| 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 | 41.8 | Very low | 49.1 | Very low | 240 Ų | 240 | 118.1 Ų | 118.1 | 100% | 1.182 | 65% | 0.645 | S | S | * | * | 0 | 59 | 0 | -167.2 | 179.4 | -174.8 | 0 | 0 | 109.8 | |||||
| 2 | C | 48.7 | Very low | 49.5 | Very low | 104 Ų | 104 | 116.6 Ų | 116.6 | 70% | 0.703 | 64% | 0.642 | S | S | * | * | trans | -131.3 | -13 | -178.1 | -153.4 | 0 | 0 | 0 | 0 | 113 | ||||
| 3 | L | 39.3 | Very low | 49.5 | Very low | 148 Ų | 148 | 116.2 Ų | 116.2 | 78% | 0.775 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.1 | -11.5 | -174.5 | -65.4 | 173.7 | 0 | 0 | 0 | 114.3 | T6 | L3-T6 PolarHBondContact O-OG1 3.43Š|
| 4 | T | 49.7 | Very low | 49.4 | Very low | 93 Ų | 93 | 112 Ų | 112 | 57% | 0.571 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -87.2 | -17.3 | -176.8 | 49.4 | 0 | 0 | 0 | 0 | 114.2 | ||
| 5 | M | 48.6 | Very low | 49.5 | Very low | 151 Ų | 151 | 113.3 Ų | 113.3 | 74% | 0.744 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -79.4 | -22.6 | 179.2 | -68.2 | -64.9 | -178.5 | 0 | 0 | 112.9 | T9 | M5-T9 PolarHBondContact O-OG1 3.44Å |
| 6 | T | 53.4 | Low | 49.4 | Very low | 73 Ų | 73 | 114.9 Ų | 114.9 | 45% | 0.448 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -77.6 | -33.3 | -177.8 | 2.7 | 0 | 0 | 0 | 0 | 112.7 | L3 T9 L10 | L3-T6 PolarHBondContact O-OG1 3.43Å; T6-T9 PolarHBondContact O-OG1 2.9Å; T6-L10 WeakPolarHBondContact O-CB 3.19Å; T6-L10 WeakPolarHBondContact O-CD1 3.27Å; T6-L10 VanDerWaalsContact O-CG 3.3Å; T6-L10 WeakPolarHBondContact O-CG 3.24Å; T6-L10 PolarHBondContact O-N 3.33Å; T6-L10 VanDerWaalsContact O-N 3.16Å |
| 7 | E | 51.9 | Low | 49.2 | Very low | 138 Ų | 138 | 111 Ų | 111 | 65% | 0.645 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -71.5 | -38.3 | -178 | -67.1 | -178.6 | 167 | 0 | 0 | 112.1 | T9 S11 | E7-T9 PolarHBondContact O-N 3.21Å; E7-S11 WeakPolarHBondContact O-CB 3.2Å; E7-S11 PolarHBondContact O-N 3.4Å; E7-S11 PolarHBondContact O-OG 3.41Å |
| 8 | N | 52.5 | Low | 49.5 | Very low | 119 Ų | 119 | 111.7 Ų | 111.7 | 64% | 0.636 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -72.7 | -28.1 | -179.9 | -88.1 | 8.9 | 0 | 0 | 0 | 113.4 | S11 V12 | N8-S11 PolarHBondContact O-OG 3.14Å; N8-V12 VanDerWaalsContact O-CG2 3.27Å; N8-V12 WeakPolarHBondContact O-CG2 3.38Å |
| 9 | T | 51.3 | Low | 49.6 | Very low | 83 Ų | 83 | 113.4 Ų | 113.4 | 51% | 0.509 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -79.7 | -38.8 | 175.9 | 36.8 | 0 | 0 | 0 | 0 | 111.7 | M5 T6 E7 L13 | M5-T9 PolarHBondContact O-OG1 3.44Å; T6-T9 PolarHBondContact O-OG1 2.9Å; E7-T9 PolarHBondContact O-N 3.21Å; T9-L13 PolarHBondContact O-N 3.34Å; T9-L13 VanDerWaalsContact O-N 3.1Å |
| 10 | L | 50.8 | Low | 49.4 | Very low | 94 Ų | 94 | 114.1 Ų | 114.1 | 49% | 0.492 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -67.8 | -37.5 | 176.8 | -72.1 | 169 | 0 | 0 | 0 | 112.5 | T6 L13 S14 | T6-L10 WeakPolarHBondContact O-CB 3.19Å; T6-L10 WeakPolarHBondContact O-CD1 3.27Å; T6-L10 VanDerWaalsContact O-CG 3.3Å; T6-L10 WeakPolarHBondContact O-CG 3.24Å; T6-L10 PolarHBondContact O-N 3.33Å; T6-L10 VanDerWaalsContact O-N 3.16Å; L10-L13 PolarHBondContact O-N 3.37Å; L10-S14 VanDerWaalsContact O-CB 3.24Å; L10-S14 WeakPolarHBondContact O-CB 3.46Å; L10-S14 PolarHBondContact O-N 3.31Å |
| 11 | S | 51.7 | Low | 49.3 | Very low | 56 Ų | 56 | 113.3 Ų | 113.3 | 39% | 0.392 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -67.7 | -36.6 | 178 | 68.1 | 0 | 0 | 0 | 0 | 112.7 | E7 N8 S14 N15 | E7-S11 WeakPolarHBondContact O-CB 3.2Å; E7-S11 PolarHBondContact O-N 3.4Å; E7-S11 PolarHBondContact O-OG 3.41Å; N8-S11 PolarHBondContact O-OG 3.14Å; S11-S14 PolarHBondContact O-N 3.45Å; S11-N15 PolarHBondContact O-ND2 3.42Å |
| 12 | V | 54.4 | Low | 49.8 | Very low | 100 Ų | 100 | 104.2 Ų | 104.2 | 61% | 0.606 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -71.2 | -37.8 | 176.2 | 176.1 | 0 | 0 | 0 | 0 | 111.5 | N8 | N8-V12 VanDerWaalsContact O-CG2 3.27Å; N8-V12 WeakPolarHBondContact O-CG2 3.38Å |
| 13 | L | 49.9 | Very low | 49.8 | Very low | 111 Ų | 111 | 107.1 Ų | 107.1 | 58% | 0.581 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -69.7 | -34.1 | 173.8 | -90.1 | 150.9 | 0 | 0 | 0 | 112.7 | T9 L10 N15 N16 | T9-L13 PolarHBondContact O-N 3.34Å; T9-L13 VanDerWaalsContact O-N 3.1Å; L10-L13 PolarHBondContact O-N 3.37Å; L13-N15 VanDerWaalsContact C-N 3.26Å; L13-N15 PolarHBondContact O-N 2.86Å; L13-N16 PolarHBondContact O-N 3.1Å |
| 14 | S | 47.4 | Very low | 50.4 | Low | 58 Ų | 58 | 104 Ų | 104 | 41% | 0.406 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -63.4 | -28.9 | 179.9 | -173.7 | 0 | 0 | 0 | 0 | 113.2 | L10 S11 | L10-S14 VanDerWaalsContact O-CB 3.24Å; L10-S14 WeakPolarHBondContact O-CB 3.46Å; L10-S14 PolarHBondContact O-N 3.31Å; S11-S14 PolarHBondContact O-N 3.45Å |
| 15 | N | 50.9 | Low | 50.4 | Low | 132 Ų | 132 | 106.4 Ų | 106.4 | 71% | 0.706 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.8 | -16.3 | -174.8 | -69.3 | -21.8 | 0 | 0 | 0 | 114.1 | S11 L13 | S11-N15 PolarHBondContact O-ND2 3.42Å; L13-N15 VanDerWaalsContact C-N 3.26Å; L13-N15 PolarHBondContact O-N 2.86Å |
| 16 | N | 48.8 | Very low | 50.6 | Low | 138 Ų | 138 | 105.2 Ų | 105.2 | 74% | 0.738 | 58% | 0.577 | S | S | * | * | S | Bend | trans | -114 | 4 | -171.4 | -77.1 | -2.6 | 0 | 0 | 0 | 114.9 | L13 | L13-N16 PolarHBondContact O-N 3.1Š|
| 17 | S | 46 | Very low | 50.5 | Low | 49 Ų | 49 | 107.1 Ų | 107.1 | 34% | 0.343 | 58% | 0.581 | S | S | . | * | trans | -133.4 | 107.9 | -176.3 | -63.1 | 0 | 0 | 0 | 0 | 111.8 | L19 Y20 | S17-L19 PolarHBondContact O-N 3.06Å; S17-Y20 PolarHBondContact O-N 3.45Å | ||
| 18 | P | 53.7 | Low | 50.6 | Low | 123 Ų | 123 | 103.8 Ų | 103.8 | 80% | 0.799 | 58% | 0.577 | S | S | * | * | G | 310 helix | trans | -63 | -1.8 | 175.4 | 24.3 | -32.2 | 0 | 0 | 0 | 114 | Y20 | P18-Y20 VanDerWaalsContact C-N 3.28Å; P18-Y20 PolarHBondContact O-N 3.36Å |
| 19 | L | 51.1 | Low | 50.8 | Low | 145 Ų | 145 | 100.7 Ų | 100.7 | 76% | 0.759 | 56% | 0.564 | S | S | * | * | G | 310 helix | trans | -67.6 | -22.5 | 172 | -72.8 | 168.5 | 0 | 0 | 0 | 113.6 | S17 S21 A22 | S17-L19 PolarHBondContact O-N 3.06Å; L19-S21 PolarHBondContact O-N 3.17Å; L19-A22 PolarHBondContact O-N 2.85Å |
| 20 | Y | 45.6 | Very low | 51.1 | Low | 127 Ų | 127 | 101.6 Ų | 101.6 | 50% | 0.498 | 57% | 0.566 | S | S | . | * | G | 310 helix | trans | -74.9 | -12.4 | -180 | -117.6 | -90.6 | 0 | 0 | 0 | 114.1 | S17 P18 A22 P24 | S17-Y20 PolarHBondContact O-N 3.45Å; P18-Y20 VanDerWaalsContact C-N 3.28Å; P18-Y20 PolarHBondContact O-N 3.36Å; Y20-A22 PolarHBondContact O-N 3.17Å; Y20-P24 WeakPolarHBondContact O-CD 3.45Å |
| 21 | S | 47.5 | Very low | 51.4 | Low | 97 Ų | 97 | 101.5 Ų | 101.5 | 68% | 0.678 | 57% | 0.565 | S | S | * | * | G | 310 helix | trans | -68.9 | -20.2 | 173.7 | -175.7 | 0 | 0 | 0 | 0 | 113 | L19 | L19-S21 PolarHBondContact O-N 3.17Š|
| 22 | A | 52.7 | Low | 51.8 | Low | 50 Ų | 50 | 101.7 Ų | 101.7 | 41% | 0.413 | 56% | 0.564 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -91.4 | -25.5 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | L19 Y20 M25 H26 | L19-A22 PolarHBondContact O-N 2.85Å; Y20-A22 PolarHBondContact O-N 3.17Å; A22-M25 PolarHBondContact O-N 3.03Å; A22-H26 PolarHBondContact O-CD2 3.16Å; A22-H26 PolarHBondContact O-N 3.36Å; A22-H26 VanDerWaalsContact O-N 3.14Å |
| 23 | Y | 48.9 | Very low | 52.4 | Low | 164 Ų | 164 | 101.7 Ų | 101.7 | 64% | 0.643 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -65.8 | -43.6 | -173.7 | -133.2 | -96.5 | 0 | 0 | 0 | 114.7 | M25 H27 | Y23-M25 VanDerWaalsContact C-N 3.32Å; Y23-M25 PolarHBondContact O-N 3.28Å; Y23-H27 PolarHBondContact O-N 3.2Å |
| 24 | P | 51.1 | Low | 53.2 | Low | 83 Ų | 83 | 101.2 Ų | 101.2 | 54% | 0.539 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -69.6 | -29.9 | 176.9 | 23.8 | -29.1 | 0 | 0 | 0 | 112.5 | Y20 A28 | Y20-P24 WeakPolarHBondContact O-CD 3.45Å; P24-A28 WeakPolarHBondContact O-CB 3.45Å; P24-A28 PolarHBondContact O-N 3.17Å |
| 25 | M | 50.3 | Low | 54.2 | Low | 143 Ų | 143 | 105 Ų | 105 | 70% | 0.704 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -69.4 | -42.2 | 178.6 | -86.7 | -80.5 | -81.1 | 0 | 0 | 112.7 | A22 Y23 S29 | A22-M25 PolarHBondContact O-N 3.03Å; Y23-M25 VanDerWaalsContact C-N 3.32Å; Y23-M25 PolarHBondContact O-N 3.28Å; M25-S29 PolarHBondContact O-N 3.27Å; M25-S29 PolarHBondContact O-OG 2.85Å |
| 26 | H | 53.2 | Low | 54.8 | Low | 127 Ų | 127 | 104 Ų | 104 | 59% | 0.588 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -71.4 | -39.6 | 177.1 | -82.7 | -74.7 | 0 | 0 | 0 | 112.2 | A22 S29 L30 | A22-H26 PolarHBondContact O-CD2 3.16Å; A22-H26 PolarHBondContact O-N 3.36Å; A22-H26 VanDerWaalsContact O-N 3.14Å; H26-S29 PolarHBondContact O-OG 3.41Å; H26-L30 WeakPolarHBondContact O-CB 3.47Å; H26-L30 WeakPolarHBondContact O-CD1 3.44Å; H26-L30 WeakPolarHBondContact O-CG 3.3Å; H26-L30 PolarHBondContact O-N 3.49Å |
| 27 | H | 50.9 | Low | 55.9 | Low | 112 Ų | 112 | 103.8 Ų | 103.8 | 52% | 0.519 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -69.9 | -39.2 | -178.9 | -154.3 | -19.1 | 0 | 0 | 0 | 112.4 | Y23 S29 I31 | Y23-H27 PolarHBondContact O-N 3.2Å; H27-S29 VanDerWaalsContact C-N 3.33Å; H27-S29 PolarHBondContact O-N 2.98Å; H27-I31 VanDerWaalsContact CE1-CD1 3.42Å; H27-I31 WeakPolarHBondContact CE1-CD1 3.38Å; H27-I31 WeakPolarHBondContact ND1-CD1 3.4Å; H27-I31 WeakPolarHBondContact ND1-CG1 3.47Å; H27-I31 WeakPolarHBondContact O-CD1 3.16Å; H27-I31 WeakPolarHBondContact O-CG1 2.96Å; H27-I31 PolarHBondContact O-N 3.45Å |
| 28 | A | 53.1 | Low | 56.9 | Low | 68 Ų | 68 | 106 Ų | 106 | 56% | 0.562 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -69.5 | -27 | -180 | 0 | 0 | 0 | 0 | 0 | 113.5 | P24 P32 | P24-A28 WeakPolarHBondContact O-CB 3.45Å; P24-A28 PolarHBondContact O-N 3.17Å; A28-P32 WeakPolarHBondContact O-CD 3.25Å; A28-P32 WeakPolarHBondContact O-CG 3.49Å |
| 29 | S | 57.4 | Low | 57.6 | Low | 54 Ų | 54 | 107.8 Ų | 107.8 | 38% | 0.378 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -87.3 | -30 | 178.3 | 52.6 | 0 | 0 | 0 | 0 | 113.2 | M25 H26 H27 N33 | M25-S29 PolarHBondContact O-N 3.27Å; M25-S29 PolarHBondContact O-OG 2.85Å; H26-S29 PolarHBondContact O-OG 3.41Å; H27-S29 VanDerWaalsContact C-N 3.33Å; H27-S29 PolarHBondContact O-N 2.98Å; S29-N33 PolarHBondContact O-ND2 3.36Å |
| 30 | L | 57.4 | Low | 58.3 | Low | 103 Ų | 103 | 102.7 Ų | 102.7 | 54% | 0.539 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -74.5 | -42.9 | -179.2 | -78.5 | 165.1 | 0 | 0 | 0 | 113.2 | H26 N33 L34 | H26-L30 WeakPolarHBondContact O-CB 3.47Å; H26-L30 WeakPolarHBondContact O-CD1 3.44Å; H26-L30 WeakPolarHBondContact O-CG 3.3Å; H26-L30 PolarHBondContact O-N 3.49Å; L30-N33 PolarHBondContact O-N 3.31Å; L30-L34 WeakPolarHBondContact O-CB 3.5Å; L30-L34 PolarHBondContact O-N 2.97Å |
| 31 | I | 58.5 | Low | 59.5 | Low | 92 Ų | 92 | 100.4 Ų | 100.4 | 47% | 0.472 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -56.3 | -53.8 | -178.7 | -63.3 | 162.6 | 0 | 0 | 0 | 112.5 | H27 N33 L34 Q35 | H27-I31 VanDerWaalsContact CE1-CD1 3.42Å; H27-I31 WeakPolarHBondContact CE1-CD1 3.38Å; H27-I31 WeakPolarHBondContact ND1-CD1 3.4Å; H27-I31 WeakPolarHBondContact ND1-CG1 3.47Å; H27-I31 WeakPolarHBondContact O-CD1 3.16Å; H27-I31 WeakPolarHBondContact O-CG1 2.96Å; H27-I31 PolarHBondContact O-N 3.45Å; I31-N33 VanDerWaalsContact C-N 3.32Å; I31-N33 PolarHBondContact O-N 2.81Å; I31-L34 PolarHBondContact O-N 3.34Å; I31-Q35 PolarHBondContact O-N 3.21Å |
| 32 | P | 58.7 | Low | 60.5 | Low | 59 Ų | 59 | 99 Ų | 99 | 38% | 0.383 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -65.3 | -35.9 | -179.3 | 22.6 | -31.4 | 0 | 0 | 0 | 112.1 | A28 Q35 I36 | A28-P32 WeakPolarHBondContact O-CD 3.25Å; A28-P32 WeakPolarHBondContact O-CG 3.49Å; P32-Q35 PolarHBondContact O-N 2.95Å; P32-I36 WeakPolarHBondContact O-CB 3.43Å; P32-I36 WeakPolarHBondContact O-CD1 3.4Å; P32-I36 WeakPolarHBondContact O-CG1 3.42Å; P32-I36 PolarHBondContact O-N 3.4Å |
| 33 | N | 68 | Low | 61 | Low | 100 Ų | 100 | 101.9 Ų | 101.9 | 54% | 0.535 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63 | -44.6 | 176.4 | -85.9 | -50.2 | 0 | 0 | 0 | 112.2 | S29 L30 I31 Q35 I36 Q37 | S29-N33 PolarHBondContact O-ND2 3.36Å; L30-N33 PolarHBondContact O-N 3.31Å; I31-N33 VanDerWaalsContact C-N 3.32Å; I31-N33 PolarHBondContact O-N 2.81Å; N33-Q35 VanDerWaalsContact C-N 3.34Å; N33-Q35 PolarHBondContact O-N 2.85Å; N33-I36 PolarHBondContact O-N 3.03Å; N33-Q37 WeakPolarHBondContact O-CB 3.16Å; N33-Q37 PolarHBondContact O-N 3.38Å |
| 34 | L | 66.3 | Low | 61.7 | Low | 102 Ų | 102 | 99.9 Ų | 99.9 | 53% | 0.534 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -66.5 | -39.6 | 179.7 | -134 | 155.4 | 0 | 0 | 0 | 111 | L30 I31 Q37 I38 | L30-L34 WeakPolarHBondContact O-CB 3.5Å; L30-L34 PolarHBondContact O-N 2.97Å; I31-L34 PolarHBondContact O-N 3.34Å; L34-Q37 PolarHBondContact O-N 2.94Å; L34-I38 HydrophobicContact CD2-CD1 3.61Å; L34-I38 HydrophobicContact CD2-CG1 4.17Å; L34-I38 VanDerWaalsContact O-CG1 3.31Å; L34-I38 WeakPolarHBondContact O-CG1 3.27Å; L34-I38 PolarHBondContact O-N 2.91Å |
| 35 | Q | 68.1 | Low | 62.4 | Low | 137 Ų | 137 | 99 Ų | 99 | 64% | 0.64 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -64.4 | -44.1 | 175.2 | -172.9 | 175.6 | -24.9 | 0 | 0 | 112.2 | I31 P32 N33 Q37 I38 Y39 | I31-Q35 PolarHBondContact O-N 3.21Å; P32-Q35 PolarHBondContact O-N 2.95Å; N33-Q35 VanDerWaalsContact C-N 3.34Å; N33-Q35 PolarHBondContact O-N 2.85Å; Q35-Q37 VanDerWaalsContact C-N 3.31Å; Q35-Q37 PolarHBondContact O-N 3.5Å; Q35-I38 PolarHBondContact O-N 2.93Å; Q35-Y39 WeakPolarHBondContact O-CB 3.11Å; Q35-Y39 PolarHBondContact O-N 3.42Å |
| 36 | I | 64.1 | Low | 63 | Low | 110 Ų | 110 | 95 Ų | 95 | 56% | 0.564 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61.6 | -42.3 | 176.1 | -69.3 | 163.3 | 0 | 0 | 0 | 110.3 | P32 N33 Y39 A40 | P32-I36 WeakPolarHBondContact O-CB 3.43Å; P32-I36 WeakPolarHBondContact O-CD1 3.4Å; P32-I36 WeakPolarHBondContact O-CG1 3.42Å; P32-I36 PolarHBondContact O-N 3.4Å; N33-I36 PolarHBondContact O-N 3.03Å; I36-Y39 PolarHBondContact O-N 3.34Å; I36-A40 VanDerWaalsContact O-CB 3.27Å; I36-A40 WeakPolarHBondContact O-CB 3.38Å; I36-A40 PolarHBondContact O-N 2.73Å |
| 37 | Q | 70.7 | Confident | 63.4 | Low | 134 Ų | 134 | 94.4 Ų | 94.4 | 63% | 0.626 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -67.7 | -40 | -179.1 | -166.4 | 175.2 | -11.4 | 0 | 0 | 112.4 | N33 L34 Q35 T41 | N33-Q37 WeakPolarHBondContact O-CB 3.16Å; N33-Q37 PolarHBondContact O-N 3.38Å; L34-Q37 PolarHBondContact O-N 2.94Å; Q35-Q37 VanDerWaalsContact C-N 3.31Å; Q35-Q37 PolarHBondContact O-N 3.5Å; Q37-T41 WeakPolarHBondContact O-CB 3.33Å; Q37-T41 WeakPolarHBondContact O-CG2 3.31Å; Q37-T41 PolarHBondContact O-N 3.36Å; Q37-T41 PolarHBondContact O-OG1 2.97Å |
| 38 | I | 68.4 | Low | 64 | Low | 95 Ų | 95 | 92 Ų | 92 | 49% | 0.487 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -66.2 | -43.6 | 174.7 | -67.8 | 166.5 | 0 | 0 | 0 | 110.5 | L34 Q35 T41 T42 | L34-I38 HydrophobicContact CD2-CD1 3.61Å; L34-I38 HydrophobicContact CD2-CG1 4.17Å; L34-I38 VanDerWaalsContact O-CG1 3.31Å; L34-I38 WeakPolarHBondContact O-CG1 3.27Å; L34-I38 PolarHBondContact O-N 2.91Å; Q35-I38 PolarHBondContact O-N 2.93Å; I38-T41 WeakPolarHBondContact CA-OG1 3.42Å; I38-T41 PolarHBondContact O-N 3.49Å; I38-T41 PolarHBondContact O-OG1 2.75Å; I38-T41 VanDerWaalsContact O-OG1 3.09Å; I38-T42 VanDerWaalsContact O-CB 3.26Å; I38-T42 WeakPolarHBondContact O-CB 3.4Å; I38-T42 PolarHBondContact O-N 3.47Å; I38-T42 PolarHBondContact O-OG1 2.95Å |
| 39 | Y | 67.4 | Low | 64.7 | Low | 162 Ų | 162 | 92.8 Ų | 92.8 | 64% | 0.635 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -62.2 | -47.4 | 177.8 | -175.8 | -97.3 | 0 | 0 | 0 | 111.2 | Q35 I36 T42 Y43 | Q35-Y39 WeakPolarHBondContact O-CB 3.11Å; Q35-Y39 PolarHBondContact O-N 3.42Å; I36-Y39 PolarHBondContact O-N 3.34Å; Y39-T42 PolarHBondContact O-N 2.9Å; Y39-Y43 WeakPolarHBondContact O-CB 3.21Å; Y39-Y43 PolarHBondContact O-N 3.43Å |
| 40 | A | 67.3 | Low | 65.2 | Low | 37 Ų | 37 | 95.3 Ų | 95.3 | 31% | 0.306 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.5 | -47.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | I36 I44 | I36-A40 VanDerWaalsContact O-CB 3.27Å; I36-A40 WeakPolarHBondContact O-CB 3.38Å; I36-A40 PolarHBondContact O-N 2.73Å; A40-I44 HydrophobicContact CB-CD1 4.44Å; A40-I44 WeakPolarHBondContact O-CB 3.26Å; A40-I44 WeakPolarHBondContact O-CD1 3.18Å; A40-I44 WeakPolarHBondContact O-CG1 2.92Å; A40-I44 PolarHBondContact O-N 3.46Å |
| 41 | T | 69.6 | Low | 65.5 | Low | 79 Ų | 79 | 93.7 Ų | 93.7 | 49% | 0.485 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -66.6 | -41.7 | -179.9 | 48.6 | 0 | 0 | 0 | 0 | 112.2 | Q37 I38 S45 | Q37-T41 WeakPolarHBondContact O-CB 3.33Å; Q37-T41 WeakPolarHBondContact O-CG2 3.31Å; Q37-T41 PolarHBondContact O-N 3.36Å; Q37-T41 PolarHBondContact O-OG1 2.97Å; I38-T41 WeakPolarHBondContact CA-OG1 3.42Å; I38-T41 PolarHBondContact O-N 3.49Å; I38-T41 PolarHBondContact O-OG1 2.75Å; I38-T41 VanDerWaalsContact O-OG1 3.09Å; T41-S45 VanDerWaalsContact O-CB 3.26Å; T41-S45 WeakPolarHBondContact O-CB 3.38Å; T41-S45 PolarHBondContact O-N 3.09Å; T41-S45 PolarHBondContact O-OG 2.88Å |
| 42 | T | 67.8 | Low | 66.1 | Low | 69 Ų | 69 | 94.4 Ų | 94.4 | 42% | 0.423 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.9 | -47.5 | 177.5 | -52.8 | 0 | 0 | 0 | 0 | 110.5 | I38 Y39 S45 T46 | I38-T42 VanDerWaalsContact O-CB 3.26Å; I38-T42 WeakPolarHBondContact O-CB 3.4Å; I38-T42 PolarHBondContact O-N 3.47Å; I38-T42 PolarHBondContact O-OG1 2.95Å; Y39-T42 PolarHBondContact O-N 2.9Å; T42-S45 PolarHBondContact O-N 2.65Å; T42-S45 PolarHBondContact O-OG 2.85Å; T42-T46 HydrophobicContact CG2-CG2 4.14Å; T42-T46 VanDerWaalsContact O-CB 3.31Å; T42-T46 WeakPolarHBondContact O-CB 3.18Å; T42-T46 WeakPolarHBondContact O-CG2 3.26Å; T42-T46 PolarHBondContact O-N 2.74Å; T42-T46 PolarHBondContact O-OG1 3.06Å |
| 43 | Y | 65.2 | Low | 66.8 | Low | 110 Ų | 110 | 94.8 Ų | 94.8 | 43% | 0.431 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.6 | -48.2 | -179.6 | -170.2 | -96.9 | 0 | 0 | 0 | 111.6 | Y39 S45 F47 | Y39-Y43 WeakPolarHBondContact O-CB 3.21Å; Y39-Y43 PolarHBondContact O-N 3.43Å; Y43-S45 VanDerWaalsContact C-N 3.32Å; Y43-S45 PolarHBondContact O-N 2.96Å; Y43-F47 HydrophobicContact CD2-CD2 4.07Å; Y43-F47 AromaticContact CE2-CD2 3.54Å; Y43-F47 HydrophobicContact CE2-CD2 3.54Å; Y43-F47 AromaticContact CE2-CE2 3.8Å; Y43-F47 HydrophobicContact CE2-CE2 3.8Å; Y43-F47 HydrophobicContact CE2-CG 4.1Å; Y43-F47 AromaticContact CZ-CD2 3.96Å; Y43-F47 WeakPolarHBondContact O-CB 3.44Å; Y43-F47 PolarHBondContact O-N 2.81Å; Y43-F47 VanDerWaalsContact O-N 3.1Å |
| 44 | I | 62.3 | Low | 67.1 | Low | 121 Ų | 121 | 93.1 Ų | 93.1 | 62% | 0.621 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -66.4 | -33.4 | -178.6 | -65.3 | 167.2 | 0 | 0 | 0 | 111.8 | A40 P48 | A40-I44 HydrophobicContact CB-CD1 4.44Å; A40-I44 WeakPolarHBondContact O-CB 3.26Å; A40-I44 WeakPolarHBondContact O-CD1 3.18Å; A40-I44 WeakPolarHBondContact O-CG1 2.92Å; A40-I44 PolarHBondContact O-N 3.46Å; I44-P48 WeakPolarHBondContact O-CD 3.1Å; I44-P48 WeakPolarHBondContact O-CG 2.99Å |
| 45 | S | 65.4 | Low | 67.5 | Low | 64 Ų | 64 | 90.4 Ų | 90.4 | 45% | 0.448 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -83.5 | -44.3 | -179.8 | 59.4 | 0 | 0 | 0 | 0 | 113 | T41 T42 Y43 C49 | T41-S45 VanDerWaalsContact O-CB 3.26Å; T41-S45 WeakPolarHBondContact O-CB 3.38Å; T41-S45 PolarHBondContact O-N 3.09Å; T41-S45 PolarHBondContact O-OG 2.88Å; T42-S45 PolarHBondContact O-N 2.65Å; T42-S45 PolarHBondContact O-OG 2.85Å; Y43-S45 VanDerWaalsContact C-N 3.32Å; Y43-S45 PolarHBondContact O-N 2.96Å; S45-C49 PolarHBondContact O-SG 3.37Å |
| 46 | T | 64.2 | Low | 67.9 | Low | 60 Ų | 60 | 89.4 Ų | 89.4 | 37% | 0.368 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -80.9 | -38 | -172 | 60.1 | 0 | 0 | 0 | 0 | 112.7 | T42 C49 I50 | T42-T46 HydrophobicContact CG2-CG2 4.14Å; T42-T46 VanDerWaalsContact O-CB 3.31Å; T42-T46 WeakPolarHBondContact O-CB 3.18Å; T42-T46 WeakPolarHBondContact O-CG2 3.26Å; T42-T46 PolarHBondContact O-N 2.74Å; T42-T46 PolarHBondContact O-OG1 3.06Å; T46-C49 PolarHBondContact O-N 3.1Å; T46-I50 WeakPolarHBondContact O-CG1 3.41Å; T46-I50 PolarHBondContact O-N 3.48Å |
| 47 | F | 61.9 | Low | 68.5 | Low | 115 Ų | 115 | 88 Ų | 88 | 50% | 0.504 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -64.4 | -46 | -173.9 | -142.7 | -92.1 | 0 | 0 | 0 | 112.6 | Y43 C49 H51 | Y43-F47 HydrophobicContact CD2-CD2 4.07Å; Y43-F47 AromaticContact CE2-CD2 3.54Å; Y43-F47 HydrophobicContact CE2-CD2 3.54Å; Y43-F47 AromaticContact CE2-CE2 3.8Å; Y43-F47 HydrophobicContact CE2-CE2 3.8Å; Y43-F47 HydrophobicContact CE2-CG 4.1Å; Y43-F47 AromaticContact CZ-CD2 3.96Å; Y43-F47 WeakPolarHBondContact O-CB 3.44Å; Y43-F47 PolarHBondContact O-N 2.81Å; Y43-F47 VanDerWaalsContact O-N 3.1Å; F47-C49 VanDerWaalsContact C-N 3.34Å; F47-C49 PolarHBondContact O-N 2.88Å; F47-H51 VanDerWaalsContact O-CB 3.28Å; F47-H51 WeakPolarHBondContact O-CB 3.38Å; F47-H51 PolarHBondContact O-N 3.01Å; F47-H51 VanDerWaalsContact O-N 3.11Å |
| 48 | P | 61.7 | Low | 68.9 | Low | 61 Ų | 61 | 87 Ų | 87 | 40% | 0.396 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -65 | -38 | 175.4 | -20.2 | 33.5 | 0 | 0 | 0 | 112.3 | I44 H51 L52 | I44-P48 WeakPolarHBondContact O-CD 3.1Å; I44-P48 WeakPolarHBondContact O-CG 2.99Å; P48-H51 PolarHBondContact O-N 2.91Å; P48-L52 WeakPolarHBondContact O-CB 3.31Å; P48-L52 WeakPolarHBondContact O-CD1 3.4Å; P48-L52 WeakPolarHBondContact O-CG 3.37Å; P48-L52 PolarHBondContact O-N 3.27Å |
| 49 | C | 68 | Low | 69.2 | Low | 84 Ų | 84 | 83.6 Ų | 83.6 | 57% | 0.568 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -67.7 | -45.7 | -177.6 | -68.8 | 0 | 0 | 0 | 0 | 112.1 | S45 T46 F47 H51 S53 | S45-C49 PolarHBondContact O-SG 3.37Å; T46-C49 PolarHBondContact O-N 3.1Å; F47-C49 VanDerWaalsContact C-N 3.34Å; F47-C49 PolarHBondContact O-N 2.88Å; C49-H51 VanDerWaalsContact C-N 3.3Å; C49-H51 PolarHBondContact O-N 3.29Å; C49-S53 VanDerWaalsContact O-CB 3.28Å; C49-S53 WeakPolarHBondContact O-CB 3.13Å; C49-S53 PolarHBondContact O-N 2.59Å |
| 50 | I | 67.8 | Low | 69.4 | Low | 108 Ų | 108 | 79.3 Ų | 79.3 | 55% | 0.554 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -62.2 | -44.1 | 176.4 | -65.5 | 167.6 | 0 | 0 | 0 | 109.2 | T46 S53 T54 | T46-I50 WeakPolarHBondContact O-CG1 3.41Å; T46-I50 PolarHBondContact O-N 3.48Å; I50-S53 PolarHBondContact O-N 3.5Å; I50-T54 HydrophobicContact CG2-CG2 4.38Å; I50-T54 WeakPolarHBondContact O-CG2 3.28Å; I50-T54 PolarHBondContact O-N 3.38Å; I50-T54 PolarHBondContact O-OG1 3.4Å; I50-T54 VanDerWaalsContact O-OG1 3.06Å |
| 51 | H | 64.8 | Low | 69.5 | Low | 68 Ų | 68 | 83.4 Ų | 83.4 | 32% | 0.315 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -65 | -43.7 | -179 | -164.8 | -86.9 | 0 | 0 | 0 | 113.1 | F47 P48 C49 T54 T55 F88 | F47-H51 VanDerWaalsContact O-CB 3.28Å; F47-H51 WeakPolarHBondContact O-CB 3.38Å; F47-H51 PolarHBondContact O-N 3.01Å; F47-H51 VanDerWaalsContact O-N 3.11Å; P48-H51 PolarHBondContact O-N 2.91Å; C49-H51 VanDerWaalsContact C-N 3.3Å; C49-H51 PolarHBondContact O-N 3.29Å; H51-T54 PolarHBondContact O-OG1 3.11Å; H51-T54 VanDerWaalsContact O-OG1 3.1Å; H51-T55 VanDerWaalsContact O-CB 3.3Å; H51-T55 WeakPolarHBondContact O-CB 3.41Å; H51-T55 PolarHBondContact O-N 3.33Å; H51-T55 PolarHBondContact O-OG1 2.86Å; H51-F88 AromaticContact CE1-CD2 3.56Å; H51-F88 AromaticContact CE1-CE2 3.02Å; H51-F88 WeakPolarHBondContact CE1-CE2 3.09Å; H51-F88 AromaticContact CE1-CZ 3.4Å; H51-F88 VanDerWaalsContact CE1-CZ 3.4Å; H51-F88 WeakPolarHBondContact CE1-CZ 3.44Å; H51-F88 AromaticContact ND1-CE2 3.68Å; H51-F88 AromaticContact ND1-CZ 3.54Å; H51-F88 AromaticContact NE2-CE2 3.31Å; H51-F88 VanDerWaalsContact NE2-CE2 3.31Å; H51-F88 WeakPolarHBondContact NE2-CE2 3.44Å; H51-F88 AromaticContact NE2-CZ 3.78Å |
| 52 | L | 70.4 | Confident | 69.4 | Low | 107 Ų | 107 | 84.1 Ų | 84.1 | 56% | 0.56 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -63.3 | -44.2 | 175.5 | -84 | 154.8 | 0 | 0 | 0 | 111.3 | P48 T55 L56 | P48-L52 WeakPolarHBondContact O-CB 3.31Å; P48-L52 WeakPolarHBondContact O-CD1 3.4Å; P48-L52 WeakPolarHBondContact O-CG 3.37Å; P48-L52 PolarHBondContact O-N 3.27Å; L52-T55 PolarHBondContact O-N 3.37Å; L52-L56 WeakPolarHBondContact O-CB 3.09Å; L52-L56 VanDerWaalsContact O-CG 3.26Å; L52-L56 WeakPolarHBondContact O-CG 3.43Å; L52-L56 PolarHBondContact O-N 3.49Å |
| 53 | S | 73.5 | Confident | 69.4 | Low | 68 Ų | 68 | 83.1 Ų | 83.1 | 48% | 0.476 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -64.4 | -46.5 | -179.3 | -174.2 | 0 | 0 | 0 | 0 | 112.3 | C49 I50 L56 T57 | C49-S53 VanDerWaalsContact O-CB 3.28Å; C49-S53 WeakPolarHBondContact O-CB 3.13Å; C49-S53 PolarHBondContact O-N 2.59Å; I50-S53 PolarHBondContact O-N 3.5Å; S53-L56 PolarHBondContact O-N 2.99Å; S53-T57 WeakPolarHBondContact O-CB 3.31Å; S53-T57 WeakPolarHBondContact O-CG2 3.02Å; S53-T57 PolarHBondContact O-N 2.87Å; S53-T57 PolarHBondContact O-OG1 3.35Å |
| 54 | T | 73.7 | Confident | 69.5 | Low | 64 Ų | 64 | 85.3 Ų | 85.3 | 39% | 0.393 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -65.2 | -41.1 | 177.3 | 54.9 | 0 | 0 | 0 | 0 | 111.4 | I50 H51 T57 I58 | I50-T54 HydrophobicContact CG2-CG2 4.38Å; I50-T54 WeakPolarHBondContact O-CG2 3.28Å; I50-T54 PolarHBondContact O-N 3.38Å; I50-T54 PolarHBondContact O-OG1 3.4Å; I50-T54 VanDerWaalsContact O-OG1 3.06Å; H51-T54 PolarHBondContact O-OG1 3.11Å; H51-T54 VanDerWaalsContact O-OG1 3.1Å; T54-T57 WeakPolarHBondContact CA-OG1 3.36Å; T54-T57 PolarHBondContact O-N 3.34Å; T54-T57 PolarHBondContact O-OG1 3.4Å; T54-I58 WeakPolarHBondContact O-CB 3.28Å; T54-I58 WeakPolarHBondContact O-CD1 3.38Å; T54-I58 WeakPolarHBondContact O-CG1 3.33Å; T54-I58 PolarHBondContact O-N 3.46Å |
| 55 | T | 75.7 | Confident | 69.5 | Low | 46 Ų | 46 | 82.5 Ų | 82.5 | 28% | 0.282 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -63.9 | -45.5 | 178.3 | -54.2 | 0 | 0 | 0 | 0 | 111.3 | H51 L52 S59 | H51-T55 VanDerWaalsContact O-CB 3.3Å; H51-T55 WeakPolarHBondContact O-CB 3.41Å; H51-T55 PolarHBondContact O-N 3.33Å; H51-T55 PolarHBondContact O-OG1 2.86Å; L52-T55 PolarHBondContact O-N 3.37Å; T55-S59 WeakPolarHBondContact O-CB 3.49Å; T55-S59 PolarHBondContact O-N 2.98Å; T55-S59 PolarHBondContact O-OG 3.42Å |
| 56 | L | 76.4 | Confident | 69.2 | Low | 116 Ų | 116 | 80 Ų | 80 | 61% | 0.607 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -66.4 | -41.3 | 179.3 | -74.6 | 171.1 | 0 | 0 | 0 | 112.5 | L52 S53 S59 S60 | L52-L56 WeakPolarHBondContact O-CB 3.09Å; L52-L56 VanDerWaalsContact O-CG 3.26Å; L52-L56 WeakPolarHBondContact O-CG 3.43Å; L52-L56 PolarHBondContact O-N 3.49Å; S53-L56 PolarHBondContact O-N 2.99Å; L56-S59 PolarHBondContact O-N 3.26Å; L56-S60 WeakPolarHBondContact O-CB 3.26Å; L56-S60 PolarHBondContact O-N 3.25Å; L56-S60 PolarHBondContact O-OG 2.98Å |
| 57 | T | 77.5 | Confident | 69.1 | Low | 79 Ų | 79 | 82.8 Ų | 82.8 | 49% | 0.485 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -67.4 | -40.3 | 179.2 | 46.4 | 0 | 0 | 0 | 0 | 112.4 | S53 T54 S59 S60 L61 | S53-T57 WeakPolarHBondContact O-CB 3.31Å; S53-T57 WeakPolarHBondContact O-CG2 3.02Å; S53-T57 PolarHBondContact O-N 2.87Å; S53-T57 PolarHBondContact O-OG1 3.35Å; T54-T57 WeakPolarHBondContact CA-OG1 3.36Å; T54-T57 PolarHBondContact O-N 3.34Å; T54-T57 PolarHBondContact O-OG1 3.4Å; T57-S59 VanDerWaalsContact C-N 3.34Å; T57-S60 PolarHBondContact O-N 3Å; T57-S60 PolarHBondContact O-OG 3.11Å; T57-L61 WeakPolarHBondContact O-CB 3.33Å; T57-L61 PolarHBondContact O-N 3.48Å |
| 58 | I | 77.5 | Confident | 69.2 | Low | 113 Ų | 113 | 86.9 Ų | 86.9 | 58% | 0.579 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -65.7 | -41.8 | 174.4 | -64.8 | 164.7 | 0 | 0 | 0 | 110.3 | T54 S60 L61 F62 | T54-I58 WeakPolarHBondContact O-CB 3.28Å; T54-I58 WeakPolarHBondContact O-CD1 3.38Å; T54-I58 WeakPolarHBondContact O-CG1 3.33Å; T54-I58 PolarHBondContact O-N 3.46Å; I58-S60 PolarHBondContact O-N 2.86Å; I58-L61 PolarHBondContact O-N 2.94Å; I58-F62 WeakPolarHBondContact O-CB 3.35Å; I58-F62 PolarHBondContact O-N 2.94Å |
| 59 | S | 75.5 | Confident | 69.1 | Low | 24 Ų | 24 | 86 Ų | 86 | 17% | 0.168 | 48% | 0.481 | C | S | . | . | H | α-helix | trans | -62.3 | -43.3 | 177.8 | -56.8 | 0 | 0 | 0 | 0 | 112 | T55 L56 T57 A63 L81 | T55-S59 WeakPolarHBondContact O-CB 3.49Å; T55-S59 PolarHBondContact O-N 2.98Å; T55-S59 PolarHBondContact O-OG 3.42Å; L56-S59 PolarHBondContact O-N 3.26Å; T57-S59 VanDerWaalsContact C-N 3.34Å; S59-A63 VanDerWaalsContact O-CB 3.29Å; S59-A63 WeakPolarHBondContact O-CB 3.3Å; S59-A63 PolarHBondContact O-N 2.98Å; S59-L81 WeakPolarHBondContact OG-CD2 3.36Å |
| 60 | S | 72 | Confident | 69.1 | Low | 73 Ų | 73 | 88.4 Ų | 88.4 | 51% | 0.51 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -70.4 | -39.8 | 179.3 | 70.6 | 0 | 0 | 0 | 0 | 112.2 | L56 T57 I58 F62 A63 F64 | L56-S60 WeakPolarHBondContact O-CB 3.26Å; L56-S60 PolarHBondContact O-N 3.25Å; L56-S60 PolarHBondContact O-OG 2.98Å; T57-S60 PolarHBondContact O-N 3Å; T57-S60 PolarHBondContact O-OG 3.11Å; I58-S60 PolarHBondContact O-N 2.86Å; S60-F62 VanDerWaalsContact C-N 3.33Å; S60-F62 PolarHBondContact O-N 3.46Å; S60-A63 PolarHBondContact O-N 3.1Å; S60-F64 WeakPolarHBondContact O-CB 3.34Å; S60-F64 PolarHBondContact O-N 2.91Å |
| 61 | L | 68.6 | Low | 69.4 | Low | 123 Ų | 123 | 89.6 Ų | 89.6 | 64% | 0.644 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -60.8 | -44.6 | 175.7 | -177.5 | 68.5 | 0 | 0 | 0 | 111.1 | T57 I58 F64 A65 | T57-L61 WeakPolarHBondContact O-CB 3.33Å; T57-L61 PolarHBondContact O-N 3.48Å; I58-L61 PolarHBondContact O-N 2.94Å; L61-F64 PolarHBondContact O-N 3.42Å; L61-A65 PolarHBondContact O-N 3.39Å |
| 62 | F | 68.3 | Low | 69.9 | Low | 93 Ų | 93 | 93 Ų | 93 | 41% | 0.408 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -70.8 | -39.7 | 178.5 | -163 | -69.8 | 0 | 0 | 0 | 111.4 | I58 S60 F64 A65 N66 H77 | I58-F62 WeakPolarHBondContact O-CB 3.35Å; I58-F62 PolarHBondContact O-N 2.94Å; S60-F62 VanDerWaalsContact C-N 3.33Å; S60-F62 PolarHBondContact O-N 3.46Å; F62-F64 VanDerWaalsContact C-N 3.3Å; F62-F64 PolarHBondContact O-N 3.04Å; F62-A65 PolarHBondContact O-N 2.69Å; F62-N66 VanDerWaalsContact CD1-CG 3.45Å; F62-N66 WeakPolarHBondContact CD1-ND2 3.13Å; F62-N66 WeakPolarHBondContact CD1-OD1 3.34Å; F62-N66 VanDerWaalsContact CE1-CG 3.42Å; F62-N66 WeakPolarHBondContact CE1-ND2 3.41Å; F62-N66 WeakPolarHBondContact CE1-OD1 3.42Å; F62-N66 WeakPolarHBondContact O-CB 3.39Å; F62-N66 PolarHBondContact O-N 3.02Å; F62-H77 VanDerWaalsContact CB-CE1 3.44Å; F62-H77 WeakPolarHBondContact CB-CE1 2.98Å; F62-H77 VanDerWaalsContact CB-NE2 3.33Å; F62-H77 WeakPolarHBondContact CB-NE2 2.91Å; F62-H77 HydrophobicContact CD1-CB 4.13Å; F62-H77 AromaticContact CD1-CD2 3.36Å; F62-H77 WeakPolarHBondContact CD1-CD2 3.35Å; F62-H77 AromaticContact CD1-CE1 2.88Å; F62-H77 WeakPolarHBondContact CD1-CE1 3.41Å; F62-H77 AromaticContact CD1-CG 3.19Å; F62-H77 AromaticContact CD1-ND1 2.91Å; F62-H77 WeakPolarHBondContact CD1-ND1 3.29Å; F62-H77 AromaticContact CD1-NE2 3.16Å; F62-H77 WeakPolarHBondContact CD1-NE2 3.16Å; F62-H77 AromaticContact CD2-CE1 3.56Å; F62-H77 HydrophobicContact CE1-CB 3.82Å; F62-H77 AromaticContact CE1-CD2 3.94Å; F62-H77 AromaticContact CE1-CE1 3.34Å; F62-H77 WeakPolarHBondContact CE1-CE1 2.84Å; F62-H77 AromaticContact CE1-CG 3.26Å; F62-H77 AromaticContact CE1-ND1 2.84Å; F62-H77 WeakPolarHBondContact CE1-ND1 3.34Å; F62-H77 AromaticContact CE1-NE2 3.97Å; F62-H77 AromaticContact CE2-CE1 3.95Å; F62-H77 AromaticContact CE2-ND1 3.96Å; F62-H77 AromaticContact CG-CE1 2.98Å; F62-H77 WeakPolarHBondContact CG-CE1 3.44Å; F62-H77 AromaticContact CG-ND1 3.51Å; F62-H77 AromaticContact CG-NE2 3.34Å; F62-H77 VanDerWaalsContact CG-NE2 3.34Å; F62-H77 WeakPolarHBondContact CG-NE2 3.38Å; F62-H77 AromaticContact CZ-CE1 3.84Å; F62-H77 AromaticContact CZ-ND1 3.41Å; F62-H77 WeakPolarHBondContact CZ-ND1 2.88Å |
| 63 | A | 66.8 | Low | 70.1 | Confident | 48 Ų | 48 | 90.2 Ų | 90.2 | 40% | 0.397 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -57.8 | -42.6 | 171.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | S59 S60 N66 T67 | S59-A63 VanDerWaalsContact O-CB 3.29Å; S59-A63 WeakPolarHBondContact O-CB 3.3Å; S59-A63 PolarHBondContact O-N 2.98Å; S60-A63 PolarHBondContact O-N 3.1Å; A63-N66 CarbonylContact O-C 3.58Å; A63-N66 WeakPolarHBondContact O-CB 3.4Å; A63-N66 PolarHBondContact O-N 3.06Å; A63-T67 WeakPolarHBondContact O-CG2 3.38Å; A63-T67 PolarHBondContact O-N 3.45Å |
| 64 | F | 66.8 | Low | 70.2 | Confident | 157 Ų | 157 | 89.5 Ų | 89.5 | 69% | 0.689 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -62.2 | -47.8 | 175 | 179.4 | -99.3 | 0 | 0 | 0 | 111.6 | S60 L61 F62 N66 T67 | S60-F64 WeakPolarHBondContact O-CB 3.34Å; S60-F64 PolarHBondContact O-N 2.91Å; L61-F64 PolarHBondContact O-N 3.42Å; F62-F64 VanDerWaalsContact C-N 3.3Å; F62-F64 PolarHBondContact O-N 3.04Å; F64-N66 PolarHBondContact O-N 2.75Å; F64-T67 PolarHBondContact O-N 3.36Å; F64-T67 VanDerWaalsContact O-N 3.16Å; F64-T67 PolarHBondContact O-OG1 2.96Å |
| 65 | A | 62.4 | Low | 70.4 | Confident | 61 Ų | 61 | 90.3 Ų | 90.3 | 50% | 0.504 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -59.6 | -32.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | L61 F62 | L61-A65 PolarHBondContact O-N 3.39Å; F62-A65 PolarHBondContact O-N 2.69Å |
| 66 | N | 60.6 | Low | 70.7 | Confident | 12 Ų | 12 | 91.8 Ų | 91.8 | 6% | 0.064 | 51% | 0.505 | C | S | . | . | H | α-helix | trans | -77.7 | -22.3 | 178 | -76.9 | -10.9 | 0 | 0 | 0 | 115.2 | F62 A63 F64 K68 S69 T74 H77 | F62-N66 VanDerWaalsContact CD1-CG 3.45Å; F62-N66 WeakPolarHBondContact CD1-ND2 3.13Å; F62-N66 WeakPolarHBondContact CD1-OD1 3.34Å; F62-N66 VanDerWaalsContact CE1-CG 3.42Å; F62-N66 WeakPolarHBondContact CE1-ND2 3.41Å; F62-N66 WeakPolarHBondContact CE1-OD1 3.42Å; F62-N66 WeakPolarHBondContact O-CB 3.39Å; F62-N66 PolarHBondContact O-N 3.02Å; A63-N66 CarbonylContact O-C 3.58Å; A63-N66 WeakPolarHBondContact O-CB 3.4Å; A63-N66 PolarHBondContact O-N 3.06Å; F64-N66 PolarHBondContact O-N 2.75Å; N66-K68 PolarHBondContact O-N 2.96Å; N66-S69 WeakPolarHBondContact CA-OG 3.4Å; N66-S69 PolarHBondContact O-N 3.34Å; N66-S69 PolarHBondContact OD1-OG 3.02Å; N66-T74 HydrophobicContact CB-CG2 4.34Å; N66-H77 VanDerWaalsContact ND2-CB 3.32Å; N66-H77 WeakPolarHBondContact ND2-CB 3.47Å |
| 67 | T | 61.2 | Low | 70.7 | Confident | 119 Ų | 119 | 87 Ų | 87 | 73% | 0.73 | 48% | 0.479 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58 | -19.6 | 174.6 | 59.2 | 0 | 0 | 0 | 0 | 112.1 | A63 F64 | A63-T67 WeakPolarHBondContact O-CG2 3.38Å; A63-T67 PolarHBondContact O-N 3.45Å; F64-T67 PolarHBondContact O-N 3.36Å; F64-T67 VanDerWaalsContact O-N 3.16Å; F64-T67 PolarHBondContact O-OG1 2.96Å |
| 68 | K | 64.8 | Low | 70.9 | Confident | 200 Ų | 200 | 89 Ų | 89 | 87% | 0.87 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.5 | -17.8 | 173.6 | -166.1 | 170.4 | -179.9 | 179.9 | 0 | 114.2 | N66 | N66-K68 PolarHBondContact O-N 2.96Š|
| 69 | S | 59.2 | Low | 71.3 | Confident | 44 Ų | 44 | 88.7 Ų | 88.7 | 31% | 0.308 | 49% | 0.485 | S | S | . | . | S | Bend | trans | -112.1 | 145.4 | -172.2 | 66.4 | 0 | 0 | 0 | 0 | 112.8 | N66 T73 | N66-S69 WeakPolarHBondContact CA-OG 3.4Å; N66-S69 PolarHBondContact O-N 3.34Å; N66-S69 PolarHBondContact OD1-OG 3.02Å; S69-T73 VanDerWaalsContact C-OG1 3.29Å; S69-T73 WeakPolarHBondContact CB-OG1 3.2Å; S69-T73 PolarHBondContact O-OG1 3.31Å; S69-T73 WeakPolarHBondContact OG-CB 3.29Å; S69-T73 PolarHBondContact OG-OG1 2.91Å |
| 70 | N | 67.4 | Low | 71.7 | Confident | 134 Ų | 134 | 92 Ų | 92 | 72% | 0.717 | 50% | 0.5 | S | S | * | . | trans | -49.6 | 156 | -167.4 | -147.5 | -28.9 | 0 | 0 | 0 | 114.2 | H72 T73 | N70-H72 PolarHBondContact O-N 3.46Å; N70-T73 PolarHBondContact O-N 3.47Å; N70-T73 PolarHBondContact O-OG1 3.26Å | ||
| 71 | L | 74 | Confident | 72.3 | Confident | 132 Ų | 132 | 91.5 Ų | 91.5 | 69% | 0.691 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -47.5 | -26.7 | -176.8 | -176.2 | 138.8 | 0 | 0 | 0 | 115 | T74 V75 | L71-T74 PolarHBondContact O-OG1 3.19Å; L71-V75 HydrophobicContact CD2-CG2 4.37Å; L71-V75 WeakPolarHBondContact O-CG2 3.47Å; L71-V75 PolarHBondContact O-N 3.02Å |
| 72 | H | 75.9 | Confident | 73.1 | Confident | 141 Ų | 141 | 91 Ų | 91 | 65% | 0.653 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -63.9 | -40.8 | 173.6 | -170.4 | -100 | 0 | 0 | 0 | 113.5 | N70 V75 V76 | N70-H72 PolarHBondContact O-N 3.46Å; H72-V75 PolarHBondContact O-N 3.37Å; H72-V76 WeakPolarHBondContact O-CG2 3.33Å; H72-V76 PolarHBondContact O-N 2.65Å; H72-V76 VanDerWaalsContact O-N 3.08Å |
| 73 | T | 73.9 | Confident | 74 | Confident | 47 Ų | 47 | 91.4 Ų | 91.4 | 29% | 0.288 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -68.9 | -35.8 | -179.7 | 56.4 | 0 | 0 | 0 | 0 | 111.5 | S69 N70 H77 | S69-T73 VanDerWaalsContact C-OG1 3.29Å; S69-T73 WeakPolarHBondContact CB-OG1 3.2Å; S69-T73 PolarHBondContact O-OG1 3.31Å; S69-T73 WeakPolarHBondContact OG-CB 3.29Å; S69-T73 PolarHBondContact OG-OG1 2.91Å; N70-T73 PolarHBondContact O-N 3.47Å; N70-T73 PolarHBondContact O-OG1 3.26Å; T73-H77 VanDerWaalsContact O-CB 3.29Å; T73-H77 WeakPolarHBondContact O-CB 3.33Å; T73-H77 PolarHBondContact O-N 2.89Å |
| 74 | T | 75.7 | Confident | 74.8 | Confident | 53 Ų | 53 | 92.4 Ų | 92.4 | 33% | 0.325 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65.6 | -41 | 176.5 | 58.4 | 0 | 0 | 0 | 0 | 111.6 | N66 L71 H77 L78 | N66-T74 HydrophobicContact CB-CG2 4.34Å; L71-T74 PolarHBondContact O-OG1 3.19Å; T74-H77 PolarHBondContact O-N 3Å; T74-L78 WeakPolarHBondContact O-CG 3.34Å; T74-L78 PolarHBondContact O-N 3.35Å |
| 75 | V | 79 | Confident | 75.6 | Confident | 81 Ų | 81 | 92.3 Ų | 92.3 | 49% | 0.491 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64 | -48.9 | 176.1 | 173.8 | 0 | 0 | 0 | 0 | 111.6 | L71 H72 H77 L78 L79 | L71-V75 HydrophobicContact CD2-CG2 4.37Å; L71-V75 WeakPolarHBondContact O-CG2 3.47Å; L71-V75 PolarHBondContact O-N 3.02Å; H72-V75 PolarHBondContact O-N 3.37Å; V75-H77 PolarHBondContact O-N 2.97Å; V75-L78 PolarHBondContact O-N 3.03Å; V75-L79 PolarHBondContact O-N 2.99Å |
| 76 | V | 80.5 | Confident | 76.7 | Confident | 78 Ų | 78 | 96.2 Ų | 96.2 | 47% | 0.473 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.1 | -37.8 | 176.8 | 172.7 | 0 | 0 | 0 | 0 | 110.5 | H72 L79 L80 | H72-V76 WeakPolarHBondContact O-CG2 3.33Å; H72-V76 PolarHBondContact O-N 2.65Å; H72-V76 VanDerWaalsContact O-N 3.08Å; V76-L79 PolarHBondContact O-N 3.04Å; V76-L80 PolarHBondContact O-N 3.38Å |
| 77 | H | 77 | Confident | 77.7 | Confident | 16 Ų | 16 | 101.5 Ų | 101.5 | 7% | 0.074 | 52% | 0.519 | C | S | . | . | H | α-helix | trans | -72.4 | -42.9 | -179.5 | -154.5 | 57.7 | 0 | 0 | 0 | 113.8 | F62 N66 T73 T74 V75 L79 L80 L81 | F62-H77 VanDerWaalsContact CB-CE1 3.44Å; F62-H77 WeakPolarHBondContact CB-CE1 2.98Å; F62-H77 VanDerWaalsContact CB-NE2 3.33Å; F62-H77 WeakPolarHBondContact CB-NE2 2.91Å; F62-H77 HydrophobicContact CD1-CB 4.13Å; F62-H77 AromaticContact CD1-CD2 3.36Å; F62-H77 WeakPolarHBondContact CD1-CD2 3.35Å; F62-H77 AromaticContact CD1-CE1 2.88Å; F62-H77 WeakPolarHBondContact CD1-CE1 3.41Å; F62-H77 AromaticContact CD1-CG 3.19Å; F62-H77 AromaticContact CD1-ND1 2.91Å; F62-H77 WeakPolarHBondContact CD1-ND1 3.29Å; F62-H77 AromaticContact CD1-NE2 3.16Å; F62-H77 WeakPolarHBondContact CD1-NE2 3.16Å; F62-H77 AromaticContact CD2-CE1 3.56Å; F62-H77 HydrophobicContact CE1-CB 3.82Å; F62-H77 AromaticContact CE1-CD2 3.94Å; F62-H77 AromaticContact CE1-CE1 3.34Å; F62-H77 WeakPolarHBondContact CE1-CE1 2.84Å; F62-H77 AromaticContact CE1-CG 3.26Å; F62-H77 AromaticContact CE1-ND1 2.84Å; F62-H77 WeakPolarHBondContact CE1-ND1 3.34Å; F62-H77 AromaticContact CE1-NE2 3.97Å; F62-H77 AromaticContact CE2-CE1 3.95Å; F62-H77 AromaticContact CE2-ND1 3.96Å; F62-H77 AromaticContact CG-CE1 2.98Å; F62-H77 WeakPolarHBondContact CG-CE1 3.44Å; F62-H77 AromaticContact CG-ND1 3.51Å; F62-H77 AromaticContact CG-NE2 3.34Å; F62-H77 VanDerWaalsContact CG-NE2 3.34Å; F62-H77 WeakPolarHBondContact CG-NE2 3.38Å; F62-H77 AromaticContact CZ-CE1 3.84Å; F62-H77 AromaticContact CZ-ND1 3.41Å; F62-H77 WeakPolarHBondContact CZ-ND1 2.88Å; N66-H77 VanDerWaalsContact ND2-CB 3.32Å; N66-H77 WeakPolarHBondContact ND2-CB 3.47Å; T73-H77 VanDerWaalsContact O-CB 3.29Å; T73-H77 WeakPolarHBondContact O-CB 3.33Å; T73-H77 PolarHBondContact O-N 2.89Å; T74-H77 PolarHBondContact O-N 3Å; V75-H77 PolarHBondContact O-N 2.97Å; H77-L79 PolarHBondContact O-N 3.47Å; H77-L80 PolarHBondContact O-N 2.87Å; H77-L81 WeakPolarHBondContact O-CG 3.33Å; H77-L81 PolarHBondContact O-N 2.97Å |
| 78 | L | 81.3 | Confident | 78.4 | Confident | 119 Ų | 119 | 102.1 Ų | 102.1 | 62% | 0.623 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -57.8 | -40.7 | 172.8 | -76.8 | 167.5 | 0 | 0 | 0 | 111.2 | T74 V75 L81 L82 | T74-L78 WeakPolarHBondContact O-CG 3.34Å; T74-L78 PolarHBondContact O-N 3.35Å; V75-L78 PolarHBondContact O-N 3.03Å; L78-L81 PolarHBondContact O-N 2.99Å; L78-L82 WeakPolarHBondContact O-CB 3.32Å; L78-L82 PolarHBondContact O-N 3.3Å |
| 79 | L | 86.1 | Confident | 78.8 | Confident | 107 Ų | 107 | 99.5 Ų | 99.5 | 56% | 0.56 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -65.2 | -41.8 | 176.9 | -169.2 | 70.2 | 0 | 0 | 0 | 112.2 | V75 V76 H77 L82 L83 | V75-L79 PolarHBondContact O-N 2.99Å; V76-L79 PolarHBondContact O-N 3.04Å; H77-L79 PolarHBondContact O-N 3.47Å; L79-L82 PolarHBondContact O-N 3.48Å; L79-L83 PolarHBondContact O-N 3.29Å |
| 80 | L | 85.4 | Confident | 79.5 | Confident | 93 Ų | 93 | 103.2 Ų | 103.2 | 49% | 0.487 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.5 | -44.1 | 177.3 | -170.4 | 72.1 | 0 | 0 | 0 | 111.6 | V76 H77 L82 L83 V84 | V76-L80 PolarHBondContact O-N 3.38Å; H77-L80 PolarHBondContact O-N 2.87Å; L80-L82 VanDerWaalsContact C-N 3.32Å; L80-L82 PolarHBondContact O-N 3.08Å; L80-L83 PolarHBondContact O-N 2.85Å; L80-V84 WeakPolarHBondContact O-CG2 3.08Å; L80-V84 PolarHBondContact O-N 3.34Å |
| 81 | L | 83.7 | Confident | 78.9 | Confident | 63 Ų | 63 | 101.2 Ų | 101.2 | 33% | 0.33 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61 | -42.2 | 176.1 | -69.9 | 174.4 | 0 | 0 | 0 | 111.6 | S59 H77 L78 V84 Y85 | S59-L81 WeakPolarHBondContact OG-CD2 3.36Å; H77-L81 WeakPolarHBondContact O-CG 3.33Å; H77-L81 PolarHBondContact O-N 2.97Å; L78-L81 PolarHBondContact O-N 2.99Å; L81-V84 PolarHBondContact O-N 2.84Å; L81-Y85 WeakPolarHBondContact O-CB 3.33Å; L81-Y85 PolarHBondContact O-N 3.39Å |
| 82 | L | 85.8 | Confident | 78 | Confident | 113 Ų | 113 | 99.9 Ų | 99.9 | 59% | 0.592 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -61.8 | -42.9 | 176 | -165 | 89.7 | 0 | 0 | 0 | 111.7 | L78 L79 L80 Y85 Y86 | L78-L82 WeakPolarHBondContact O-CB 3.32Å; L78-L82 PolarHBondContact O-N 3.3Å; L79-L82 PolarHBondContact O-N 3.48Å; L80-L82 VanDerWaalsContact C-N 3.32Å; L80-L82 PolarHBondContact O-N 3.08Å; L82-Y85 PolarHBondContact O-N 3.42Å; L82-Y86 WeakPolarHBondContact O-CB 3.42Å; L82-Y86 PolarHBondContact O-N 3.47Å |
| 83 | L | 87.1 | Confident | 77.2 | Confident | 102 Ų | 102 | 99.3 Ų | 99.3 | 53% | 0.534 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.3 | -45 | 177.7 | -81.6 | 167.8 | 0 | 0 | 0 | 112.1 | L79 L80 Y85 Y86 H87 | L79-L83 PolarHBondContact O-N 3.29Å; L80-L83 PolarHBondContact O-N 2.85Å; L83-Y85 VanDerWaalsContact C-N 3.35Å; L83-Y86 PolarHBondContact O-N 3.45Å; L83-H87 WeakPolarHBondContact O-CB 3.08Å; L83-H87 PolarHBondContact O-N 3Å |
| 84 | V | 84 | Confident | 76.2 | Confident | 68 Ų | 68 | 102.1 Ų | 102.1 | 41% | 0.412 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62.5 | -44.9 | 176.8 | 172.9 | 0 | 0 | 0 | 0 | 110.4 | L80 L81 Y86 H87 F88 | L80-V84 WeakPolarHBondContact O-CG2 3.08Å; L80-V84 PolarHBondContact O-N 3.34Å; L81-V84 PolarHBondContact O-N 2.84Å; V84-Y86 PolarHBondContact O-N 3.5Å; V84-H87 PolarHBondContact O-N 3.18Å; V84-F88 PolarHBondContact O-N 2.81Å |
| 85 | Y | 83.7 | Confident | 74.9 | Confident | 155 Ų | 155 | 104.8 Ų | 104.8 | 61% | 0.608 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -59.3 | -47.3 | 176.2 | 177 | -97.7 | 0 | 0 | 0 | 111.9 | L81 L82 L83 H87 F88 H89 | L81-Y85 WeakPolarHBondContact O-CB 3.33Å; L81-Y85 PolarHBondContact O-N 3.39Å; L82-Y85 PolarHBondContact O-N 3.42Å; L83-Y85 VanDerWaalsContact C-N 3.35Å; Y85-H87 PolarHBondContact O-N 2.94Å; Y85-F88 PolarHBondContact O-N 3.24Å; Y85-H89 WeakPolarHBondContact O-CB 3.48Å; Y85-H89 PolarHBondContact O-N 3Å |
| 86 | Y | 84.8 | Confident | 73.6 | Confident | 144 Ų | 144 | 106.9 Ų | 106.9 | 57% | 0.565 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -62.7 | -44.4 | 178.2 | -175.3 | -95.5 | 0 | 0 | 0 | 111.7 | L82 L83 V84 F88 H89 H90 | L82-Y86 WeakPolarHBondContact O-CB 3.42Å; L82-Y86 PolarHBondContact O-N 3.47Å; L83-Y86 PolarHBondContact O-N 3.45Å; V84-Y86 PolarHBondContact O-N 3.5Å; Y86-F88 VanDerWaalsContact C-N 3.31Å; Y86-F88 PolarHBondContact O-N 3.38Å; Y86-H89 PolarHBondContact O-N 2.84Å; Y86-H90 HydrophobicContact CD1-CB 4.39Å; Y86-H90 HydrophobicContact CE1-CB 4.08Å; Y86-H90 HydrophobicContact CE2-CB 4.36Å; Y86-H90 AromaticContact CZ-CG 3.92Å; Y86-H90 WeakPolarHBondContact O-CB 3.42Å; Y86-H90 PolarHBondContact O-N 2.78Å |
| 87 | H | 80.3 | Confident | 72.1 | Confident | 122 Ų | 122 | 108.6 Ų | 108.6 | 57% | 0.565 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -61.3 | -42.1 | 178.9 | -164.2 | 62.1 | 0 | 0 | 0 | 111.2 | L83 V84 Y85 N91 | L83-H87 WeakPolarHBondContact O-CB 3.08Å; L83-H87 PolarHBondContact O-N 3Å; V84-H87 PolarHBondContact O-N 3.18Å; Y85-H87 PolarHBondContact O-N 2.94Å; H87-N91 PolarHBondContact CE1-ND2 2.8Å; H87-N91 VanDerWaalsContact CE1-ND2 3.27Å; H87-N91 PolarHBondContact NE2-ND2 3.46Å; H87-N91 WeakPolarHBondContact O-CB 3.35Å; H87-N91 PolarHBondContact O-N 3.25Å |
| 88 | F | 76.5 | Confident | 70.4 | Confident | 132 Ų | 132 | 113.3 Ų | 113.3 | 58% | 0.579 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -71.3 | -38.8 | -179.6 | -141.9 | -91.7 | 0 | 0 | 0 | 112.9 | H51 V84 Y85 Y86 | H51-F88 AromaticContact CE1-CD2 3.56Å; H51-F88 AromaticContact CE1-CE2 3.02Å; H51-F88 WeakPolarHBondContact CE1-CE2 3.09Å; H51-F88 AromaticContact CE1-CZ 3.4Å; H51-F88 VanDerWaalsContact CE1-CZ 3.4Å; H51-F88 WeakPolarHBondContact CE1-CZ 3.44Å; H51-F88 AromaticContact ND1-CE2 3.68Å; H51-F88 AromaticContact ND1-CZ 3.54Å; H51-F88 AromaticContact NE2-CE2 3.31Å; H51-F88 VanDerWaalsContact NE2-CE2 3.31Å; H51-F88 WeakPolarHBondContact NE2-CE2 3.44Å; H51-F88 AromaticContact NE2-CZ 3.78Å; V84-F88 PolarHBondContact O-N 2.81Å; Y85-F88 PolarHBondContact O-N 3.24Å; Y86-F88 VanDerWaalsContact C-N 3.31Å; Y86-F88 PolarHBondContact O-N 3.38Å |
| 89 | H | 73.2 | Confident | 68.8 | Low | 146 Ų | 146 | 120.5 Ų | 120.5 | 68% | 0.676 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -80.7 | -22.1 | -177.5 | -153.5 | -76.7 | 0 | 0 | 0 | 113.2 | Y85 Y86 | Y85-H89 WeakPolarHBondContact O-CB 3.48Å; Y85-H89 PolarHBondContact O-N 3Å; Y86-H89 PolarHBondContact O-N 2.84Å |
| 90 | H | 73.9 | Confident | 67.9 | Low | 121 Ų | 121 | 121.2 Ų | 121.2 | 56% | 0.56 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -108.4 | 1.2 | -178.5 | -159.3 | -80.3 | 0 | 0 | 0 | 113.7 | Y86 P92 | Y86-H90 HydrophobicContact CD1-CB 4.39Å; Y86-H90 HydrophobicContact CE1-CB 4.08Å; Y86-H90 HydrophobicContact CE2-CB 4.36Å; Y86-H90 AromaticContact CZ-CG 3.92Å; Y86-H90 WeakPolarHBondContact O-CB 3.42Å; Y86-H90 PolarHBondContact O-N 2.78Å; H90-P92 WeakPolarHBondContact O-CD 3.42Å |
| 91 | N | 54.5 | Low | 67 | Low | 93 Ų | 93 | 122.6 Ų | 122.6 | 50% | 0.497 | 65% | 0.645 | S | S | . | * | S | Bend | trans | -99.6 | 83.7 | 170.6 | -145 | -16.5 | 0 | 0 | 0 | 107.9 | H87 V93 | H87-N91 PolarHBondContact CE1-ND2 2.8Å; H87-N91 VanDerWaalsContact CE1-ND2 3.27Å; H87-N91 PolarHBondContact NE2-ND2 3.46Å; H87-N91 WeakPolarHBondContact O-CB 3.35Å; H87-N91 PolarHBondContact O-N 3.25Å; N91-V93 PolarHBondContact O-N 2.68Å |
| 92 | P | 56.8 | Low | 66.1 | Low | 103 Ų | 103 | 125.9 Ų | 125.9 | 67% | 0.669 | 66% | 0.663 | S | S | * | * | trans | -61.3 | 112.9 | 174.9 | 27 | -32.8 | 0 | 0 | 0 | 106.1 | H90 S94 | H90-P92 WeakPolarHBondContact O-CD 3.42Å; P92-S94 VanDerWaalsContact C-N 3.35Å; P92-S94 PolarHBondContact O-N 2.84Å | ||
| 93 | V | 59 | Low | 64.9 | Low | 129 Ų | 129 | 126.7 Ų | 126.7 | 78% | 0.782 | 67% | 0.667 | S | S | * | * | trans | -41.7 | 108.8 | 165.4 | 166 | 0 | 0 | 0 | 0 | 105.8 | N91 T95 | N91-V93 PolarHBondContact O-N 2.68Å; V93-T95 PolarHBondContact O-N 2.98Å | ||
| 94 | S | 51.7 | Low | 63.5 | Low | 107 Ų | 107 | 128.3 Ų | 128.3 | 75% | 0.748 | 68% | 0.675 | S | S | * | * | trans | -59.4 | 94.9 | 178.5 | 49.1 | 0 | 0 | 0 | 0 | 106 | P92 P96 | P92-S94 VanDerWaalsContact C-N 3.35Å; P92-S94 PolarHBondContact O-N 2.84Å; S94-P96 WeakPolarHBondContact O-CD 3.46Å | ||
| 95 | T | 49.6 | Very low | 62.2 | Low | 108 Ų | 108 | 132.3 Ų | 132.3 | 66% | 0.663 | 69% | 0.693 | S | S | * | * | trans | -58.2 | 124.9 | 168 | 41.9 | 0 | 0 | 0 | 0 | 105.5 | V93 V97 | V93-T95 PolarHBondContact O-N 2.98Å; T95-V97 VanDerWaalsContact C-N 3.29Å; T95-V97 PolarHBondContact O-N 3.16Å | ||
| 96 | P | 51.1 | Low | 60.6 | Low | 126 Ų | 126 | 130.6 Ų | 130.6 | 82% | 0.818 | 70% | 0.699 | S | S | * | * | trans | -65 | 100.2 | 173.3 | 25.2 | -30.2 | 0 | 0 | 0 | 106.5 | S94 S98 | S94-P96 WeakPolarHBondContact O-CD 3.46Å; P96-S98 VanDerWaalsContact C-N 3.34Å; P96-S98 PolarHBondContact O-N 3.24Å | ||
| 97 | V | 49.3 | Very low | 58.8 | Low | 114 Ų | 114 | 129.6 Ų | 129.6 | 69% | 0.691 | 71% | 0.709 | S | S | * | * | trans | -64.2 | 102.6 | 169 | 174.3 | 0 | 0 | 0 | 0 | 105.6 | T95 K99 | T95-V97 VanDerWaalsContact C-N 3.29Å; T95-V97 PolarHBondContact O-N 3.16Å; V97-K99 HydrophobicContact CG1-CG 4.43Å; V97-K99 PolarHBondContact O-N 2.7Å | ||
| 98 | S | 40 | Very low | 57 | Low | 115 Ų | 115 | 130.3 Ų | 130.3 | 80% | 0.804 | 72% | 0.721 | S | S | * | * | trans | -56.2 | 116.6 | 162 | 61 | 0 | 0 | 0 | 0 | 107.9 | P96 | P96-S98 VanDerWaalsContact C-N 3.34Å; P96-S98 PolarHBondContact O-N 3.24Å | ||
| 99 | K | 47.9 | Very low | 55.2 | Low | 269 Ų | 269 | 130.1 Ų | 130.1 | 100% | 1.17 | 73% | 0.734 | S | S | * | * | trans | -124.2 | 0 | 153.1 | -87.7 | -174.8 | 176.9 | 177.3 | 0 | 107.5 | V97 | V97-K99 HydrophobicContact CG1-CG 4.43Å; V97-K99 PolarHBondContact O-N 2.7Å |
Retrieved 99 of 99 residues in 188.8 ms
(Link to these results)