.683 | S | S | . | * | trans | -143.9 | 81.3 | 165.6 | 53.7 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 148 | K | 49.3 | Very low | 51.2 | Low | 183 Ų | 183 | 122.7 Ų | 122.7 | 80% | 0.796 | 67% | 0.674 | S | S | * | * | trans | -126.7 | 93.7 | 157.3 | -78.2 | -169.6 | 177.7 | -176.5 | 0 | 108.3 | ||||
| 149 | A | 41.2 | Very low | 50.9 | Low | 101 Ų | 101 | 118.9 Ų | 118.9 | 84% | 0.835 | 67% | 0.674 | S | S | * | * | -81.5 | 134.1 | 123.9 | 0 | 0 | 0 | 0 | 0 | 107.1 | |||||
| 150 | P | 53.6 | Low | 50.4 | Low | 110 Ų | 110 | 124.1 Ų | 124.1 | 71% | 0.714 | 70% | 0.699 | S | S | * | * | trans | -101 | 158.6 | -163.6 | 9.2 | 14.3 | 0 | 0 | 0 | 112.4 | ||||
| 151 | A | 47.9 | Very low | 50.3 | Low | 92 Ų | 92 | 126.2 Ų | 126.2 | 76% | 0.76 | 70% | 0.704 | S | S | * | * | trans | 70.6 | 86.2 | 160.1 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 152 | L | 43.1 | Very low | 50.5 | Low | 148 Ų | 148 | 120.9 Ų | 120.9 | 78% | 0.775 | 70% | 0.698 | S | S | * | * | -139.6 | 135 | 128.5 | -75.3 | -177.9 | 0 | 0 | 0 | 107.5 | |||||
| 153 | Q | 46.2 | Very low | 50.6 | Low | 132 Ų | 132 | 120.5 Ų | 120.5 | 62% | 0.617 | 70% | 0.697 | S | S | * | * | trans | -60.8 | 146 | -177.9 | -56.4 | -166.1 | -16.1 | 0 | 0 | 109.6 | G155 E156 | Q153-G155 PolarHBondContact O-N 3.41Å; Q153-E156 WeakPolarHBondContact CB-OE2 3.42Å; Q153-E156 WeakPolarHBondContact CG-OE2 2.99Å; Q153-E156 PolarHBondContact O-N 3.44Å | ||
| 154 | P | 46.7 | Very low | 50.4 | Low | 131 Ų | 131 | 118.6 Ų | 118.6 | 85% | 0.851 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.1 | -15.4 | 168.7 | -23.1 | 32.9 | 0 | 0 | 0 | 113.4 | ||
| 155 | G | 53.4 | Low | 50.4 | Low | 51 Ų | 51 | 119.1 Ų | 119.1 | 53% | 0.526 | 71% | 0.71 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -80 | -25.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 115.8 | Q153 | Q153-G155 PolarHBondContact O-N 3.41Š|
| 156 | E | 52.9 | Low | 50.6 | Low | 106 Ų | 106 | 114.3 Ų | 114.3 | 50% | 0.495 | 71% | 0.71 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -87.8 | -28.7 | -177.6 | -100.5 | 98.3 | -163.4 | 0 | 0 | 113.7 | Q153 A158 A159 | Q153-E156 WeakPolarHBondContact CB-OE2 3.42Å; Q153-E156 WeakPolarHBondContact CG-OE2 2.99Å; Q153-E156 PolarHBondContact O-N 3.44Å; E156-A158 VanDerWaalsContact C-N 3.33Å; E156-A159 PolarHBondContact O-N 3.04Å |
| 157 | A | 52.4 | Low | 50.8 | Low | 70 Ų | 70 | 113.8 Ų | 113.8 | 58% | 0.579 | 71% | 0.706 | S | S | * | * | G | 310 helix | trans | -77.2 | -19.9 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | A159 | A157-A159 VanDerWaalsContact C-N 3.28Š|
| 158 | A | 48.5 | Very low | 50.5 | Low | 70 Ų | 70 | 116.3 Ų | 116.3 | 58% | 0.579 | 72% | 0.718 | S | S | * | * | G | 310 helix | trans | -79.1 | -10.9 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | E156 | E156-A158 VanDerWaalsContact C-N 3.33Š|
| 159 | A | 52.2 | Low | 50.7 | Low | 85 Ų | 85 | 119.2 Ų | 119.2 | 70% | 0.702 | 72% | 0.724 | S | S | * | * | G | 310 helix | trans | -88.7 | -11.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | E156 A157 | E156-A159 PolarHBondContact O-N 3.04Å; A157-A159 VanDerWaalsContact C-N 3.28Å |
| 160 | M | 48.2 | Very low | 50.7 | Low | 175 Ų | 175 | 123.4 Ų | 123.4 | 86% | 0.862 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -98.4 | -3.2 | 177 | -71.7 | -148.8 | -158.9 | 0 | 0 | 114.4 | ||
| 161 | I | 49.6 | Very low | 50.8 | Low | 121 Ų | 121 | 123.6 Ų | 123.6 | 62% | 0.621 | 73% | 0.725 | S | S | * | * | S | Bend | trans | -93.7 | 115.8 | 165.6 | -57.6 | 174.9 | 0 | 0 | 0 | 105.3 | P163 | I161-P163 WeakPolarHBondContact O-CD 3.02Å; I161-P163 VanDerWaalsContact O-N 3.12Å |
| 162 | P | 57.5 | Low | 51.1 | Low | 107 Ų | 107 | 130.8 Ų | 130.8 | 70% | 0.695 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 125 | 170.6 | -12.2 | 23.6 | 0 | 0 | 0 | 106.6 | ||
| 163 | P | 57.3 | Low | 51.4 | Low | 106 Ų | 106 | 134.9 Ų | 134.9 | 69% | 0.688 | 74% | 0.739 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 132.7 | 169.9 | 22.5 | -31 | 0 | 0 | 0 | 107 | I161 Q165 | I161-P163 WeakPolarHBondContact O-CD 3.02Å; I161-P163 VanDerWaalsContact O-N 3.12Å; P163-Q165 PolarHBondContact O-N 3.18Å |
| 164 | P | 51.8 | Low | 51.9 | Low | 124 Ų | 124 | 134.9 Ų | 134.9 | 81% | 0.805 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -52.8 | 122.1 | 175.1 | 20.9 | -30.8 | 0 | 0 | 0 | 107.5 | S166 | P164-S166 PolarHBondContact O-N 3.03Å; P164-S166 VanDerWaalsContact O-N 3.14Å |
| 165 | Q | 48.8 | Very low | 52.1 | Low | 179 Ų | 179 | 139.3 Ų | 139.3 | 84% | 0.836 | 75% | 0.747 | S | S | * | * | trans | -42.6 | 121.1 | -179.3 | -74.5 | -84.1 | -29.5 | 0 | 0 | 109.4 | P163 S167 | P163-Q165 PolarHBondContact O-N 3.18Å; Q165-S167 PolarHBondContact O-N 3.13Å; Q165-S167 VanDerWaalsContact O-N 3.11Å | ||
| 166 | S | 55.9 | Low | 51.9 | Low | 115 Ų | 115 | 148.5 Ų | 148.5 | 80% | 0.804 | 77% | 0.766 | S | S | * | * | trans | -46.7 | 117 | 169.5 | 52.9 | 0 | 0 | 0 | 0 | 110.1 | P164 | P164-S166 PolarHBondContact O-N 3.03Å; P164-S166 VanDerWaalsContact O-N 3.14Å | ||
| 167 | S | 57.1 | Low | 51.2 | Low | 106 Ų | 106 | 149.7 Ų | 149.7 | 74% | 0.741 | 77% | 0.772 | S | S | * | * | trans | -151.8 | 121.9 | 165.1 | 176.2 | 0 | 0 | 0 | 0 | 108.4 | Q165 | Q165-S167 PolarHBondContact O-N 3.13Å; Q165-S167 VanDerWaalsContact O-N 3.11Å | ||
| 168 | V | 45.9 | Very low | 50.8 | Low | 131 Ų | 131 | 156.4 Ų | 156.4 | 79% | 0.794 | 78% | 0.782 | S | S | * | * | trans | 86.9 | 74.9 | 176.1 | -158.6 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 169 | R | 53.8 | Low | 50.6 | Low | 243 Ų | 243 | 159.1 Ų | 159.1 | 92% | 0.917 | 79% | 0.794 | S | S | * | * | trans | -72.3 | 113.1 | 153.3 | -168.7 | 179.9 | -168.6 | 178.8 | 3.1 | 108.8 | ||||
| 170 | K | 41.6 | Very low | 50.4 | Low | 189 Ų | 189 | 162.4 Ų | 162.4 | 82% | 0.822 | 80% | 0.799 | S | S | * | * | trans | -133.6 | 137.7 | 145.5 | -90.4 | -172.2 | -178.9 | -179.9 | 0 | 110.3 | ||||
| 171 | P | 55.3 | Low | 50.1 | Low | 115 Ų | 115 | 160.9 Ų | 160.9 | 75% | 0.747 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 138 | -166 | -7.5 | 25.9 | 0 | 0 | 0 | 111.4 | Y173 | P171-Y173 PolarHBondContact O-N 3.48Š|
| 172 | R | 55.3 | Low | 49.8 | Very low | 242 Ų | 242 | 167.2 Ų | 167.2 | 91% | 0.913 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 126.6 | 162.1 | -79.8 | -179.9 | 175.4 | 155.9 | -1.1 | 107.8 | V174 | R172-V174 PolarHBondContact O-N 2.98Å; R172-V174 VanDerWaalsContact O-N 3.16Å |
| 173 | Y | 49.5 | Very low | 48.9 | Very low | 234 Ų | 234 | 166.1 Ų | 166.1 | 92% | 0.918 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -49.2 | 122.5 | 174.5 | -101.2 | -97.1 | 0 | 0 | 0 | 109.9 | P171 R175 | P171-Y173 PolarHBondContact O-N 3.48Å; Y173-R175 PolarHBondContact O-N 3.48Å |
| 174 | V | 56.2 | Low | 48 | Very low | 133 Ų | 133 | 168.9 Ų | 168.9 | 81% | 0.806 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 122.1 | 172.2 | 174.8 | 0 | 0 | 0 | 0 | 107.5 | R172 R176 | R172-V174 PolarHBondContact O-N 2.98Å; R172-V174 VanDerWaalsContact O-N 3.16Å; V174-R176 PolarHBondContact O-N 3.32Å |
| 175 | R | 50.3 | Low | 47.4 | Very low | 223 Ų | 223 | 169.9 Ų | 169.9 | 84% | 0.842 | 81% | 0.814 | S | S | * | * | trans | -59.7 | 105.5 | 170 | -175.6 | -179.6 | -178.7 | 109 | -1.9 | 107.3 | Y173 E177 | Y173-R175 PolarHBondContact O-N 3.48Å; R175-E177 PolarHBondContact O-N 3.25Å; R175-E177 VanDerWaalsContact O-N 3.16Å | ||
| 176 | R | 50.4 | Low | 47.4 | Very low | 245 Ų | 245 | 166.8 Ų | 166.8 | 93% | 0.925 | 81% | 0.81 | S | S | * | * | trans | -64.7 | 112.6 | 179.1 | -135.4 | 177.2 | -170.6 | 167 | 1.4 | 108.3 | V174 | V174-R176 PolarHBondContact O-N 3.32Š| ||
| 177 | E | 38.3 | Very low | 46.6 | Very low | 130 Ų | 130 | 166 Ų | 166 | 61% | 0.607 | 81% | 0.811 | S | S | * | * | trans | -82.3 | 126.5 | 171.3 | -83.8 | -93.9 | 157.5 | 0 | 0 | 110.3 | R175 | R175-E177 PolarHBondContact O-N 3.25Å; R175-E177 VanDerWaalsContact O-N 3.16Å | ||
| 178 | R | 43.9 | Very low | 45.8 | Very low | 211 Ų | 211 | 164.9 Ų | 164.9 | 80% | 0.796 | 81% | 0.808 | S | S | * | * | trans | 67.2 | 156 | 156.7 | -79.6 | -166.9 | -166 | 82.7 | 9.6 | 120 | ||||
| 179 | P | 43.9 | Very low | 45.5 | Very low | 127 Ų | 127 | 168.7 Ų | 168.7 | 83% | 0.825 | 81% | 0.814 | S | S | * | * | cis | -136.9 | 176.1 | 26.5 | 30.4 | -5.6 | 0 | 0 | 0 | 118.7 | ||||
| 180 | L | 48.2 | Very low | 44.9 | Very low | 154 Ų | 154 | 162.6 Ų | 162.6 | 81% | 0.806 | 81% | 0.808 | S | S | * | * | trans | -60.9 | 157.2 | 179.7 | -160.9 | 75.2 | 0 | 0 | 0 | 114.3 | ||||
| 181 | D | 40.9 | Very low | 44.8 | Very low | 144 Ų | 144 | 159 Ų | 159 | 77% | 0.77 | 81% | 0.807 | S | S | * | * | trans | 83.9 | 99.9 | 166.3 | -67.8 | -27.5 | 0 | 0 | 0 | 120.5 | ||||
| 182 | R | 43.5 | Very low | 44.4 | Very low | 254 Ų | 254 | 158.3 Ų | 158.3 | 96% | 0.958 | 81% | 0.811 | S | S | * | * | -150 | 129.1 | 129.2 | -119.9 | -170.5 | -179.6 | 101.4 | -1.4 | 110.9 | |||||
| 183 | A | 38 | Very low | 43.9 | Very low | 84 Ų | 84 | 155.4 Ų | 155.4 | 69% | 0.694 | 81% | 0.808 | S | S | * | * | trans | -77.5 | 169.9 | -173.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 184 | M | 40.2 | Very low | 43.5 | Very low | 163 Ų | 163 | 147.7 Ų | 147.7 | 80% | 0.803 | 79% | 0.793 | S | S | * | * | trans | 72.7 | 133.3 | 161.1 | -102.7 | 85.6 | 90.9 | 0 | 0 | 116.9 | ||||
| 185 | D | 38.1 | Very low | 43.1 | Very low | 145 Ų | 145 | 153.5 Ų | 153.5 | 78% | 0.775 | 80% | 0.8 | S | S | * | * | cis | -156.1 | 164.6 | 24.5 | -100.8 | -51.7 | 0 | 0 | 0 | 112.8 | ||||
| 186 | P | 50 | Low | 42.8 | Very low | 114 Ų | 114 | 150.5 Ų | 150.5 | 74% | 0.74 | 80% | 0.799 | S | S | * | * | trans | -101.5 | 117.6 | 179.4 | 35.1 | -22.7 | 0 | 0 | 0 | 111.8 | ||||
| 187 | A | 37.8 | Very low | 42.8 | Very low | 100 Ų | 100 | 144 Ų | 144 | 83% | 0.826 | 79% | 0.791 | S | S | * | * | trans | -171.6 | 147.6 | 161.2 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 188 | A | 41.3 | Very low | 42.8 | Very low | 82 Ų | 82 | 145.5 Ų | 145.5 | 68% | 0.678 | 80% | 0.804 | S | S | * | * | trans | 85 | 83.7 | 144.9 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 189 | F | 39.2 | Very low | 42.9 | Very low | 210 Ų | 210 | 146 Ų | 146 | 92% | 0.921 | 83% | 0.83 | S | S | * | * | 9.9 | 132.9 | 125.6 | -53.9 | -85.6 | 0 | 0 | 0 | 118.7 | |||||
| 190 | S | 40.2 | Very low | 42.9 | Very low | 115 Ų | 115 | 147 Ų | 147 | 80% | 0.804 | 83% | 0.83 | S | S | * | * | -177.1 | 102.9 | 128.9 | -160.9 | 0 | 0 | 0 | 0 | 109.9 | |||||
| 191 | S | 39.8 | Very low | 42.6 | Very low | 113 Ų | 113 | 146.6 Ų | 146.6 | 79% | 0.79 | 83% | 0.831 | S | S | * | * | 64.9 | 100.7 | 108 | 170.8 | 0 | 0 | 0 | 0 | 116.3 | |||||
| 192 | A | 47.5 | Very low | 42.7 | Very low | 101 Ų | 101 | 146.7 Ų | 146.7 | 84% | 0.835 | 84% | 0.835 | S | S | * | * | trans | -167.2 | 97.6 | 131.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 193 | E | 45 | Very low | 42.6 | Very low | 181 Ų | 181 | 140.4 Ų | 140.4 | 85% | 0.846 | 83% | 0.827 | S | S | * | * | trans | -52.8 | 135.2 | 173.1 | -177.5 | 66.1 | -165.7 | 0 | 0 | 112.7 | ||||
| 194 | A | 41.3 | Very low | 42.9 | Very low | 73 Ų | 73 | 143.9 Ų | 143.9 | 60% | 0.603 | 84% | 0.836 | S | S | * | * | trans | -71.4 | 128.4 | 171.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 195 | R | 47.2 | Very low | 43.1 | Very low | 254 Ų | 254 | 142.7 Ų | 142.7 | 96% | 0.958 | 84% | 0.838 | S | S | * | * | trans | -99.5 | 109.9 | 161.4 | -68.6 | -159.9 | -160.2 | -166.4 | 7.4 | 109.8 | ||||
| 196 | I | 44.5 | Very low | 43.5 | Very low | 160 Ų | 160 | 142.5 Ų | 142.5 | 82% | 0.821 | 84% | 0.842 | S | S | * | * | trans | -91 | 130.6 | 165.3 | -62.9 | 163.3 | 0 | 0 | 0 | 106.9 | ||||
| 197 | S | 50.1 | Low | 43 | Very low | 109 Ų | 109 | 144.7 Ų | 144.7 | 76% | 0.762 | 85% | 0.85 | S | S | * | * | trans | -146.7 | 108.6 | 156 | 68.6 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 198 | N | 38.5 | Very low | 43.4 | Very low | 161 Ų | 161 | 148.4 Ų | 148.4 | 86% | 0.861 | 85% | 0.852 | S | S | * | * | trans | -141 | 104.1 | 159.6 | -92.8 | -11.2 | 0 | 0 | 0 | 106.6 | ||||
| 199 | V | 46 | Very low | 43.6 | Very low | 222 Ų | 222 | 154.5 Ų | 154.5 | 100% | 1.345 | 87% | 0.868 | S | S | * | * | trans | -144.8 | 0 | 148.7 | 179.6 | 0 | 0 | 0 | 0 | 106.5 |
Retrieved 199 of 199 residues in 37.3 ms
(Link to these results)