| 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 | 39.6 | Very low | 44.5 | Very low | 220 Ų | 220 | 133 Ų | 133 | 100% | 1.084 | 69% | 0.687 | S | S | * | * | 0 | -30.6 | 0 | -132.3 | 166.8 | -129.6 | 0 | 0 | 113.4 | |||||
| 2 | V | 40.5 | Very low | 45.2 | Very low | 136 Ų | 136 | 130.9 Ų | 130.9 | 82% | 0.824 | 68% | 0.677 | S | S | * | * | G | 310 helix | trans | -74 | -24.7 | 177.4 | -179.2 | 0 | 0 | 0 | 0 | 114.5 | R4 | V2-R4 VanDerWaalsContact C-N 3.3Å; V2-R4 PolarHBondContact O-N 3.28Å |
| 3 | R | 39.7 | Very low | 46.2 | Very low | 232 Ų | 232 | 128.7 Ų | 128.7 | 88% | 0.875 | 67% | 0.665 | S | S | * | * | G | 310 helix | trans | -71.8 | -14.2 | 179.3 | -76.1 | -174.7 | -175.7 | 173.1 | 1.3 | 115.5 | ||
| 4 | R | 39.4 | Very low | 47 | Very low | 216 Ų | 216 | 124.9 Ų | 124.9 | 82% | 0.815 | 64% | 0.644 | S | S | * | * | G | 310 helix | trans | -98.6 | -6.3 | -174.9 | -146.9 | 178.8 | -88.4 | -170.3 | -5.5 | 113.7 | V2 | V2-R4 VanDerWaalsContact C-N 3.3Å; V2-R4 PolarHBondContact O-N 3.28Å |
| 5 | F | 38.2 | Very low | 47.8 | Very low | 175 Ų | 175 | 123.9 Ų | 123.9 | 77% | 0.768 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.1 | -21.1 | 176.9 | -96.8 | -87.1 | 0 | 0 | 0 | 113.6 | ||
| 6 | G | 40.4 | Very low | 48.3 | Very low | 40 Ų | 40 | 124.6 Ų | 124.6 | 41% | 0.412 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -75.7 | -28.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | C8 S9 L10 | G6-C8 PolarHBondContact O-N 3.27Å; G6-S9 PolarHBondContact O-N 3.03Å; G6-L10 PolarHBondContact O-N 3.29Å |
| 7 | D | 51.5 | Low | 48.9 | Very low | 111 Ų | 111 | 121.1 Ų | 121.1 | 59% | 0.594 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -70.7 | -31 | -177.2 | -67.2 | -29.4 | 0 | 0 | 0 | 112.8 | A11 | D7-A11 WeakPolarHBondContact O-CB 3.46Å; D7-A11 PolarHBondContact O-N 3.15Å |
| 8 | C | 42.4 | Very low | 49.3 | Very low | 87 Ų | 87 | 122.3 Ų | 122.3 | 59% | 0.588 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -72.4 | -37.4 | 177.1 | -90.9 | 0 | 0 | 0 | 0 | 112.9 | G6 L12 | G6-C8 PolarHBondContact O-N 3.27Å; C8-L12 WeakPolarHBondContact O-CB 3.17Å; C8-L12 PolarHBondContact O-N 3.04Å |
| 9 | S | 51.6 | Low | 49.5 | Very low | 76 Ų | 76 | 120.6 Ų | 120.6 | 53% | 0.531 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -69.9 | -41.8 | 176.5 | -86.3 | 0 | 0 | 0 | 0 | 111.8 | G6 L12 I13 | G6-S9 PolarHBondContact O-N 3.03Å; S9-L12 PolarHBondContact O-N 3.44Å; S9-I13 WeakPolarHBondContact O-CB 3.23Å; S9-I13 WeakPolarHBondContact O-CD1 3.29Å; S9-I13 WeakPolarHBondContact O-CG1 3.24Å; S9-I13 PolarHBondContact O-N 3.29Å |
| 10 | L | 52.8 | Low | 49.6 | Very low | 113 Ų | 113 | 120.1 Ų | 120.1 | 59% | 0.592 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -66 | -40.1 | 175.2 | -108.8 | 95.9 | 0 | 0 | 0 | 112.1 | G6 I13 M14 | G6-L10 PolarHBondContact O-N 3.29Å; L10-I13 PolarHBondContact O-N 3.12Å; L10-M14 VanDerWaalsContact O-CB 3.27Å; L10-M14 WeakPolarHBondContact O-CB 3.27Å; L10-M14 VanDerWaalsContact O-CG 3.25Å; L10-M14 WeakPolarHBondContact O-CG 3.24Å; L10-M14 PolarHBondContact O-N 3.39Å |
| 11 | A | 53.3 | Low | 49.7 | Very low | 57 Ų | 57 | 121.5 Ų | 121.5 | 47% | 0.471 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -66.1 | -37.7 | 177 | 0 | 0 | 0 | 0 | 0 | 112.3 | D7 H15 | D7-A11 WeakPolarHBondContact O-CB 3.46Å; D7-A11 PolarHBondContact O-N 3.15Å; A11-H15 WeakPolarHBondContact O-CB 3.21Å; A11-H15 PolarHBondContact O-N 2.8Å |
| 12 | L | 53.4 | Low | 50.5 | Low | 108 Ų | 108 | 121 Ų | 121 | 57% | 0.565 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -66.1 | -42.8 | 172.9 | -99.8 | 141.6 | 0 | 0 | 0 | 111.6 | C8 S9 H15 Q16 | C8-L12 WeakPolarHBondContact O-CB 3.17Å; C8-L12 PolarHBondContact O-N 3.04Å; S9-L12 PolarHBondContact O-N 3.44Å; L12-H15 PolarHBondContact O-N 2.75Å; L12-Q16 VanDerWaalsContact O-CB 3.27Å; L12-Q16 WeakPolarHBondContact O-CB 3.4Å; L12-Q16 WeakPolarHBondContact O-CG 3.25Å; L12-Q16 PolarHBondContact O-N 3.43Å |
| 13 | I | 57.8 | Low | 51 | Low | 102 Ų | 102 | 125 Ų | 125 | 52% | 0.523 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -64.8 | -42.8 | 175.9 | -66.9 | 163.6 | 0 | 0 | 0 | 110.7 | S9 L10 Q16 V17 | S9-I13 WeakPolarHBondContact O-CB 3.23Å; S9-I13 WeakPolarHBondContact O-CD1 3.29Å; S9-I13 WeakPolarHBondContact O-CG1 3.24Å; S9-I13 PolarHBondContact O-N 3.29Å; L10-I13 PolarHBondContact O-N 3.12Å; I13-Q16 PolarHBondContact O-N 2.85Å; I13-V17 HydrophobicContact CG2-CG2 4.42Å; I13-V17 WeakPolarHBondContact O-CB 3.07Å; I13-V17 WeakPolarHBondContact O-CG2 3.23Å; I13-V17 PolarHBondContact O-N 3.34Å |
| 14 | M | 56.9 | Low | 51.6 | Low | 76 Ų | 76 | 116.9 Ų | 116.9 | 37% | 0.374 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -64.7 | -41.6 | 175.7 | -79.2 | -83.5 | 112.4 | 0 | 0 | 112.5 | L10 V17 Y18 D307 | L10-M14 VanDerWaalsContact O-CB 3.27Å; L10-M14 WeakPolarHBondContact O-CB 3.27Å; L10-M14 VanDerWaalsContact O-CG 3.25Å; L10-M14 WeakPolarHBondContact O-CG 3.24Å; L10-M14 PolarHBondContact O-N 3.39Å; M14-V17 PolarHBondContact O-N 3.5Å; M14-Y18 VanDerWaalsContact O-CB 3.23Å; M14-Y18 WeakPolarHBondContact O-CB 2.99Å; M14-Y18 PolarHBondContact O-N 2.79Å; M14-D307 WeakPolarHBondContact CE-OD2 3.25Å |
| 15 | H | 59.1 | Low | 52.1 | Low | 110 Ų | 110 | 112.3 Ų | 112.3 | 51% | 0.509 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -69.7 | -36.2 | 175.9 | -172.6 | -103.8 | 0 | 0 | 0 | 111.5 | A11 L12 Y18 L19 | A11-H15 WeakPolarHBondContact O-CB 3.21Å; A11-H15 PolarHBondContact O-N 2.8Å; L12-H15 PolarHBondContact O-N 2.75Å; H15-Y18 PolarHBondContact O-N 3.42Å; H15-L19 WeakPolarHBondContact CE1-CD1 3.38Å; H15-L19 WeakPolarHBondContact ND1-CD1 3.25Å; H15-L19 VanDerWaalsContact O-CB 3.24Å; H15-L19 WeakPolarHBondContact O-CB 3.27Å; H15-L19 VanDerWaalsContact O-CG 3.29Å; H15-L19 WeakPolarHBondContact O-CG 3.17Å; H15-L19 PolarHBondContact O-N 2.8Å |
| 16 | Q | 56.3 | Low | 52.7 | Low | 134 Ų | 134 | 107.7 Ų | 107.7 | 63% | 0.626 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -62.9 | -49.4 | 170.8 | -69 | -117 | -23.5 | 0 | 0 | 110.1 | L12 I13 Y18 L19 F20 | L12-Q16 VanDerWaalsContact O-CB 3.27Å; L12-Q16 WeakPolarHBondContact O-CB 3.4Å; L12-Q16 WeakPolarHBondContact O-CG 3.25Å; L12-Q16 PolarHBondContact O-N 3.43Å; I13-Q16 PolarHBondContact O-N 2.85Å; Q16-Y18 PolarHBondContact O-N 3.41Å; Q16-L19 PolarHBondContact O-N 3.35Å; Q16-F20 WeakPolarHBondContact O-CB 3.41Å; Q16-F20 PolarHBondContact O-N 2.79Å |
| 17 | V | 58.3 | Low | 53.1 | Low | 65 Ų | 65 | 109.8 Ų | 109.8 | 39% | 0.394 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -62.9 | -38.1 | 177.2 | 171.2 | 0 | 0 | 0 | 0 | 112 | I13 M14 F20 R21 | I13-V17 HydrophobicContact CG2-CG2 4.42Å; I13-V17 WeakPolarHBondContact O-CB 3.07Å; I13-V17 WeakPolarHBondContact O-CG2 3.23Å; I13-V17 PolarHBondContact O-N 3.34Å; M14-V17 PolarHBondContact O-N 3.5Å; V17-F20 PolarHBondContact O-N 3.42Å; V17-R21 VanDerWaalsContact O-CB 3.25Å; V17-R21 WeakPolarHBondContact O-CB 3.2Å; V17-R21 PolarHBondContact O-N 2.82Å |
| 18 | Y | 55.7 | Low | 53.2 | Low | 143 Ų | 143 | 108.2 Ų | 108.2 | 56% | 0.561 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -70.1 | -42.8 | 176.6 | -172.8 | -94.2 | 0 | 0 | 0 | 112.2 | M14 H15 Q16 F20 R21 R22 | M14-Y18 VanDerWaalsContact O-CB 3.23Å; M14-Y18 WeakPolarHBondContact O-CB 2.99Å; M14-Y18 PolarHBondContact O-N 2.79Å; H15-Y18 PolarHBondContact O-N 3.42Å; Q16-Y18 PolarHBondContact O-N 3.41Å; Y18-F20 VanDerWaalsContact C-N 3.31Å; Y18-R21 PolarHBondContact O-N 2.81Å; Y18-R22 PolarHBondContact O-N 3.43Å; Y18-R22 VanDerWaalsContact O-N 3.12Å |
| 19 | L | 53.7 | Low | 54 | Low | 90 Ų | 90 | 106.5 Ų | 106.5 | 47% | 0.471 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -66.6 | -34 | 172.5 | -75.6 | 177.4 | 0 | 0 | 0 | 111.9 | H15 Q16 R22 R23 | H15-L19 WeakPolarHBondContact CE1-CD1 3.38Å; H15-L19 WeakPolarHBondContact ND1-CD1 3.25Å; H15-L19 VanDerWaalsContact O-CB 3.24Å; H15-L19 WeakPolarHBondContact O-CB 3.27Å; H15-L19 VanDerWaalsContact O-CG 3.29Å; H15-L19 WeakPolarHBondContact O-CG 3.17Å; H15-L19 PolarHBondContact O-N 2.8Å; Q16-L19 PolarHBondContact O-N 3.35Å; L19-R22 PolarHBondContact O-N 2.98Å; L19-R23 VanDerWaalsContact O-CB 3.23Å; L19-R23 WeakPolarHBondContact O-CB 3.49Å; L19-R23 PolarHBondContact O-N 3.27Å |
| 20 | F | 51 | Low | 54.6 | Low | 111 Ų | 111 | 105.4 Ų | 105.4 | 49% | 0.487 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -68 | -41.8 | 174.9 | -157.7 | -114.7 | 0 | 0 | 0 | 110.9 | Q16 V17 Y18 R22 R23 N24 E27 | Q16-F20 WeakPolarHBondContact O-CB 3.41Å; Q16-F20 PolarHBondContact O-N 2.79Å; V17-F20 PolarHBondContact O-N 3.42Å; Y18-F20 VanDerWaalsContact C-N 3.31Å; F20-R22 PolarHBondContact O-N 2.98Å; F20-R23 PolarHBondContact O-N 3.5Å; F20-N24 PolarHBondContact O-N 3.5Å; F20-E27 VanDerWaalsContact CE1-CD 3.42Å; F20-E27 WeakPolarHBondContact CE1-OE1 3.47Å; F20-E27 WeakPolarHBondContact CE1-OE2 3.46Å; F20-E27 WeakPolarHBondContact CZ-OE1 3.5Å; F20-E27 WeakPolarHBondContact CZ-OE2 3.31Å |
| 21 | R | 52.2 | Low | 55.3 | Low | 150 Ų | 150 | 105.4 Ų | 105.4 | 57% | 0.566 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -61 | -27.6 | 172.1 | -167.1 | 174.7 | -169.8 | -176.9 | -0.3 | 112.8 | V17 Y18 E94 | V17-R21 VanDerWaalsContact O-CB 3.25Å; V17-R21 WeakPolarHBondContact O-CB 3.2Å; V17-R21 PolarHBondContact O-N 2.82Å; Y18-R21 PolarHBondContact O-N 2.81Å; R21-E94 IonicContact CZ-OE1 3.41Å; R21-E94 IonicContact NH1-OE1 2.9Å; R21-E94 PolarHBondContact NH1-OE1 3.34Å; R21-E94 IonicContact NH2-OE1 2.93Å; R21-E94 PolarHBondContact NH2-OE1 2.96Å |
| 22 | R | 56.1 | Low | 56.2 | Low | 209 Ų | 209 | 105 Ų | 105 | 79% | 0.789 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -94.4 | -17.3 | 179.6 | -148.2 | 178.6 | -172.3 | -169.7 | 2.8 | 114.3 | Y18 L19 F20 | Y18-R22 PolarHBondContact O-N 3.43Å; Y18-R22 VanDerWaalsContact O-N 3.12Å; L19-R22 PolarHBondContact O-N 2.98Å; F20-R22 PolarHBondContact O-N 2.98Å |
| 23 | R | 51.7 | Low | 57.1 | Low | 221 Ų | 221 | 105.2 Ų | 105.2 | 83% | 0.834 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -105.9 | -21.3 | -171.4 | -170.7 | 157.7 | 161.8 | 167.8 | -7.9 | 114.8 | L19 F20 | L19-R23 VanDerWaalsContact O-CB 3.23Å; L19-R23 WeakPolarHBondContact O-CB 3.49Å; L19-R23 PolarHBondContact O-N 3.27Å; F20-R23 PolarHBondContact O-N 3.5Å |
| 24 | N | 51.4 | Low | 57.9 | Low | 61 Ų | 61 | 107.5 Ų | 107.5 | 33% | 0.326 | 51% | 0.513 | S | S | . | . | trans | -127.9 | 86.8 | -178.3 | -80.9 | -6.8 | 0 | 0 | 0 | 113.4 | F20 S26 E27 | F20-N24 PolarHBondContact O-N 3.5Å; N24-S26 PolarHBondContact O-N 3.42Å; N24-E27 HydrophobicContact CB-CG 4.44Å; N24-E27 PolarHBondContact ND2-OE1 3.32Å; N24-E27 PolarHBondContact O-N 3.21Å | ||
| 25 | S | 51 | Low | 59.2 | Low | 120 Ų | 120 | 105.3 Ų | 105.3 | 84% | 0.839 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -59.8 | -11.4 | 164.6 | -74.3 | 0 | 0 | 0 | 0 | 113.6 | ||
| 26 | S | 49.6 | Very low | 60.5 | Low | 78 Ų | 78 | 104.7 Ų | 104.7 | 55% | 0.545 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -70.8 | -24.6 | -179.5 | 46.3 | 0 | 0 | 0 | 0 | 114.4 | N24 S29 | N24-S26 PolarHBondContact O-N 3.42Å; S26-S29 WeakPolarHBondContact O-CB 3.11Å |
| 27 | E | 49.5 | Very low | 62 | Low | 84 Ų | 84 | 102.6 Ų | 102.6 | 39% | 0.393 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -89.3 | -33.1 | -173 | -69.4 | -178 | -163.1 | 0 | 0 | 113.8 | F20 N24 S29 C30 | F20-E27 VanDerWaalsContact CE1-CD 3.42Å; F20-E27 WeakPolarHBondContact CE1-OE1 3.47Å; F20-E27 WeakPolarHBondContact CE1-OE2 3.46Å; F20-E27 WeakPolarHBondContact CZ-OE1 3.5Å; F20-E27 WeakPolarHBondContact CZ-OE2 3.31Å; N24-E27 HydrophobicContact CB-CG 4.44Å; N24-E27 PolarHBondContact ND2-OE1 3.32Å; N24-E27 PolarHBondContact O-N 3.21Å; E27-S29 PolarHBondContact O-N 3.07Å; E27-C30 WeakPolarHBondContact O-CB 3.42Å; E27-C30 PolarHBondContact O-N 2.93Å |
| 28 | V | 52.4 | Low | 63.5 | Low | 78 Ų | 78 | 99.5 Ų | 99.5 | 47% | 0.473 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -58.2 | -29.5 | 168.1 | -177 | 0 | 0 | 0 | 0 | 110.2 | C30 V32 L92 | V28-C30 PolarHBondContact O-N 2.9Å; V28-V32 HydrophobicContact CG1-CG2 4.44Å; V28-V32 WeakPolarHBondContact O-CG2 2.92Å; V28-V32 PolarHBondContact O-N 3.21Å; V28-L92 HydrophobicContact CG1-CD2 4.17Å |
| 29 | S | 60.4 | Low | 65.3 | Low | 50 Ų | 50 | 95.4 Ų | 95.4 | 35% | 0.35 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -59.1 | -31.4 | 173.7 | -159.8 | 0 | 0 | 0 | 0 | 112.7 | S26 E27 K33 | S26-S29 WeakPolarHBondContact O-CB 3.11Å; E27-S29 PolarHBondContact O-N 3.07Å; S29-K33 WeakPolarHBondContact O-CB 3.43Å; S29-K33 WeakPolarHBondContact O-CD 3.33Å; S29-K33 WeakPolarHBondContact O-CG 2.85Å; S29-K33 PolarHBondContact O-N 3.47Å; S29-K33 WeakPolarHBondContact OG-CE 3.4Å |
| 30 | C | 63.1 | Low | 67.2 | Low | 53 Ų | 53 | 93.5 Ų | 93.5 | 36% | 0.358 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -72.7 | -49.2 | -175.6 | -155.2 | 0 | 0 | 0 | 0 | 112.5 | E27 V28 V32 K33 Y34 | E27-C30 WeakPolarHBondContact O-CB 3.42Å; E27-C30 PolarHBondContact O-N 2.93Å; V28-C30 PolarHBondContact O-N 2.9Å; C30-V32 VanDerWaalsContact C-N 3.32Å; C30-V32 PolarHBondContact O-N 3.43Å; C30-K33 WeakPolarHBondContact O-CB 3.46Å; C30-K33 PolarHBondContact O-N 3.42Å; C30-K33 VanDerWaalsContact O-N 3.13Å; C30-Y34 WeakPolarHBondContact O-CD2 2.94Å; C30-Y34 PolarHBondContact O-N 3.13Å; C30-Y34 VanDerWaalsContact O-N 3.1Å; C30-Y34 WeakPolarHBondContact SG-CE2 3.33Å |
| 31 | F | 67.4 | Low | 69.2 | Low | 114 Ų | 114 | 90.9 Ų | 90.9 | 50% | 0.5 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -63 | -39 | 177.5 | -78.4 | -79.8 | 0 | 0 | 0 | 112.6 | K33 Y34 M35 C88 | F31-K33 VanDerWaalsContact C-N 3.33Å; F31-Y34 PolarHBondContact O-N 3.19Å; F31-M35 PolarHBondContact O-N 2.84Å; F31-C88 HydrophobicContact CB-CB 4.45Å |
| 32 | V | 72.3 | Confident | 71.3 | Confident | 47 Ų | 47 | 85.4 Ų | 85.4 | 29% | 0.285 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -64.2 | -40.1 | 175.1 | 176.5 | 0 | 0 | 0 | 0 | 110.6 | V28 C30 Y34 M35 L36 | V28-V32 HydrophobicContact CG1-CG2 4.44Å; V28-V32 WeakPolarHBondContact O-CG2 2.92Å; V28-V32 PolarHBondContact O-N 3.21Å; C30-V32 VanDerWaalsContact C-N 3.32Å; C30-V32 PolarHBondContact O-N 3.43Å; V32-Y34 PolarHBondContact O-N 3.46Å; V32-M35 PolarHBondContact O-N 3.28Å; V32-L36 HydrophobicContact CG1-CD1 4Å; V32-L36 HydrophobicContact CG1-CG 4.27Å; V32-L36 WeakPolarHBondContact O-CB 3.37Å; V32-L36 VanDerWaalsContact O-CG 3.26Å; V32-L36 WeakPolarHBondContact O-CG 3.42Å; V32-L36 PolarHBondContact O-N 3.35Å |
| 33 | K | 72.6 | Confident | 73.1 | Confident | 114 Ų | 114 | 80.5 Ų | 80.5 | 50% | 0.496 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -58.5 | -47.5 | 174.3 | -73.9 | 162.9 | -164.9 | 175.5 | 0 | 111.7 | S29 C30 F31 M35 L36 I37 | S29-K33 WeakPolarHBondContact O-CB 3.43Å; S29-K33 WeakPolarHBondContact O-CD 3.33Å; S29-K33 WeakPolarHBondContact O-CG 2.85Å; S29-K33 PolarHBondContact O-N 3.47Å; S29-K33 WeakPolarHBondContact OG-CE 3.4Å; C30-K33 WeakPolarHBondContact O-CB 3.46Å; C30-K33 PolarHBondContact O-N 3.42Å; C30-K33 VanDerWaalsContact O-N 3.13Å; F31-K33 VanDerWaalsContact C-N 3.33Å; K33-M35 PolarHBondContact O-N 3.47Å; K33-L36 PolarHBondContact O-N 3.34Å; K33-I37 VanDerWaalsContact O-CG1 3.23Å; K33-I37 WeakPolarHBondContact O-CG1 3.34Å; K33-I37 PolarHBondContact O-N 3.19Å |
| 34 | Y | 75.9 | Confident | 75.1 | Confident | 150 Ų | 150 | 74.2 Ų | 74.2 | 59% | 0.588 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -62.8 | -40.8 | 178.7 | -69.9 | -66.2 | 0 | 0 | 0 | 112.7 | C30 F31 V32 L36 I37 G38 | C30-Y34 WeakPolarHBondContact O-CD2 2.94Å; C30-Y34 PolarHBondContact O-N 3.13Å; C30-Y34 VanDerWaalsContact O-N 3.1Å; C30-Y34 WeakPolarHBondContact SG-CE2 3.33Å; F31-Y34 PolarHBondContact O-N 3.19Å; V32-Y34 PolarHBondContact O-N 3.46Å; Y34-L36 VanDerWaalsContact C-N 3.34Å; Y34-L36 PolarHBondContact O-N 3.48Å; Y34-I37 PolarHBondContact O-N 3.41Å; Y34-G38 PolarHBondContact O-N 2.93Å |
| 35 | M | 83.4 | Confident | 77.1 | Confident | 30 Ų | 30 | 71.3 Ų | 71.3 | 15% | 0.148 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -61.3 | -43 | 174.4 | -174.5 | -169.8 | 75.1 | 0 | 0 | 111.7 | F31 V32 K33 G38 L39 F81 F85 | F31-M35 PolarHBondContact O-N 2.84Å; V32-M35 PolarHBondContact O-N 3.28Å; K33-M35 PolarHBondContact O-N 3.47Å; M35-G38 PolarHBondContact O-N 3.34Å; M35-L39 WeakPolarHBondContact O-CB 3.19Å; M35-L39 PolarHBondContact O-N 2.94Å; M35-F81 HydrophobicContact CG-CD2 4.21Å; M35-F81 HydrophobicContact CG-CE2 4.22Å; M35-F85 HydrophobicContact SD-CB 4.45Å; M35-F85 HydrophobicContact SD-CD2 4.31Å |
| 36 | L | 86.9 | Confident | 79 | Confident | 96 Ų | 96 | 68.3 Ų | 68.3 | 50% | 0.503 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -67.7 | -37.4 | 177.7 | -68.6 | 176.4 | 0 | 0 | 0 | 112.3 | V32 K33 Y34 L39 A40 | V32-L36 HydrophobicContact CG1-CD1 4Å; V32-L36 HydrophobicContact CG1-CG 4.27Å; V32-L36 WeakPolarHBondContact O-CB 3.37Å; V32-L36 VanDerWaalsContact O-CG 3.26Å; V32-L36 WeakPolarHBondContact O-CG 3.42Å; V32-L36 PolarHBondContact O-N 3.35Å; K33-L36 PolarHBondContact O-N 3.34Å; Y34-L36 VanDerWaalsContact C-N 3.34Å; Y34-L36 PolarHBondContact O-N 3.48Å; L36-L39 PolarHBondContact O-N 3.1Å; L36-A40 WeakPolarHBondContact O-CB 3.32Å; L36-A40 PolarHBondContact O-N 3.25Å |
| 37 | I | 87.2 | Confident | 81 | Confident | 91 Ų | 91 | 73.5 Ų | 73.5 | 47% | 0.467 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -64.1 | -48.1 | 174.4 | -69.1 | 163.2 | 0 | 0 | 0 | 110.2 | K33 Y34 L39 A40 I41 | K33-I37 VanDerWaalsContact O-CG1 3.23Å; K33-I37 WeakPolarHBondContact O-CG1 3.34Å; K33-I37 PolarHBondContact O-N 3.19Å; Y34-I37 PolarHBondContact O-N 3.41Å; I37-L39 VanDerWaalsContact C-N 3.32Å; I37-L39 PolarHBondContact O-N 3.46Å; I37-A40 PolarHBondContact O-N 2.9Å; I37-I41 HydrophobicContact CG2-CD1 3.72Å; I37-I41 HydrophobicContact CG2-CG1 4.4Å; I37-I41 VanDerWaalsContact O-CG1 3.29Å; I37-I41 WeakPolarHBondContact O-CG1 3.4Å; I37-I41 PolarHBondContact O-N 3.1Å |
| 38 | G | 89.1 | Confident | 82.8 | Confident | 0 Ų | 0 | 70.7 Ų | 70.7 | 0% | 0 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -59 | -43.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y34 M35 I41 L42 T80 | Y34-G38 PolarHBondContact O-N 2.93Å; M35-G38 PolarHBondContact O-N 3.34Å; G38-I41 PolarHBondContact O-N 3.2Å; G38-L42 WeakPolarHBondContact O-CB 3.09Å; G38-L42 PolarHBondContact O-N 3.27Å; G38-T80 WeakPolarHBondContact CA-OG1 3.36Å |
| 39 | L | 94.3 | Very high | 84.3 | Confident | 56 Ų | 56 | 67.9 Ų | 67.9 | 29% | 0.293 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -62.4 | -44.7 | 175.1 | -177.3 | 60.6 | 0 | 0 | 0 | 112.1 | M35 L36 I37 L42 L43 F81 | M35-L39 WeakPolarHBondContact O-CB 3.19Å; M35-L39 PolarHBondContact O-N 2.94Å; L36-L39 PolarHBondContact O-N 3.1Å; I37-L39 VanDerWaalsContact C-N 3.32Å; I37-L39 PolarHBondContact O-N 3.46Å; L39-L42 PolarHBondContact O-N 2.92Å; L39-L43 HydrophobicContact CD1-CD1 4.24Å; L39-L43 HydrophobicContact CD1-CG 4.15Å; L39-L43 HydrophobicContact CG-CD1 4.05Å; L39-L43 HydrophobicContact CG-CG 4.37Å; L39-L43 WeakPolarHBondContact O-CB 3.48Å; L39-L43 VanDerWaalsContact O-CG 3.27Å; L39-L43 WeakPolarHBondContact O-CG 3.4Å; L39-L43 PolarHBondContact O-N 3.17Å; L39-F81 HydrophobicContact CB-CD2 3.73Å; L39-F81 HydrophobicContact CB-CE2 4.01Å; L39-F81 HydrophobicContact CD1-CD2 4.1Å; L39-F81 HydrophobicContact CD1-CE2 3.89Å; L39-F81 HydrophobicContact CD1-CZ 4.29Å; L39-F81 HydrophobicContact CD2-CE2 4.36Å; L39-F81 HydrophobicContact CG-CD2 4.43Å; L39-F81 HydrophobicContact CG-CE2 4.31Å |
| 40 | A | 94.2 | Very high | 85.5 | Confident | 51 Ų | 51 | 71.1 Ų | 71.1 | 42% | 0.421 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -62 | -45.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | L36 I37 L42 L43 V44 | L36-A40 WeakPolarHBondContact O-CB 3.32Å; L36-A40 PolarHBondContact O-N 3.25Å; I37-A40 PolarHBondContact O-N 2.9Å; A40-L42 VanDerWaalsContact C-N 3.34Å; A40-L42 PolarHBondContact O-N 3.45Å; A40-L43 PolarHBondContact O-N 3.36Å; A40-V44 VanDerWaalsContact O-CG2 3.3Å; A40-V44 WeakPolarHBondContact O-CG2 3.29Å; A40-V44 PolarHBondContact O-N 3.34Å |
| 41 | I | 92.8 | Very high | 86.5 | Confident | 56 Ų | 56 | 75.8 Ų | 75.8 | 29% | 0.287 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -60.4 | -45.3 | 176.5 | -66.4 | 168 | 0 | 0 | 0 | 110.5 | I37 G38 V44 G45 L73 | I37-I41 HydrophobicContact CG2-CD1 3.72Å; I37-I41 HydrophobicContact CG2-CG1 4.4Å; I37-I41 VanDerWaalsContact O-CG1 3.29Å; I37-I41 WeakPolarHBondContact O-CG1 3.4Å; I37-I41 PolarHBondContact O-N 3.1Å; G38-I41 PolarHBondContact O-N 3.2Å; I41-V44 PolarHBondContact O-N 3.09Å; I41-G45 PolarHBondContact O-N 3.03Å; I41-L73 HydrophobicContact CG2-CB 4.35Å; I41-L73 HydrophobicContact CG2-CD2 4.14Å |
| 42 | L | 95 | Very high | 86.7 | Confident | 35 Ų | 35 | 73.1 Ų | 73.1 | 18% | 0.183 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -61.6 | -46.6 | 178.1 | 179.3 | 62 | 0 | 0 | 0 | 111.8 | G38 L39 A40 V44 G45 V46 I74 F81 | G38-L42 WeakPolarHBondContact O-CB 3.09Å; G38-L42 PolarHBondContact O-N 3.27Å; L39-L42 PolarHBondContact O-N 2.92Å; A40-L42 VanDerWaalsContact C-N 3.34Å; A40-L42 PolarHBondContact O-N 3.45Å; L42-V44 VanDerWaalsContact C-N 3.34Å; L42-V44 PolarHBondContact O-N 3.46Å; L42-G45 PolarHBondContact O-N 3.05Å; L42-V46 HydrophobicContact CD1-CG2 4.09Å; L42-V46 HydrophobicContact CG-CG2 4.42Å; L42-V46 WeakPolarHBondContact O-CB 3.41Å; L42-V46 VanDerWaalsContact O-CG2 3.3Å; L42-V46 WeakPolarHBondContact O-CG2 3.47Å; L42-V46 PolarHBondContact O-N 3.43Å; L42-I74 HydrophobicContact CD1-CG2 4.1Å; L42-F81 HydrophobicContact CD2-CD1 4.38Å |
| 43 | L | 95.6 | Very high | 86.3 | Confident | 106 Ų | 106 | 73.1 Ų | 73.1 | 56% | 0.555 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -62.7 | -40.5 | 178.9 | -71.5 | 175.4 | 0 | 0 | 0 | 111.8 | L39 A40 V46 W47 | L39-L43 HydrophobicContact CD1-CD1 4.24Å; L39-L43 HydrophobicContact CD1-CG 4.15Å; L39-L43 HydrophobicContact CG-CD1 4.05Å; L39-L43 HydrophobicContact CG-CG 4.37Å; L39-L43 WeakPolarHBondContact O-CB 3.48Å; L39-L43 VanDerWaalsContact O-CG 3.27Å; L39-L43 WeakPolarHBondContact O-CG 3.4Å; L39-L43 PolarHBondContact O-N 3.17Å; A40-L43 PolarHBondContact O-N 3.36Å; L43-V46 PolarHBondContact O-N 2.95Å; L43-W47 WeakPolarHBondContact O-CB 3.39Å; L43-W47 PolarHBondContact O-N 3.28Å |
| 44 | V | 93.7 | Very high | 86.2 | Confident | 89 Ų | 89 | 71 Ų | 71 | 54% | 0.539 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -63.5 | -44.9 | 174.9 | 171.1 | 0 | 0 | 0 | 0 | 111 | A40 I41 L42 W47 A48 L73 | A40-V44 VanDerWaalsContact O-CG2 3.3Å; A40-V44 WeakPolarHBondContact O-CG2 3.29Å; A40-V44 PolarHBondContact O-N 3.34Å; I41-V44 PolarHBondContact O-N 3.09Å; L42-V44 VanDerWaalsContact C-N 3.34Å; L42-V44 PolarHBondContact O-N 3.46Å; V44-W47 PolarHBondContact O-N 2.9Å; V44-A48 WeakPolarHBondContact O-CB 3.34Å; V44-A48 PolarHBondContact O-N 2.91Å; V44-L73 HydrophobicContact CG1-CD1 4.46Å |
| 45 | G | 91.5 | Very high | 85.6 | Confident | 0 Ų | 0 | 71 Ų | 71 | 0% | 0 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -62.7 | -44.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | I41 L42 A48 Q49 I74 | I41-G45 PolarHBondContact O-N 3.03Å; L42-G45 PolarHBondContact O-N 3.05Å; G45-A48 PolarHBondContact O-N 3.02Å; G45-Q49 PolarHBondContact O-N 3.39Å; G45-Q49 VanDerWaalsContact O-N 3.09Å; G45-I74 VanDerWaalsContact C-CG1 3.45Å |
| 46 | V | 92 | Very high | 84.8 | Confident | 56 Ų | 56 | 74.8 Ų | 74.8 | 34% | 0.339 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -65.8 | -44.2 | 177.3 | 171.2 | 0 | 0 | 0 | 0 | 111.1 | L42 L43 A48 Q49 I50 I74 | L42-V46 HydrophobicContact CD1-CG2 4.09Å; L42-V46 HydrophobicContact CG-CG2 4.42Å; L42-V46 WeakPolarHBondContact O-CB 3.41Å; L42-V46 VanDerWaalsContact O-CG2 3.3Å; L42-V46 WeakPolarHBondContact O-CG2 3.47Å; L42-V46 PolarHBondContact O-N 3.43Å; L43-V46 PolarHBondContact O-N 2.95Å; V46-A48 VanDerWaalsContact C-N 3.31Å; V46-A48 PolarHBondContact O-N 2.91Å; V46-Q49 PolarHBondContact O-N 2.91Å; V46-I50 HydrophobicContact CG1-CD1 3.66Å; V46-I50 HydrophobicContact CG1-CG1 4.29Å; V46-I50 VanDerWaalsContact O-CG1 3.32Å; V46-I50 WeakPolarHBondContact O-CG1 3.44Å; V46-I50 PolarHBondContact O-N 2.94Å; V46-I74 HydrophobicContact CG2-CD1 4.37Å; V46-I74 HydrophobicContact CG2-CG1 4.25Å |
| 47 | W | 91.6 | Very high | 84 | Confident | 188 Ų | 188 | 75.2 Ų | 75.2 | 71% | 0.712 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -56.2 | -47.3 | 174.5 | -179.3 | -78.8 | 0 | 0 | 0 | 111.2 | L43 V44 Q49 I50 E51 | L43-W47 WeakPolarHBondContact O-CB 3.39Å; L43-W47 PolarHBondContact O-N 3.28Å; V44-W47 PolarHBondContact O-N 2.9Å; W47-Q49 VanDerWaalsContact C-N 3.31Å; W47-Q49 PolarHBondContact O-N 3.36Å; W47-I50 PolarHBondContact O-N 3.33Å; W47-E51 PolarHBondContact O-N 3.48Å; W47-E51 VanDerWaalsContact O-N 3.16Å |
| 48 | A | 87.3 | Confident | 83.2 | Confident | 24 Ų | 24 | 73.7 Ų | 73.7 | 20% | 0.198 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -60.6 | -37.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | V44 G45 V46 K52 A70 | V44-A48 WeakPolarHBondContact O-CB 3.34Å; V44-A48 PolarHBondContact O-N 2.91Å; G45-A48 PolarHBondContact O-N 3.02Å; V46-A48 VanDerWaalsContact C-N 3.31Å; V46-A48 PolarHBondContact O-N 2.91Å; A48-K52 WeakPolarHBondContact O-CD 3.18Å; A48-K52 VanDerWaalsContact O-CE 3.28Å; A48-K52 WeakPolarHBondContact O-CE 3.35Å; A48-K52 WeakPolarHBondContact O-CG 3.46Å; A48-A70 HydrophobicContact CB-CB 3.91Å |
| 49 | Q | 85 | Confident | 82.4 | Confident | 19 Ų | 19 | 78 Ų | 78 | 9% | 0.089 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -71 | -41.5 | 176.4 | -75.4 | -60.9 | -26.4 | 0 | 0 | 113 | G45 V46 W47 E51 K52 T53 D68 A70 W71 I74 | G45-Q49 PolarHBondContact O-N 3.39Å; G45-Q49 VanDerWaalsContact O-N 3.09Å; V46-Q49 PolarHBondContact O-N 2.91Å; W47-Q49 VanDerWaalsContact C-N 3.31Å; W47-Q49 PolarHBondContact O-N 3.36Å; Q49-E51 VanDerWaalsContact C-N 3.32Å; Q49-E51 PolarHBondContact O-N 2.91Å; Q49-K52 PolarHBondContact O-N 3.34Å; Q49-T53 PolarHBondContact O-N 3.06Å; Q49-T53 PolarHBondContact O-OG1 3.1Å; Q49-D68 PolarHBondContact NE2-OD2 3.44Å; Q49-A70 HydrophobicContact CG-CB 4.33Å; Q49-W71 VanDerWaalsContact NE2-CD1 3.25Å; Q49-I74 HydrophobicContact CB-CD1 4.21Å; Q49-I74 HydrophobicContact CG-CD1 3.4Å |
| 50 | I | 84.6 | Confident | 81.2 | Confident | 118 Ų | 118 | 80 Ų | 80 | 61% | 0.605 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -61 | -42.9 | -178.8 | -69.8 | 168.2 | 0 | 0 | 0 | 110.6 | V46 W47 K52 | V46-I50 HydrophobicContact CG1-CD1 3.66Å; V46-I50 HydrophobicContact CG1-CG1 4.29Å; V46-I50 VanDerWaalsContact O-CG1 3.32Å; V46-I50 WeakPolarHBondContact O-CG1 3.44Å; V46-I50 PolarHBondContact O-N 2.94Å; W47-I50 PolarHBondContact O-N 3.33Å; I50-K52 VanDerWaalsContact C-N 3.27Å; I50-K52 PolarHBondContact O-N 2.99Å |
| 51 | E | 84.3 | Confident | 79.9 | Confident | 151 Ų | 151 | 81.3 Ų | 81.3 | 71% | 0.706 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -64.6 | -31.8 | -179.7 | -165.7 | 66.7 | -165.9 | 0 | 0 | 112.4 | W47 Q49 | W47-E51 PolarHBondContact O-N 3.48Å; W47-E51 VanDerWaalsContact O-N 3.16Å; Q49-E51 VanDerWaalsContact C-N 3.32Å; Q49-E51 PolarHBondContact O-N 2.91Å |
| 52 | K | 72.1 | Confident | 79 | Confident | 58 Ų | 58 | 82.3 Ų | 82.3 | 25% | 0.252 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -84 | -23.6 | -175.6 | -67.4 | 175.3 | -153.7 | -169.6 | 0 | 114.6 | A48 Q49 I50 P54 D68 D147 | A48-K52 WeakPolarHBondContact O-CD 3.18Å; A48-K52 VanDerWaalsContact O-CE 3.28Å; A48-K52 WeakPolarHBondContact O-CE 3.35Å; A48-K52 WeakPolarHBondContact O-CG 3.46Å; Q49-K52 PolarHBondContact O-N 3.34Å; I50-K52 VanDerWaalsContact C-N 3.27Å; I50-K52 PolarHBondContact O-N 2.99Å; K52-P54 VanDerWaalsContact O-CD 3.26Å; K52-P54 WeakPolarHBondContact O-CD 3.25Å; K52-D68 IonicContact NZ-OD1 2.62Å; K52-D68 PolarHBondContact NZ-OD1 3.48Å; K52-D68 IonicContact NZ-OD2 3.08Å; K52-D68 PolarHBondContact NZ-OD2 3.5Å; K52-D147 WeakPolarHBondContact CD-OD2 3.26Å; K52-D147 VanDerWaalsContact CE-OD1 3.3Å; K52-D147 WeakPolarHBondContact CE-OD1 3.49Å; K52-D147 WeakPolarHBondContact CE-OD2 3.35Å; K52-D147 IonicContact NZ-OD1 3.51Å; K52-D147 PolarHBondContact NZ-OD1 2.98Å; K52-D147 VanDerWaalsContact NZ-OD1 3.08Å; K52-D147 IonicContact NZ-OD2 2.82Å; K52-D147 PolarHBondContact NZ-OD2 3.38Å |
| 53 | T | 64.3 | Low | 78.1 | Confident | 47 Ų | 47 | 86.8 Ų | 86.8 | 29% | 0.288 | 46% | 0.462 | S | S | . | . | trans | -113.2 | 102.6 | -158.9 | 48.7 | 0 | 0 | 0 | 0 | 114.3 | Q49 L55 | Q49-T53 PolarHBondContact O-N 3.06Å; Q49-T53 PolarHBondContact O-OG1 3.1Å; T53-L55 PolarHBondContact O-N 2.98Å | ||
| 54 | P | 68.6 | Low | 77.1 | Confident | 71 Ų | 71 | 84.1 Ų | 84.1 | 46% | 0.461 | 45% | 0.446 | S | S | . | . | trans | -65.6 | 125.6 | 147.4 | 27.6 | -29.4 | 0 | 0 | 0 | 107.9 | K52 S56 Q57 | K52-P54 VanDerWaalsContact O-CD 3.26Å; K52-P54 WeakPolarHBondContact O-CD 3.25Å; P54-S56 PolarHBondContact O-N 3.34Å; P54-Q57 PolarHBondContact O-N 3.46Å | ||
| 55 | L | 65.2 | Low | 76.5 | Confident | 149 Ų | 149 | 84.6 Ų | 84.6 | 78% | 0.78 | 44% | 0.441 | S | S | * | . | G | 310 helix | trans | -50.2 | -24.5 | -174.6 | -173.3 | 64.9 | 0 | 0 | 0 | 114 | T53 Q57 L58 | T53-L55 PolarHBondContact O-N 2.98Å; L55-Q57 VanDerWaalsContact C-N 3.27Å; L55-Q57 PolarHBondContact O-N 3.13Å; L55-L58 HydrophobicContact CD1-CD2 4.17Å; L55-L58 PolarHBondContact O-N 3.4Å |
| 56 | S | 65.1 | Low | 76 | Confident | 109 Ų | 109 | 88.2 Ų | 88.2 | 76% | 0.762 | 46% | 0.456 | S | S | * | . | G | 310 helix | trans | -63.6 | -22.1 | 178.7 | 55.6 | 0 | 0 | 0 | 0 | 115 | P54 | P54-S56 PolarHBondContact O-N 3.34Š|
| 57 | Q | 69.8 | Low | 75.4 | Confident | 106 Ų | 106 | 86.1 Ų | 86.1 | 50% | 0.495 | 44% | 0.443 | S | S | . | . | G | 310 helix | trans | -104.5 | 4.5 | -178 | -65.3 | -171.6 | -14.6 | 0 | 0 | 114.1 | P54 L55 S59 T60 R61 | P54-Q57 PolarHBondContact O-N 3.46Å; L55-Q57 VanDerWaalsContact C-N 3.27Å; L55-Q57 PolarHBondContact O-N 3.13Å; Q57-S59 VanDerWaalsContact C-N 3.35Å; Q57-S59 PolarHBondContact O-N 3.23Å; Q57-T60 PolarHBondContact O-N 3.07Å; Q57-R61 PolarHBondContact O-N 3.05Å |
| 58 | L | 70.4 | Confident | 75 | Confident | 59 Ų | 59 | 77.6 Ų | 77.6 | 31% | 0.309 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -59.6 | -42.3 | -174.4 | -176.6 | 61.2 | 0 | 0 | 0 | 112.3 | L55 T60 R61 L62 | L55-L58 HydrophobicContact CD1-CD2 4.17Å; L55-L58 PolarHBondContact O-N 3.4Å; L58-T60 PolarHBondContact O-N 2.89Å; L58-R61 PolarHBondContact O-N 3.05Å; L58-L62 HydrophobicContact CD1-CD1 4.4Å; L58-L62 HydrophobicContact CD1-CD2 4.36Å; L58-L62 HydrophobicContact CD1-CG 4.08Å; L58-L62 HydrophobicContact CG-CD1 4.01Å; L58-L62 HydrophobicContact CG-CG 4.16Å; L58-L62 WeakPolarHBondContact O-CB 3.41Å; L58-L62 VanDerWaalsContact O-CG 3.27Å; L58-L62 WeakPolarHBondContact O-CG 3.23Å; L58-L62 PolarHBondContact O-N 3.21Å |
| 59 | S | 72.2 | Confident | 74.7 | Confident | 90 Ų | 90 | 78.2 Ų | 78.2 | 63% | 0.629 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -62.5 | -42.2 | -177.6 | 179.2 | 0 | 0 | 0 | 0 | 113 | Q57 L62 | Q57-S59 VanDerWaalsContact C-N 3.35Å; Q57-S59 PolarHBondContact O-N 3.23Å; S59-L62 PolarHBondContact O-N 3.4Å |
| 60 | T | 69.9 | Low | 74.8 | Confident | 98 Ų | 98 | 77.5 Ų | 77.5 | 60% | 0.601 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -68.6 | -38.4 | 178.6 | -49.6 | 0 | 0 | 0 | 0 | 111.4 | Q57 L58 N63 | Q57-T60 PolarHBondContact O-N 3.07Å; L58-T60 PolarHBondContact O-N 2.89Å; T60-N63 PolarHBondContact O-N 2.95Å |
| 61 | R | 67.5 | Low | 75 | Confident | 78 Ų | 78 | 74.7 Ų | 74.7 | 29% | 0.294 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -69.9 | -36.1 | 177.6 | -71.2 | -74 | -169.7 | -167.8 | -8.3 | 112.3 | Q57 L58 N63 K64 F65 D144 D145 | Q57-R61 PolarHBondContact O-N 3.05Å; L58-R61 PolarHBondContact O-N 3.05Å; R61-N63 PolarHBondContact O-N 3.41Å; R61-K64 CarbonylContact O-C 3.44Å; R61-K64 WeakPolarHBondContact O-CA 3.37Å; R61-K64 PolarHBondContact O-N 3.47Å; R61-F65 PolarHBondContact O-N 3.2Å; R61-F65 VanDerWaalsContact O-N 3.16Å; R61-D144 PolarHBondContact NH1-O 3.08Å; R61-D144 PolarHBondContact NH2-O 2.98Å; R61-D145 IonicContact CZ-OD2 3.23Å; R61-D145 IonicContact NH1-OD2 3.68Å; R61-D145 PolarHBondContact NH1-OD2 3.13Å |
| 62 | L | 72.9 | Confident | 75.2 | Confident | 78 Ų | 78 | 72.1 Ų | 72.1 | 41% | 0.408 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -60.8 | -29.1 | 176.7 | -75.8 | 176.2 | 0 | 0 | 0 | 112.8 | L58 S59 K64 F65 W71 | L58-L62 HydrophobicContact CD1-CD1 4.4Å; L58-L62 HydrophobicContact CD1-CD2 4.36Å; L58-L62 HydrophobicContact CD1-CG 4.08Å; L58-L62 HydrophobicContact CG-CD1 4.01Å; L58-L62 HydrophobicContact CG-CG 4.16Å; L58-L62 WeakPolarHBondContact O-CB 3.41Å; L58-L62 VanDerWaalsContact O-CG 3.27Å; L58-L62 WeakPolarHBondContact O-CG 3.23Å; L58-L62 PolarHBondContact O-N 3.21Å; S59-L62 PolarHBondContact O-N 3.4Å; L62-K64 PolarHBondContact O-N 3.17Å; L62-F65 VanDerWaalsContact O-CD1 3.29Å; L62-F65 WeakPolarHBondContact O-CD1 3.11Å; L62-W71 HydrophobicContact CD2-CH2 3.93Å; L62-W71 HydrophobicContact CD2-CZ2 3.7Å |
| 63 | N | 76.7 | Confident | 76 | Confident | 128 Ų | 128 | 72.8 Ų | 72.8 | 68% | 0.684 | 39% | 0.389 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.4 | -18.6 | 174.4 | -74.2 | -23.4 | 0 | 0 | 0 | 113.5 | T60 R61 | T60-N63 PolarHBondContact O-N 2.95Å; R61-N63 PolarHBondContact O-N 3.41Å |
| 64 | K | 75.2 | Confident | 77.4 | Confident | 50 Ų | 50 | 72.1 Ų | 72.1 | 22% | 0.217 | 38% | 0.383 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -118 | 22.2 | -178.9 | -61.7 | -175 | -173 | 178.6 | 0 | 112.2 | R61 L62 Y66 L67 Y141 D144 | R61-K64 CarbonylContact O-C 3.44Å; R61-K64 WeakPolarHBondContact O-CA 3.37Å; R61-K64 PolarHBondContact O-N 3.47Å; L62-K64 PolarHBondContact O-N 3.17Å; K64-Y66 PolarHBondContact O-N 2.93Å; K64-Y66 VanDerWaalsContact O-N 3.08Å; K64-L67 HydrophobicContact CB-CD1 4.29Å; K64-L67 PolarHBondContact O-N 3.41Å; K64-Y141 HydrophobicContact CD-CD1 4.45Å; K64-Y141 HydrophobicContact CD-CD2 4.42Å; K64-Y141 HydrophobicContact CD-CE1 4.42Å; K64-Y141 HydrophobicContact CD-CE2 4.4Å; K64-Y141 HydrophobicContact CD-CG 4.42Å; K64-D144 IonicContact NZ-OD2 2.72Å; K64-D144 PolarHBondContact NZ-OD2 2.96Å |
| 65 | F | 81.4 | Confident | 78.5 | Confident | 100 Ų | 100 | 72.7 Ų | 72.7 | 44% | 0.439 | 38% | 0.381 | S | S | . | . | G | 310 helix | trans | -58 | -28.4 | -174.1 | 79.9 | -85.7 | 0 | 0 | 0 | 113.6 | R61 L62 L67 D68 W71 | R61-F65 PolarHBondContact O-N 3.2Å; R61-F65 VanDerWaalsContact O-N 3.16Å; L62-F65 VanDerWaalsContact O-CD1 3.29Å; L62-F65 WeakPolarHBondContact O-CD1 3.11Å; F65-L67 PolarHBondContact O-N 3.44Å; F65-D68 PolarHBondContact O-N 3.43Å; F65-W71 HydrophobicContact CB-CD2 4.38Å; F65-W71 HydrophobicContact CB-CG 4.05Å |
| 66 | Y | 80.8 | Confident | 79.8 | Confident | 76 Ų | 76 | 70.2 Ų | 70.2 | 30% | 0.298 | 37% | 0.368 | S | S | . | . | G | 310 helix | trans | -72.2 | -14.9 | 179.9 | 65.7 | -88.5 | 0 | 0 | 0 | 113.9 | K64 R134 D137 | K64-Y66 PolarHBondContact O-N 2.93Å; K64-Y66 VanDerWaalsContact O-N 3.08Å; Y66-R134 PolarHBondContact OH-NH1 2.87Å; Y66-D137 HydrophobicContact CE2-CB 4.45Å; Y66-D137 PolarHBondContact OH-OD2 3.38Å |
| 67 | L | 78.2 | Confident | 81.2 | Confident | 12 Ų | 12 | 65 Ų | 65 | 6% | 0.063 | 33% | 0.332 | C | S | . | . | G | 310 helix | trans | -90.4 | -19.6 | 177.2 | -65.5 | 173.5 | 0 | 0 | 0 | 112.7 | K64 F65 P69 D137 M138 Y141 L148 | K64-L67 HydrophobicContact CB-CD1 4.29Å; K64-L67 PolarHBondContact O-N 3.41Å; F65-L67 PolarHBondContact O-N 3.44Å; L67-P69 WeakPolarHBondContact O-CD 3.08Å; L67-D137 HydrophobicContact CD1-CB 4.36Å; L67-D137 HydrophobicContact CD2-CB 4.1Å; L67-M138 HydrophobicContact CD2-CG 3.96Å; L67-Y141 HydrophobicContact CD1-CD2 3.41Å; L67-Y141 VanDerWaalsContact CD1-CD2 3.41Å; L67-Y141 HydrophobicContact CD1-CE2 4.16Å; L67-Y141 HydrophobicContact CD1-CG 4.13Å; L67-L148 HydrophobicContact CB-CD2 4.32Å |
| 68 | D | 82.9 | Confident | 82.4 | Confident | 8 Ų | 8 | 60.7 Ų | 60.7 | 4% | 0.043 | 32% | 0.315 | C | S | . | . | trans | -94 | 114.7 | -178.3 | 176.4 | -0.8 | 0 | 0 | 0 | 110.4 | Q49 K52 F65 A70 W71 | Q49-D68 PolarHBondContact NE2-OD2 3.44Å; K52-D68 IonicContact NZ-OD1 2.62Å; K52-D68 PolarHBondContact NZ-OD1 3.48Å; K52-D68 IonicContact NZ-OD2 3.08Å; K52-D68 PolarHBondContact NZ-OD2 3.5Å; F65-D68 PolarHBondContact O-N 3.43Å; D68-A70 PolarHBondContact O-N 2.89Å; D68-A70 VanDerWaalsContact O-N 3.11Å; D68-A70 VanDerWaalsContact OD1-CB 3.3Å; D68-A70 WeakPolarHBondContact OD1-CB 3.28Å; D68-A70 PolarHBondContact OD1-N 3.33Å; D68-W71 PolarHBondContact O-N 2.85Å; D68-W71 VanDerWaalsContact O-N 3.14Å | ||
| 69 | P | 82.3 | Confident | 83.5 | Confident | 38 Ų | 38 | 60.8 Ų | 60.8 | 25% | 0.247 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -60.6 | -22.4 | -178.5 | 24.9 | -34.1 | 0 | 0 | 0 | 113.5 | L67 W71 L72 L73 D147 | L67-P69 WeakPolarHBondContact O-CD 3.08Å; P69-W71 PolarHBondContact O-N 2.91Å; P69-L72 WeakPolarHBondContact O-CB 3.37Å; P69-L72 PolarHBondContact O-N 3.31Å; P69-L73 PolarHBondContact O-N 3.31Å; P69-D147 HydrophobicContact CG-CB 3.93Å |
| 70 | A | 87.4 | Confident | 84.4 | Confident | 4 Ų | 4 | 59.3 Ų | 59.3 | 3% | 0.033 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -67.3 | -33.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | A48 Q49 D68 L72 L73 I74 | A48-A70 HydrophobicContact CB-CB 3.91Å; Q49-A70 HydrophobicContact CG-CB 4.33Å; D68-A70 PolarHBondContact O-N 2.89Å; D68-A70 VanDerWaalsContact O-N 3.11Å; D68-A70 VanDerWaalsContact OD1-CB 3.3Å; D68-A70 WeakPolarHBondContact OD1-CB 3.28Å; D68-A70 PolarHBondContact OD1-N 3.33Å; A70-L72 VanDerWaalsContact C-N 3.33Å; A70-L72 PolarHBondContact O-N 2.83Å; A70-L73 PolarHBondContact O-N 2.9Å; A70-I74 WeakPolarHBondContact O-CG1 3.41Å; A70-I74 PolarHBondContact O-N 2.91Å |
| 71 | W | 87.8 | Confident | 85.5 | Confident | 59 Ų | 59 | 57.1 Ų | 57.1 | 22% | 0.223 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -65.3 | -37.5 | 173.9 | -81.2 | 103.9 | 0 | 0 | 0 | 112 | Q49 L62 F65 D68 P69 L73 I74 I75 | Q49-W71 VanDerWaalsContact NE2-CD1 3.25Å; L62-W71 HydrophobicContact CD2-CH2 3.93Å; L62-W71 HydrophobicContact CD2-CZ2 3.7Å; F65-W71 HydrophobicContact CB-CD2 4.38Å; F65-W71 HydrophobicContact CB-CG 4.05Å; D68-W71 PolarHBondContact O-N 2.85Å; D68-W71 VanDerWaalsContact O-N 3.14Å; P69-W71 PolarHBondContact O-N 2.91Å; W71-L73 VanDerWaalsContact C-N 3.34Å; W71-L73 PolarHBondContact O-N 3.34Å; W71-I74 PolarHBondContact O-N 2.89Å; W71-I75 VanDerWaalsContact O-CG1 3.32Å; W71-I75 WeakPolarHBondContact O-CG1 3.31Å; W71-I75 PolarHBondContact O-N 3.34Å |
| 72 | L | 87.6 | Confident | 86.8 | Confident | 96 Ų | 96 | 57.1 Ų | 57.1 | 50% | 0.503 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -61.7 | -42.5 | 174.1 | -66.9 | 176 | 0 | 0 | 0 | 111.5 | P69 A70 I74 I75 I76 | P69-L72 WeakPolarHBondContact O-CB 3.37Å; P69-L72 PolarHBondContact O-N 3.31Å; A70-L72 VanDerWaalsContact C-N 3.33Å; A70-L72 PolarHBondContact O-N 2.83Å; L72-I74 PolarHBondContact O-N 3.46Å; L72-I75 PolarHBondContact O-N 2.74Å; L72-I76 WeakPolarHBondContact O-CB 3.41Å; L72-I76 VanDerWaalsContact O-CG1 3.28Å; L72-I76 WeakPolarHBondContact O-CG1 3.28Å; L72-I76 PolarHBondContact O-N 2.86Å |
| 73 | L | 90.4 | Very high | 87.7 | Confident | 73 Ų | 73 | 55 Ų | 55 | 38% | 0.382 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -61.9 | -41.7 | 174.8 | -66.3 | 177.1 | 0 | 0 | 0 | 112.2 | I41 V44 P69 A70 W71 G77 | I41-L73 HydrophobicContact CG2-CB 4.35Å; I41-L73 HydrophobicContact CG2-CD2 4.14Å; V44-L73 HydrophobicContact CG1-CD1 4.46Å; P69-L73 PolarHBondContact O-N 3.31Å; A70-L73 PolarHBondContact O-N 2.9Å; W71-L73 VanDerWaalsContact C-N 3.34Å; W71-L73 PolarHBondContact O-N 3.34Å; L73-G77 WeakPolarHBondContact O-CA 3.49Å; L73-G77 PolarHBondContact O-N 3.47Å |
| 74 | I | 93 | Very high | 88.3 | Confident | 32 Ų | 32 | 49.4 Ų | 49.4 | 16% | 0.164 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -64 | -46.2 | 177.4 | -68.7 | 172.5 | 0 | 0 | 0 | 111.1 | L42 G45 V46 Q49 A70 W71 L72 G78 | L42-I74 HydrophobicContact CD1-CG2 4.1Å; G45-I74 VanDerWaalsContact C-CG1 3.45Å; V46-I74 HydrophobicContact CG2-CD1 4.37Å; V46-I74 HydrophobicContact CG2-CG1 4.25Å; Q49-I74 HydrophobicContact CB-CD1 4.21Å; Q49-I74 HydrophobicContact CG-CD1 3.4Å; A70-I74 WeakPolarHBondContact O-CG1 3.41Å; A70-I74 PolarHBondContact O-N 2.91Å; W71-I74 PolarHBondContact O-N 2.89Å; L72-I74 PolarHBondContact O-N 3.46Å; I74-G78 WeakPolarHBondContact O-CA 3.1Å; I74-G78 PolarHBondContact O-N 3.15Å |
| 75 | I | 92.8 | Very high | 89.1 | Confident | 83 Ų | 83 | 51 Ų | 51 | 43% | 0.426 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -65.2 | -51 | -178.6 | -66.8 | 166.8 | 0 | 0 | 0 | 110.1 | W71 L72 G78 V79 | W71-I75 VanDerWaalsContact O-CG1 3.32Å; W71-I75 WeakPolarHBondContact O-CG1 3.31Å; W71-I75 PolarHBondContact O-N 3.34Å; L72-I75 PolarHBondContact O-N 2.74Å; I75-G78 PolarHBondContact O-N 3.22Å; I75-V79 WeakPolarHBondContact O-CB 3.2Å; I75-V79 VanDerWaalsContact O-CG2 3.31Å; I75-V79 WeakPolarHBondContact O-CG2 3.39Å; I75-V79 PolarHBondContact O-N 2.96Å |
| 76 | I | 91.9 | Very high | 89.6 | Confident | 98 Ų | 98 | 46.7 Ų | 46.7 | 50% | 0.503 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -65.4 | -47.8 | -178.8 | -65.6 | 170.4 | 0 | 0 | 0 | 110.6 | L72 G78 T80 | L72-I76 WeakPolarHBondContact O-CB 3.41Å; L72-I76 VanDerWaalsContact O-CG1 3.28Å; L72-I76 WeakPolarHBondContact O-CG1 3.28Å; L72-I76 PolarHBondContact O-N 2.86Å; I76-G78 PolarHBondContact O-N 2.9Å; I76-T80 HydrophobicContact CG2-CG2 4.43Å; I76-T80 WeakPolarHBondContact O-CB 3.48Å; I76-T80 VanDerWaalsContact O-CG2 3.24Å; I76-T80 WeakPolarHBondContact O-CG2 3.48Å; I76-T80 PolarHBondContact O-N 3.38Å; I76-T80 PolarHBondContact O-OG1 3.49Å |
| 77 | G | 94.5 | Very high | 90.1 | Very high | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -61.5 | -41.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | L73 T80 F81 | L73-G77 WeakPolarHBondContact O-CA 3.49Å; L73-G77 PolarHBondContact O-N 3.47Å; G77-T80 WeakPolarHBondContact CA-OG1 3.43Å; G77-T80 PolarHBondContact O-OG1 2.77Å; G77-F81 WeakPolarHBondContact O-CB 3.12Å; G77-F81 PolarHBondContact O-N 3.49Å |
| 78 | G | 95.1 | Very high | 90.5 | Very high | 14 Ų | 14 | 43.3 Ų | 43.3 | 14% | 0.144 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -65.6 | -49 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | I74 I75 I76 F81 I82 | I74-G78 WeakPolarHBondContact O-CA 3.1Å; I74-G78 PolarHBondContact O-N 3.15Å; I75-G78 PolarHBondContact O-N 3.22Å; I76-G78 PolarHBondContact O-N 2.9Å; G78-F81 PolarHBondContact O-N 3.48Å; G78-I82 WeakPolarHBondContact O-CB 3.29Å; G78-I82 VanDerWaalsContact O-CG1 3.26Å; G78-I82 WeakPolarHBondContact O-CG1 3.46Å; G78-I82 PolarHBondContact O-N 2.96Å |
| 79 | V | 93.5 | Very high | 90.8 | Very high | 62 Ų | 62 | 44.7 Ų | 44.7 | 38% | 0.376 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -61.9 | -48 | 177.7 | 171.2 | 0 | 0 | 0 | 0 | 110.7 | I75 F81 I82 I83 L109 | I75-V79 WeakPolarHBondContact O-CB 3.2Å; I75-V79 VanDerWaalsContact O-CG2 3.31Å; I75-V79 WeakPolarHBondContact O-CG2 3.39Å; I75-V79 PolarHBondContact O-N 2.96Å; V79-F81 PolarHBondContact O-N 3.49Å; V79-I82 PolarHBondContact O-N 3.19Å; V79-I83 HydrophobicContact CG1-CD1 3.71Å; V79-I83 WeakPolarHBondContact O-CB 3.35Å; V79-I83 WeakPolarHBondContact O-CG1 3.4Å; V79-I83 PolarHBondContact O-N 3.46Å; V79-L109 HydrophobicContact CG1-CD1 4.29Å; V79-L109 HydrophobicContact CG1-CD2 4.45Å |
| 80 | T | 90.3 | Very high | 91.2 | Very high | 58 Ų | 58 | 42.9 Ų | 42.9 | 36% | 0.356 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -63.5 | -40.1 | 179.1 | 53.3 | 0 | 0 | 0 | 0 | 112.3 | G38 I76 G77 G84 | G38-T80 WeakPolarHBondContact CA-OG1 3.36Å; I76-T80 HydrophobicContact CG2-CG2 4.43Å; I76-T80 WeakPolarHBondContact O-CB 3.48Å; I76-T80 VanDerWaalsContact O-CG2 3.24Å; I76-T80 WeakPolarHBondContact O-CG2 3.48Å; I76-T80 PolarHBondContact O-N 3.38Å; I76-T80 PolarHBondContact O-OG1 3.49Å; G77-T80 WeakPolarHBondContact CA-OG1 3.43Å; G77-T80 PolarHBondContact O-OG1 2.77Å; T80-G84 PolarHBondContact O-N 2.77Å |
| 81 | F | 94 | Very high | 91.2 | Very high | 53 Ų | 53 | 44.1 Ų | 44.1 | 23% | 0.232 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -63.4 | -47.4 | 174.7 | 175.7 | -106.9 | 0 | 0 | 0 | 112.2 | M35 L39 L42 G77 G78 V79 I83 G84 F85 | M35-F81 HydrophobicContact CG-CD2 4.21Å; M35-F81 HydrophobicContact CG-CE2 4.22Å; L39-F81 HydrophobicContact CB-CD2 3.73Å; L39-F81 HydrophobicContact CB-CE2 4.01Å; L39-F81 HydrophobicContact CD1-CD2 4.1Å; L39-F81 HydrophobicContact CD1-CE2 3.89Å; L39-F81 HydrophobicContact CD1-CZ 4.29Å; L39-F81 HydrophobicContact CD2-CE2 4.36Å; L39-F81 HydrophobicContact CG-CD2 4.43Å; L39-F81 HydrophobicContact CG-CE2 4.31Å; L42-F81 HydrophobicContact CD2-CD1 4.38Å; G77-F81 WeakPolarHBondContact O-CB 3.12Å; G77-F81 PolarHBondContact O-N 3.49Å; G78-F81 PolarHBondContact O-N 3.48Å; V79-F81 PolarHBondContact O-N 3.49Å; F81-I83 PolarHBondContact O-N 3.47Å; F81-G84 PolarHBondContact O-N 2.91Å; F81-F85 HydrophobicContact CZ-CD2 4.35Å; F81-F85 WeakPolarHBondContact O-CB 3.46Å; F81-F85 PolarHBondContact O-N 2.89Å |
| 82 | I | 93.9 | Very high | 91.1 | Very high | 78 Ų | 78 | 46 Ų | 46 | 40% | 0.4 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -62.5 | -45.8 | -179.3 | -70.3 | 166.6 | 0 | 0 | 0 | 110.9 | G78 V79 F85 T86 F105 | G78-I82 WeakPolarHBondContact O-CB 3.29Å; G78-I82 VanDerWaalsContact O-CG1 3.26Å; G78-I82 WeakPolarHBondContact O-CG1 3.46Å; G78-I82 PolarHBondContact O-N 2.96Å; V79-I82 PolarHBondContact O-N 3.19Å; I82-F85 PolarHBondContact O-N 2.93Å; I82-T86 WeakPolarHBondContact O-CB 3.41Å; I82-T86 WeakPolarHBondContact O-CG2 3.36Å; I82-T86 PolarHBondContact O-N 3.42Å; I82-T86 PolarHBondContact O-OG1 3.23Å; I82-F105 HydrophobicContact CG2-CD2 3.86Å; I82-F105 HydrophobicContact CG2-CE2 3.54Å; I82-F105 HydrophobicContact CG2-CZ 3.96Å |
| 83 | I | 92.1 | Very high | 91.2 | Very high | 32 Ų | 32 | 50.8 Ų | 50.8 | 16% | 0.164 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -65.3 | -46.6 | 178.4 | -67.6 | 172 | 0 | 0 | 0 | 110.2 | V79 F81 F85 T86 G87 Y102 F105 V106 L109 | V79-I83 HydrophobicContact CG1-CD1 3.71Å; V79-I83 WeakPolarHBondContact O-CB 3.35Å; V79-I83 WeakPolarHBondContact O-CG1 3.4Å; V79-I83 PolarHBondContact O-N 3.46Å; F81-I83 PolarHBondContact O-N 3.47Å; I83-F85 PolarHBondContact O-N 2.86Å; I83-T86 PolarHBondContact O-OG1 3.49Å; I83-G87 PolarHBondContact O-N 2.94Å; I83-Y102 HydrophobicContact CG2-CD2 3.95Å; I83-Y102 HydrophobicContact CG2-CE2 3.68Å; I83-Y102 WeakPolarHBondContact O-CD2 3.36Å; I83-F105 HydrophobicContact CG1-CB 4.03Å; I83-V106 HydrophobicContact CG2-CG2 4.03Å; I83-L109 HydrophobicContact CD1-CD1 3.28Å; I83-L109 HydrophobicContact CD1-CG 4.29Å |
| 84 | G | 89 | Confident | 91.1 | Very high | 12 Ų | 12 | 50.1 Ų | 50.1 | 12% | 0.124 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -60.7 | -43.7 | 177 | 0 | 0 | 0 | 0 | 0 | 112.8 | T80 F81 C88 | T80-G84 PolarHBondContact O-N 2.77Å; F81-G84 PolarHBondContact O-N 2.91Å; G84-C88 WeakPolarHBondContact O-CB 3.31Å; G84-C88 PolarHBondContact O-N 2.99Å |
| 85 | F | 91.4 | Very high | 91.1 | Very high | 83 Ų | 83 | 51.3 Ų | 51.3 | 36% | 0.364 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -65 | -51.7 | 178.7 | 177.9 | -94.5 | 0 | 0 | 0 | 111.8 | M35 F81 I82 I83 G87 I89 | M35-F85 HydrophobicContact SD-CB 4.45Å; M35-F85 HydrophobicContact SD-CD2 4.31Å; F81-F85 HydrophobicContact CZ-CD2 4.35Å; F81-F85 WeakPolarHBondContact O-CB 3.46Å; F81-F85 PolarHBondContact O-N 2.89Å; I82-F85 PolarHBondContact O-N 2.93Å; I83-F85 PolarHBondContact O-N 2.86Å; F85-G87 PolarHBondContact O-N 3.47Å; F85-I89 HydrophobicContact CD2-CG1 3.81Å; F85-I89 HydrophobicContact CE2-CG1 3.75Å; F85-I89 HydrophobicContact CG-CG1 4.33Å; F85-I89 HydrophobicContact CZ-CG1 4.2Å; F85-I89 VanDerWaalsContact O-CB 3.25Å; F85-I89 WeakPolarHBondContact O-CB 3.44Å; F85-I89 WeakPolarHBondContact O-CG1 3.48Å; F85-I89 PolarHBondContact O-N 3.06Å |
| 86 | T | 93.1 | Very high | 91.1 | Very high | 9 Ų | 9 | 48.1 Ų | 48.1 | 6% | 0.055 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -64.1 | -40.8 | -179.5 | 51.3 | 0 | 0 | 0 | 0 | 112 | I82 I83 G90 L98 C101 F105 | I82-T86 WeakPolarHBondContact O-CB 3.41Å; I82-T86 WeakPolarHBondContact O-CG2 3.36Å; I82-T86 PolarHBondContact O-N 3.42Å; I82-T86 PolarHBondContact O-OG1 3.23Å; I83-T86 PolarHBondContact O-OG1 3.49Å; T86-G90 VanDerWaalsContact O-CA 3.28Å; T86-G90 WeakPolarHBondContact O-CA 3.34Å; T86-G90 PolarHBondContact O-N 3.26Å; T86-L98 HydrophobicContact CG2-CD2 4.28Å; T86-C101 HydrophobicContact CG2-CB 4.19Å; T86-F105 HydrophobicContact CG2-CD2 4.43Å; T86-F105 HydrophobicContact CG2-CE2 4.16Å |
| 87 | G | 89.9 | Confident | 91.2 | Very high | 10 Ų | 10 | 47.3 Ų | 47.3 | 10% | 0.103 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -67.1 | -52 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | I83 F85 A91 | I83-G87 PolarHBondContact O-N 2.94Å; F85-G87 PolarHBondContact O-N 3.47Å; G87-A91 WeakPolarHBondContact O-CB 3.39Å; G87-A91 PolarHBondContact O-N 3.2Å |
| 88 | C | 87.4 | Confident | 91.3 | Very high | 7 Ų | 7 | 48.9 Ų | 48.9 | 5% | 0.047 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -68.4 | -52.5 | -176.2 | -173 | 0 | 0 | 0 | 0 | 112.1 | F31 G84 A91 L92 | F31-C88 HydrophobicContact CB-CB 4.45Å; G84-C88 WeakPolarHBondContact O-CB 3.31Å; G84-C88 PolarHBondContact O-N 2.99Å; C88-A91 PolarHBondContact O-N 3.33Å; C88-L92 WeakPolarHBondContact O-CB 3.46Å; C88-L92 WeakPolarHBondContact O-CG 3.23Å; C88-L92 PolarHBondContact O-N 3.31Å |
| 89 | I | 90.3 | Very high | 91.2 | Very high | 37 Ų | 37 | 48.5 Ų | 48.5 | 19% | 0.19 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -70 | -35.2 | -179.4 | -55.8 | -58.1 | 0 | 0 | 0 | 111 | F85 A91 L92 R93 L98 | F85-I89 HydrophobicContact CD2-CG1 3.81Å; F85-I89 HydrophobicContact CE2-CG1 3.75Å; F85-I89 HydrophobicContact CG-CG1 4.33Å; F85-I89 HydrophobicContact CZ-CG1 4.2Å; F85-I89 VanDerWaalsContact O-CB 3.25Å; F85-I89 WeakPolarHBondContact O-CB 3.44Å; F85-I89 WeakPolarHBondContact O-CG1 3.48Å; F85-I89 PolarHBondContact O-N 3.06Å; I89-A91 VanDerWaalsContact C-N 3.33Å; I89-A91 PolarHBondContact O-N 3.25Å; I89-L92 PolarHBondContact O-N 3Å; I89-R93 HydrophobicContact CG2-CG 4.12Å; I89-R93 WeakPolarHBondContact O-CB 3.46Å; I89-R93 PolarHBondContact O-N 3.44Å; I89-L98 HydrophobicContact CB-CD1 4.12Å; I89-L98 HydrophobicContact CG2-CD1 3.7Å |
| 90 | G | 90.3 | Very high | 91.2 | Very high | 0 Ų | 0 | 46.5 Ų | 46.5 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -58.9 | -43.6 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | T86 E94 N95 | T86-G90 VanDerWaalsContact O-CA 3.28Å; T86-G90 WeakPolarHBondContact O-CA 3.34Å; T86-G90 PolarHBondContact O-N 3.26Å; G90-E94 WeakPolarHBondContact O-CA 3.37Å; G90-E94 PolarHBondContact O-N 2.9Å; G90-N95 PolarHBondContact O-N 2.9Å |
| 91 | A | 86.5 | Confident | 91.5 | Very high | 31 Ų | 31 | 46 Ų | 46 | 26% | 0.256 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -72 | -44.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | G87 C88 I89 E94 L304 | G87-A91 WeakPolarHBondContact O-CB 3.39Å; G87-A91 PolarHBondContact O-N 3.2Å; C88-A91 PolarHBondContact O-N 3.33Å; I89-A91 VanDerWaalsContact C-N 3.33Å; I89-A91 PolarHBondContact O-N 3.25Å; A91-E94 PolarHBondContact O-N 2.92Å; A91-L304 HydrophobicContact CB-CD2 3.93Å |
| 92 | L | 85.8 | Confident | 91.5 | Very high | 97 Ų | 97 | 45 Ų | 45 | 51% | 0.508 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -66.1 | -39.8 | -178 | -76 | 172.6 | 0 | 0 | 0 | 113.1 | V28 C88 I89 | V28-L92 HydrophobicContact CG1-CD2 4.17Å; C88-L92 WeakPolarHBondContact O-CB 3.46Å; C88-L92 WeakPolarHBondContact O-CG 3.23Å; C88-L92 PolarHBondContact O-N 3.31Å; I89-L92 PolarHBondContact O-N 3Å |
| 93 | R | 89.2 | Confident | 91.5 | Very high | 197 Ų | 197 | 42 Ų | 42 | 74% | 0.743 | 22% | 0.223 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -93.4 | 2.7 | -179.9 | -66 | -168 | 173.8 | -170.9 | -0.9 | 113.6 | I89 N95 | I89-R93 HydrophobicContact CG2-CG 4.12Å; I89-R93 WeakPolarHBondContact O-CB 3.46Å; I89-R93 PolarHBondContact O-N 3.44Å; R93-N95 HydrophobicContact CB-CB 4.29Å; R93-N95 PolarHBondContact O-N 2.69Å; R93-N95 VanDerWaalsContact O-N 3.1Å |
| 94 | E | 89.8 | Confident | 91.7 | Very high | 59 Ų | 59 | 42.9 Ų | 42.9 | 28% | 0.276 | 24% | 0.236 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 48.6 | 39.9 | -174 | -64.4 | 179.5 | 176.5 | 0 | 0 | 111.3 | R21 G90 A91 T96 V308 | R21-E94 IonicContact CZ-OE1 3.41Å; R21-E94 IonicContact NH1-OE1 2.9Å; R21-E94 PolarHBondContact NH1-OE1 3.34Å; R21-E94 IonicContact NH2-OE1 2.93Å; R21-E94 PolarHBondContact NH2-OE1 2.96Å; G90-E94 WeakPolarHBondContact O-CA 3.37Å; G90-E94 PolarHBondContact O-N 2.9Å; A91-E94 PolarHBondContact O-N 2.92Å; E94-T96 PolarHBondContact O-N 3.45Å; E94-V308 HydrophobicContact CB-CG2 3.89Å; E94-V308 HydrophobicContact CG-CG2 4.31Å |
| 95 | N | 91.8 | Very high | 92 | Very high | 57 Ų | 57 | 46.2 Ų | 46.2 | 31% | 0.305 | 25% | 0.247 | S | C | . | . | trans | -91.9 | 102.7 | -176.3 | -174.5 | -20.3 | 0 | 0 | 0 | 109.5 | G90 R93 C97 L98 L99 | G90-N95 PolarHBondContact O-N 2.9Å; R93-N95 HydrophobicContact CB-CB 4.29Å; R93-N95 PolarHBondContact O-N 2.69Å; R93-N95 VanDerWaalsContact O-N 3.1Å; N95-C97 PolarHBondContact O-N 3.42Å; N95-C97 WeakPolarHBondContact OD1-CB 3.44Å; N95-C97 PolarHBondContact OD1-N 2.98Å; N95-L98 HydrophobicContact CB-CB 4.3Å; N95-L98 HydrophobicContact CB-CD1 4.16Å; N95-L98 HydrophobicContact CB-CG 4.34Å; N95-L98 PolarHBondContact O-N 3.25Å; N95-L98 PolarHBondContact OD1-N 3.28Å; N95-L99 PolarHBondContact O-N 3.04Å; N95-L99 VanDerWaalsContact O-N 3.07Å | ||
| 96 | T | 92.6 | Very high | 92.1 | Very high | 17 Ų | 17 | 42.6 Ų | 42.6 | 10% | 0.104 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -61.1 | -28.7 | -177.2 | 55.2 | 0 | 0 | 0 | 0 | 113.6 | E94 A100 R305 V308 F309 | E94-T96 PolarHBondContact O-N 3.45Å; T96-A100 VanDerWaalsContact O-CB 3.31Å; T96-A100 WeakPolarHBondContact O-CB 3.47Å; T96-A100 PolarHBondContact O-N 3Å; T96-R305 HydrophobicContact CG2-CG 4.13Å; T96-V308 HydrophobicContact CG2-CB 3.88Å; T96-V308 HydrophobicContact CG2-CG1 3.53Å; T96-F309 HydrophobicContact CG2-CD1 4.49Å; T96-F309 HydrophobicContact CG2-CE1 4.15Å; T96-F309 HydrophobicContact CG2-CE2 4.35Å; T96-F309 HydrophobicContact CG2-CZ 4.08Å |
| 97 | C | 95.5 | Very high | 92.2 | Very high | 80 Ų | 80 | 43.1 Ų | 43.1 | 54% | 0.541 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -69.2 | -48.2 | 176.5 | 177.6 | 0 | 0 | 0 | 0 | 111 | N95 L99 A100 C101 | N95-C97 PolarHBondContact O-N 3.42Å; N95-C97 WeakPolarHBondContact OD1-CB 3.44Å; N95-C97 PolarHBondContact OD1-N 2.98Å; C97-L99 VanDerWaalsContact C-N 3.32Å; C97-L99 PolarHBondContact O-N 2.94Å; C97-A100 WeakPolarHBondContact O-CB 3.14Å; C97-A100 PolarHBondContact O-N 3.47Å; C97-C101 PolarHBondContact O-N 3.39Å; C97-C101 PolarHBondContact O-SG 3.34Å; C97-C101 VanDerWaalsContact O-SG 3.33Å |
| 98 | L | 94.8 | Very high | 92.5 | Very high | 34 Ų | 34 | 47 Ų | 47 | 18% | 0.178 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -63.4 | -39.2 | 177.4 | -72.5 | 177.8 | 0 | 0 | 0 | 112.1 | T86 I89 N95 A100 C101 Y102 | T86-L98 HydrophobicContact CG2-CD2 4.28Å; I89-L98 HydrophobicContact CB-CD1 4.12Å; I89-L98 HydrophobicContact CG2-CD1 3.7Å; N95-L98 HydrophobicContact CB-CB 4.3Å; N95-L98 HydrophobicContact CB-CD1 4.16Å; N95-L98 HydrophobicContact CB-CG 4.34Å; N95-L98 PolarHBondContact O-N 3.25Å; N95-L98 PolarHBondContact OD1-N 3.28Å; L98-A100 VanDerWaalsContact C-N 3.32Å; L98-A100 PolarHBondContact O-N 2.91Å; L98-C101 WeakPolarHBondContact O-CB 3.32Å; L98-C101 PolarHBondContact O-N 2.88Å; L98-Y102 PolarHBondContact O-N 2.83Å |
| 99 | L | 93.2 | Very high | 92.7 | Very high | 6 Ų | 6 | 49.3 Ų | 49.3 | 3% | 0.031 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -67.5 | -34.5 | 177.4 | -163 | 59 | 0 | 0 | 0 | 112.2 | N95 C97 S103 A301 L304 R305 | N95-L99 PolarHBondContact O-N 3.04Å; N95-L99 VanDerWaalsContact O-N 3.07Å; C97-L99 VanDerWaalsContact C-N 3.32Å; C97-L99 PolarHBondContact O-N 2.94Å; L99-S103 PolarHBondContact O-N 2.75Å; L99-S103 PolarHBondContact O-OG 3.21Å; L99-A301 HydrophobicContact CD1-CB 3.56Å; L99-A301 WeakPolarHBondContact CD2-O 3.37Å; L99-A301 HydrophobicContact CG-CB 3.85Å; L99-A301 WeakPolarHBondContact CG-O 3.06Å; L99-L304 HydrophobicContact CD1-CD2 4.39Å; L99-L304 HydrophobicContact CD2-CB 3.81Å; L99-L304 HydrophobicContact CD2-CD2 3.74Å; L99-L304 HydrophobicContact CD2-CG 3.77Å; L99-R305 HydrophobicContact CD2-CB 3.95Å |
| 100 | A | 94.9 | Very high | 92.9 | Very high | 20 Ų | 20 | 49 Ų | 49 | 17% | 0.165 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -64.2 | -46.2 | 170.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | T96 C97 L98 Y102 S103 A104 | T96-A100 VanDerWaalsContact O-CB 3.31Å; T96-A100 WeakPolarHBondContact O-CB 3.47Å; T96-A100 PolarHBondContact O-N 3Å; C97-A100 WeakPolarHBondContact O-CB 3.14Å; C97-A100 PolarHBondContact O-N 3.47Å; L98-A100 VanDerWaalsContact C-N 3.32Å; L98-A100 PolarHBondContact O-N 2.91Å; A100-Y102 PolarHBondContact O-N 2.75Å; A100-S103 PolarHBondContact O-N 3.14Å; A100-S103 PolarHBondContact O-OG 2.93Å; A100-A104 WeakPolarHBondContact O-CB 3.13Å; A100-A104 PolarHBondContact O-N 2.93Å |
| 101 | C | 96.1 | Very high | 93.1 | Very high | 46 Ų | 46 | 54.1 Ų | 54.1 | 31% | 0.311 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -59.3 | -45.3 | 175.8 | -66.9 | 0 | 0 | 0 | 0 | 111.7 | T86 C97 L98 S103 A104 F105 | T86-C101 HydrophobicContact CG2-CB 4.19Å; C97-C101 PolarHBondContact O-N 3.39Å; C97-C101 PolarHBondContact O-SG 3.34Å; C97-C101 VanDerWaalsContact O-SG 3.33Å; L98-C101 WeakPolarHBondContact O-CB 3.32Å; L98-C101 PolarHBondContact O-N 2.88Å; C101-S103 PolarHBondContact O-N 2.99Å; C101-A104 PolarHBondContact O-N 3.4Å; C101-A104 VanDerWaalsContact O-N 3.16Å; C101-F105 HydrophobicContact CB-CD2 4.37Å; C101-F105 HydrophobicContact CB-CE2 4.02Å; C101-F105 WeakPolarHBondContact O-CD2 3.26Å; C101-F105 WeakPolarHBondContact O-CG 3.41Å; C101-F105 PolarHBondContact O-N 3.39Å |
| 102 | Y | 94.2 | Very high | 93.5 | Very high | 34 Ų | 34 | 57.5 Ų | 57.5 | 13% | 0.133 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -54.5 | -51.7 | 174.3 | 168.8 | -97.9 | 0 | 0 | 0 | 111.3 | I83 L98 A100 A104 F105 V106 A301 | I83-Y102 HydrophobicContact CG2-CD2 3.95Å; I83-Y102 HydrophobicContact CG2-CE2 3.68Å; I83-Y102 WeakPolarHBondContact O-CD2 3.36Å; L98-Y102 PolarHBondContact O-N 2.83Å; A100-Y102 PolarHBondContact O-N 2.75Å; Y102-A104 VanDerWaalsContact C-N 3.27Å; Y102-A104 PolarHBondContact O-N 3.1Å; Y102-F105 PolarHBondContact O-N 3.17Å; Y102-V106 HydrophobicContact CD2-CG2 4.15Å; Y102-V106 HydrophobicContact CE1-CG2 4.31Å; Y102-V106 HydrophobicContact CE2-CG2 3.71Å; Y102-V106 WeakPolarHBondContact O-CG2 3.19Å; Y102-V106 PolarHBondContact O-N 2.78Å; Y102-A301 HydrophobicContact CD1-CB 3.6Å; Y102-A301 HydrophobicContact CE1-CB 3.85Å |
| 103 | S | 93.9 | Very high | 93.7 | Very high | 13 Ų | 13 | 55.3 Ų | 55.3 | 9% | 0.091 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -62.3 | -33.8 | 179.2 | 68.1 | 0 | 0 | 0 | 0 | 113.3 | L99 A100 C101 G107 Q302 | L99-S103 PolarHBondContact O-N 2.75Å; L99-S103 PolarHBondContact O-OG 3.21Å; A100-S103 PolarHBondContact O-N 3.14Å; A100-S103 PolarHBondContact O-OG 2.93Å; C101-S103 PolarHBondContact O-N 2.99Å; S103-G107 PolarHBondContact O-N 3.31Å; S103-Q302 PolarHBondContact OG-NE2 2.71Å |
| 104 | A | 96.1 | Very high | 93.8 | Very high | 52 Ų | 52 | 49.9 Ų | 49.9 | 43% | 0.43 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -70.8 | -44.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | A100 C101 Y102 G107 I108 | A100-A104 WeakPolarHBondContact O-CB 3.13Å; A100-A104 PolarHBondContact O-N 2.93Å; C101-A104 PolarHBondContact O-N 3.4Å; C101-A104 VanDerWaalsContact O-N 3.16Å; Y102-A104 VanDerWaalsContact C-N 3.27Å; Y102-A104 PolarHBondContact O-N 3.1Å; A104-G107 PolarHBondContact O-N 3.33Å; A104-I108 VanDerWaalsContact O-CG1 3.25Å; A104-I108 WeakPolarHBondContact O-CG1 3.43Å; A104-I108 PolarHBondContact O-N 2.73Å |
| 105 | F | 94.9 | Very high | 93.9 | Very high | 82 Ų | 82 | 50.8 Ų | 50.8 | 36% | 0.36 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -63.5 | -46.3 | 178.1 | -69.2 | -51.4 | 0 | 0 | 0 | 112.2 | I82 I83 T86 C101 Y102 G107 I108 L109 | I82-F105 HydrophobicContact CG2-CD2 3.86Å; I82-F105 HydrophobicContact CG2-CE2 3.54Å; I82-F105 HydrophobicContact CG2-CZ 3.96Å; I83-F105 HydrophobicContact CG1-CB 4.03Å; T86-F105 HydrophobicContact CG2-CD2 4.43Å; T86-F105 HydrophobicContact CG2-CE2 4.16Å; C101-F105 HydrophobicContact CB-CD2 4.37Å; C101-F105 HydrophobicContact CB-CE2 4.02Å; C101-F105 WeakPolarHBondContact O-CD2 3.26Å; C101-F105 WeakPolarHBondContact O-CG 3.41Å; C101-F105 PolarHBondContact O-N 3.39Å; Y102-F105 PolarHBondContact O-N 3.17Å; F105-G107 VanDerWaalsContact C-N 3.33Å; F105-I108 PolarHBondContact O-N 3.43Å; F105-L109 PolarHBondContact O-N 2.89Å |
| 106 | V | 93.7 | Very high | 93.8 | Very high | 7 Ų | 7 | 50.8 Ų | 50.8 | 4% | 0.042 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -65 | -39.4 | 175.5 | 179.5 | 0 | 0 | 0 | 0 | 110.7 | I83 Y102 I108 L109 L110 E294 I298 | I83-V106 HydrophobicContact CG2-CG2 4.03Å; Y102-V106 HydrophobicContact CD2-CG2 4.15Å; Y102-V106 HydrophobicContact CE1-CG2 4.31Å; Y102-V106 HydrophobicContact CE2-CG2 3.71Å; Y102-V106 WeakPolarHBondContact O-CG2 3.19Å; Y102-V106 PolarHBondContact O-N 2.78Å; V106-I108 VanDerWaalsContact C-N 3.33Å; V106-I108 PolarHBondContact O-N 3.31Å; V106-L109 PolarHBondContact O-N 3.1Å; V106-L110 PolarHBondContact O-N 3.47Å; V106-E294 HydrophobicContact CG1-CB 3.77Å; V106-E294 HydrophobicContact CG1-CG 4.03Å; V106-I298 HydrophobicContact CB-CD1 4.4Å; V106-I298 HydrophobicContact CB-CG1 4.06Å; V106-I298 HydrophobicContact CG1-CD1 3.95Å; V106-I298 HydrophobicContact CG1-CG1 3.8Å |
| 107 | G | 94.4 | Very high | 93.5 | Very high | 19 Ų | 19 | 52.2 Ų | 52.2 | 20% | 0.196 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -61.2 | -38.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | S103 A104 F105 L111 | S103-G107 PolarHBondContact O-N 3.31Å; A104-G107 PolarHBondContact O-N 3.33Å; F105-G107 VanDerWaalsContact C-N 3.33Å; G107-L111 WeakPolarHBondContact O-CG 3.38Å; G107-L111 PolarHBondContact O-N 2.89Å; G107-L111 VanDerWaalsContact O-N 3.13Å |
| 108 | I | 96.1 | Very high | 93.1 | Very high | 91 Ų | 91 | 53.6 Ų | 53.6 | 47% | 0.467 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -66.3 | -42.8 | 174.5 | -70 | 163.8 | 0 | 0 | 0 | 110.7 | A104 F105 V106 L111 I112 | A104-I108 VanDerWaalsContact O-CG1 3.25Å; A104-I108 WeakPolarHBondContact O-CG1 3.43Å; A104-I108 PolarHBondContact O-N 2.73Å; F105-I108 PolarHBondContact O-N 3.43Å; V106-I108 VanDerWaalsContact C-N 3.33Å; V106-I108 PolarHBondContact O-N 3.31Å; I108-L111 PolarHBondContact O-N 3.36Å; I108-I112 HydrophobicContact CG2-CD1 3.84Å; I108-I112 HydrophobicContact CG2-CG1 4.45Å; I108-I112 WeakPolarHBondContact O-CG1 3.45Å; I108-I112 PolarHBondContact O-N 3.21Å |
| 109 | L | 93.6 | Very high | 92.9 | Very high | 57 Ų | 57 | 55.9 Ų | 55.9 | 30% | 0.298 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -60.6 | -44.7 | 176 | -73.9 | -176.1 | 0 | 0 | 0 | 112.1 | V79 I83 F105 V106 L111 I112 E113 | V79-L109 HydrophobicContact CG1-CD1 4.29Å; V79-L109 HydrophobicContact CG1-CD2 4.45Å; I83-L109 HydrophobicContact CD1-CD1 3.28Å; I83-L109 HydrophobicContact CD1-CG 4.29Å; F105-L109 PolarHBondContact O-N 2.89Å; V106-L109 PolarHBondContact O-N 3.1Å; L109-L111 VanDerWaalsContact C-N 3.3Å; L109-L111 PolarHBondContact O-N 3.45Å; L109-I112 CarbonylContact O-C 3.57Å; L109-I112 WeakPolarHBondContact O-CA 3.27Å; L109-I112 WeakPolarHBondContact O-CB 3.3Å; L109-I112 PolarHBondContact O-N 3.41Å; L109-I112 VanDerWaalsContact O-N 3.08Å; L109-E113 PolarHBondContact O-N 2.94Å |
| 110 | L | 93.1 | Very high | 92.4 | Very high | 29 Ų | 29 | 56.9 Ų | 56.9 | 15% | 0.152 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -57.5 | -43.7 | 175.9 | -173.8 | 117 | 0 | 0 | 0 | 111.7 | V106 E113 L114 V291 E294 I295 | V106-L110 PolarHBondContact O-N 3.47Å; L110-E113 PolarHBondContact O-N 3Å; L110-L114 HydrophobicContact CD2-CD1 4.06Å; L110-L114 HydrophobicContact CG-CD1 4.36Å; L110-L114 WeakPolarHBondContact O-CB 3.34Å; L110-L114 VanDerWaalsContact O-CG 3.26Å; L110-L114 WeakPolarHBondContact O-CG 3.29Å; L110-L114 PolarHBondContact O-N 2.95Å; L110-V291 HydrophobicContact CD1-CG1 4.06Å; L110-E294 VanDerWaalsContact CA-OE2 3.26Å; L110-E294 WeakPolarHBondContact CA-OE2 3.35Å; L110-E294 VanDerWaalsContact CB-OE2 3.27Å; L110-E294 WeakPolarHBondContact CB-OE2 3.45Å; L110-E294 HydrophobicContact CD1-CB 3.95Å; L110-E294 WeakPolarHBondContact CD1-OE2 3.43Å; L110-I295 HydrophobicContact CD1-CD1 4.47Å; L110-I295 HydrophobicContact CD1-CG1 3.9Å |
| 111 | L | 95.1 | Very high | 91.8 | Very high | 109 Ų | 109 | 61.6 Ų | 61.6 | 57% | 0.571 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -65 | -39 | 176.1 | -69.2 | 173.9 | 0 | 0 | 0 | 112.3 | G107 I108 L109 T115 | G107-L111 WeakPolarHBondContact O-CG 3.38Å; G107-L111 PolarHBondContact O-N 2.89Å; G107-L111 VanDerWaalsContact O-N 3.13Å; I108-L111 PolarHBondContact O-N 3.36Å; L109-L111 VanDerWaalsContact C-N 3.3Å; L109-L111 PolarHBondContact O-N 3.45Å; L111-T115 VanDerWaalsContact O-CB 3.28Å; L111-T115 WeakPolarHBondContact O-CB 3.15Å; L111-T115 PolarHBondContact O-N 3.34Å; L111-T115 PolarHBondContact O-OG1 2.94Å |
| 112 | I | 94.9 | Very high | 91.5 | Very high | 101 Ų | 101 | 63.7 Ų | 63.7 | 52% | 0.518 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -64.9 | -44.9 | 175.3 | -69.4 | 167.8 | 0 | 0 | 0 | 110.2 | I108 L109 T115 A116 | I108-I112 HydrophobicContact CG2-CD1 3.84Å; I108-I112 HydrophobicContact CG2-CG1 4.45Å; I108-I112 WeakPolarHBondContact O-CG1 3.45Å; I108-I112 PolarHBondContact O-N 3.21Å; L109-I112 CarbonylContact O-C 3.57Å; L109-I112 WeakPolarHBondContact O-CA 3.27Å; L109-I112 WeakPolarHBondContact O-CB 3.3Å; L109-I112 PolarHBondContact O-N 3.41Å; L109-I112 VanDerWaalsContact O-N 3.08Å; I112-T115 PolarHBondContact O-N 3.46Å; I112-A116 WeakPolarHBondContact O-CB 3.38Å; I112-A116 PolarHBondContact O-N 3.41Å |
| 113 | E | 90.8 | Very high | 91.2 | Very high | 52 Ų | 52 | 67 Ų | 67 | 24% | 0.243 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -62 | -47.6 | 179.1 | -174.5 | 178.8 | -178.6 | 0 | 0 | 111.4 | L109 L110 T115 A116 G117 I290 | L109-E113 PolarHBondContact O-N 2.94Å; L110-E113 PolarHBondContact O-N 3Å; E113-T115 PolarHBondContact O-N 2.75Å; E113-A116 PolarHBondContact O-N 2.88Å; E113-G117 PolarHBondContact O-N 3.34Å; E113-I290 WeakPolarHBondContact OE2-CG2 3.41Å |
| 114 | L | 90.9 | Very high | 90.6 | Very high | 83 Ų | 83 | 69.9 Ų | 69.9 | 44% | 0.435 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -61.5 | -44.7 | 177.1 | -68.7 | 174.7 | 0 | 0 | 0 | 111.5 | L110 G117 I118 | L110-L114 HydrophobicContact CD2-CD1 4.06Å; L110-L114 HydrophobicContact CG-CD1 4.36Å; L110-L114 WeakPolarHBondContact O-CB 3.34Å; L110-L114 VanDerWaalsContact O-CG 3.26Å; L110-L114 WeakPolarHBondContact O-CG 3.29Å; L110-L114 PolarHBondContact O-N 2.95Å; L114-G117 PolarHBondContact O-N 3.02Å; L114-I118 WeakPolarHBondContact O-CD1 3.35Å; L114-I118 VanDerWaalsContact O-CG1 3.23Å; L114-I118 WeakPolarHBondContact O-CG1 3.39Å; L114-I118 PolarHBondContact O-N 3.16Å |
| 115 | T | 92.2 | Very high | 89.9 | Confident | 77 Ų | 77 | 72 Ų | 72 | 47% | 0.472 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -65.3 | -45.2 | 178.6 | -55.7 | 0 | 0 | 0 | 0 | 111 | L111 I112 E113 G117 I118 L119 | L111-T115 VanDerWaalsContact O-CB 3.28Å; L111-T115 WeakPolarHBondContact O-CB 3.15Å; L111-T115 PolarHBondContact O-N 3.34Å; L111-T115 PolarHBondContact O-OG1 2.94Å; I112-T115 PolarHBondContact O-N 3.46Å; E113-T115 PolarHBondContact O-N 2.75Å; T115-G117 VanDerWaalsContact C-N 3.34Å; T115-G117 PolarHBondContact O-N 2.87Å; T115-I118 PolarHBondContact O-N 3.44Å; T115-L119 HydrophobicContact CG2-CD1 3.81Å; T115-L119 HydrophobicContact CG2-CG 4.16Å; T115-L119 WeakPolarHBondContact O-CB 3.26Å; T115-L119 VanDerWaalsContact O-CG 3.26Å; T115-L119 WeakPolarHBondContact O-CG 3.39Å; T115-L119 PolarHBondContact O-N 3.26Å |
| 116 | A | 89.6 | Confident | 89.6 | Confident | 57 Ų | 57 | 75.5 Ų | 75.5 | 47% | 0.471 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -63.4 | -39.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | I112 E113 G120 | I112-A116 WeakPolarHBondContact O-CB 3.38Å; I112-A116 PolarHBondContact O-N 3.41Å; E113-A116 PolarHBondContact O-N 2.88Å; A116-G120 WeakPolarHBondContact O-CA 3.24Å; A116-G120 PolarHBondContact O-N 3Å |
| 117 | G | 84.4 | Confident | 89 | Confident | 48 Ų | 48 | 78.7 Ų | 78.7 | 50% | 0.495 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -63 | -46.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | E113 L114 T115 F121 | E113-G117 PolarHBondContact O-N 3.34Å; L114-G117 PolarHBondContact O-N 3.02Å; T115-G117 VanDerWaalsContact C-N 3.34Å; T115-G117 PolarHBondContact O-N 2.87Å; G117-F121 PolarHBondContact O-N 2.94Å; G117-F121 VanDerWaalsContact O-N 3.11Å |
| 118 | I | 88.8 | Confident | 88.2 | Confident | 109 Ų | 109 | 80.2 Ų | 80.2 | 56% | 0.559 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -64.5 | -50.9 | 177.2 | -65.7 | 163.8 | 0 | 0 | 0 | 110.7 | L114 T115 G120 F121 V122 | L114-I118 WeakPolarHBondContact O-CD1 3.35Å; L114-I118 VanDerWaalsContact O-CG1 3.23Å; L114-I118 WeakPolarHBondContact O-CG1 3.39Å; L114-I118 PolarHBondContact O-N 3.16Å; T115-I118 PolarHBondContact O-N 3.44Å; I118-G120 VanDerWaalsContact C-N 3.31Å; I118-G120 PolarHBondContact O-N 3.32Å; I118-F121 PolarHBondContact O-N 2.94Å; I118-V122 HydrophobicContact CG2-CG2 4.24Å; I118-V122 WeakPolarHBondContact O-CG2 3.37Å; I118-V122 PolarHBondContact O-N 3.02Å |
| 119 | L | 89.3 | Confident | 87.5 | Confident | 82 Ų | 82 | 77.5 Ų | 77.5 | 43% | 0.429 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -63.7 | -38.6 | 179.6 | -68.4 | 179.4 | 0 | 0 | 0 | 111.7 | T115 F121 V122 F123 | T115-L119 HydrophobicContact CG2-CD1 3.81Å; T115-L119 HydrophobicContact CG2-CG 4.16Å; T115-L119 WeakPolarHBondContact O-CB 3.26Å; T115-L119 VanDerWaalsContact O-CG 3.26Å; T115-L119 WeakPolarHBondContact O-CG 3.39Å; T115-L119 PolarHBondContact O-N 3.26Å; L119-F121 VanDerWaalsContact C-N 3.27Å; L119-F121 PolarHBondContact O-N 3.22Å; L119-V122 PolarHBondContact O-N 2.88Å; L119-F123 HydrophobicContact CB-CD2 4.43Å; L119-F123 HydrophobicContact CD2-CD2 3.69Å; L119-F123 HydrophobicContact CD2-CE2 3.58Å; L119-F123 WeakPolarHBondContact O-CB 3.5Å; L119-F123 PolarHBondContact O-N 3.41Å |
| 120 | G | 83.6 | Confident | 87.1 | Confident | 27 Ų | 27 | 78 Ų | 78 | 28% | 0.278 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -56.1 | -41.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | A116 I118 K124 | A116-G120 WeakPolarHBondContact O-CA 3.24Å; A116-G120 PolarHBondContact O-N 3Å; I118-G120 VanDerWaalsContact C-N 3.31Å; I118-G120 PolarHBondContact O-N 3.32Å; G120-K124 WeakPolarHBondContact O-CA 3.07Å; G120-K124 WeakPolarHBondContact O-CB 3.49Å |
| 121 | F | 81.8 | Confident | 86.7 | Confident | 118 Ų | 118 | 81.3 Ų | 81.3 | 52% | 0.518 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -77.2 | -46.3 | 178.4 | -175 | -100 | 0 | 0 | 0 | 112.8 | G117 I118 L119 F280 | G117-F121 PolarHBondContact O-N 2.94Å; G117-F121 VanDerWaalsContact O-N 3.11Å; I118-F121 PolarHBondContact O-N 2.94Å; L119-F121 VanDerWaalsContact C-N 3.27Å; L119-F121 PolarHBondContact O-N 3.22Å; F121-F280 AromaticContact CD2-CE2 3.96Å; F121-F280 HydrophobicContact CD2-CE2 3.96Å; F121-F280 HydrophobicContact CE2-CE2 4.03Å |
| 122 | V | 89.3 | Confident | 86 | Confident | 90 Ų | 90 | 79.5 Ų | 79.5 | 55% | 0.545 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -71.3 | -42.8 | -175.4 | 174.2 | 0 | 0 | 0 | 0 | 111.9 | I118 L119 | I118-V122 HydrophobicContact CG2-CG2 4.24Å; I118-V122 WeakPolarHBondContact O-CG2 3.37Å; I118-V122 PolarHBondContact O-N 3.02Å; L119-V122 PolarHBondContact O-N 2.88Å |
| 123 | F | 89.3 | Confident | 85.5 | Confident | 104 Ų | 104 | 77.3 Ų | 77.3 | 46% | 0.456 | 42% | 0.421 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -105.7 | 29.2 | -174.1 | -62.4 | -73.7 | 0 | 0 | 0 | 112.8 | L119 D125 W126 L127 | L119-F123 HydrophobicContact CB-CD2 4.43Å; L119-F123 HydrophobicContact CD2-CD2 3.69Å; L119-F123 HydrophobicContact CD2-CE2 3.58Å; L119-F123 WeakPolarHBondContact O-CB 3.5Å; L119-F123 PolarHBondContact O-N 3.41Å; F123-D125 VanDerWaalsContact C-N 3.3Å; F123-D125 PolarHBondContact O-N 2.82Å; F123-W126 HydrophobicContact CB-CB 4.4Å; F123-W126 PolarHBondContact O-N 3.29Å; F123-W126 VanDerWaalsContact O-N 3.09Å; F123-L127 WeakPolarHBondContact O-CB 3.42Å; F123-L127 WeakPolarHBondContact O-CG 3.25Å; F123-L127 PolarHBondContact O-N 2.74Å |
| 124 | K | 80.7 | Confident | 85.3 | Confident | 73 Ų | 73 | 80 Ų | 80 | 32% | 0.317 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -53.3 | -42.3 | -175 | 75.1 | -167.4 | -165.7 | 171.8 | 0 | 113.7 | G120 K128 L273 | G120-K124 WeakPolarHBondContact O-CA 3.07Å; G120-K124 WeakPolarHBondContact O-CB 3.49Å; K124-K128 VanDerWaalsContact O-CB 3.27Å; K124-K128 WeakPolarHBondContact O-CB 3.41Å; K124-K128 PolarHBondContact O-N 3.32Å; K124-L273 HydrophobicContact CB-CD2 3.62Å; K124-L273 HydrophobicContact CD-CD2 3.35Å; K124-L273 HydrophobicContact CG-CD2 3.42Å; K124-L273 VanDerWaalsContact CG-CD2 3.42Å |
| 125 | D | 81.6 | Confident | 85.2 | Confident | 96 Ų | 96 | 77.4 Ų | 77.4 | 51% | 0.513 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -74.7 | -31.8 | -178.7 | -62.1 | -53.7 | 0 | 0 | 0 | 112.4 | F123 K128 G129 | F123-D125 VanDerWaalsContact C-N 3.3Å; F123-D125 PolarHBondContact O-N 2.82Å; D125-K128 WeakPolarHBondContact O-CB 3.27Å; D125-G129 PolarHBondContact O-N 2.95Å |
| 126 | W | 87.9 | Confident | 85.2 | Confident | 157 Ų | 157 | 76 Ų | 76 | 60% | 0.595 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -72.4 | -44.6 | 173.7 | 179.8 | 84.7 | 0 | 0 | 0 | 111.1 | F123 K128 G129 Q130 | F123-W126 HydrophobicContact CB-CB 4.4Å; F123-W126 PolarHBondContact O-N 3.29Å; F123-W126 VanDerWaalsContact O-N 3.09Å; W126-K128 VanDerWaalsContact C-N 3.25Å; W126-K128 PolarHBondContact O-N 3.16Å; W126-G129 PolarHBondContact O-N 3.28Å; W126-Q130 HydrophobicContact CD2-CG 3.89Å; W126-Q130 HydrophobicContact CE3-CG 3.97Å; W126-Q130 HydrophobicContact CH2-CG 3.7Å; W126-Q130 HydrophobicContact CZ2-CG 3.58Å; W126-Q130 HydrophobicContact CZ3-CG 3.88Å; W126-Q130 WeakPolarHBondContact O-CG 3.26Å; W126-Q130 PolarHBondContact O-N 2.9Å |
| 127 | L | 82.4 | Confident | 85.2 | Confident | 74 Ų | 74 | 74.3 Ų | 74.3 | 39% | 0.387 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -58.9 | -38.5 | 175.5 | -77.8 | 169.8 | 0 | 0 | 0 | 112 | F123 Q130 L131 | F123-L127 WeakPolarHBondContact O-CB 3.42Å; F123-L127 WeakPolarHBondContact O-CG 3.25Å; F123-L127 PolarHBondContact O-N 2.74Å; L127-Q130 PolarHBondContact O-N 3.41Å; L127-L131 VanDerWaalsContact O-CB 3.27Å; L127-L131 WeakPolarHBondContact O-CB 3.49Å; L127-L131 PolarHBondContact O-N 2.97Å |
| 128 | K | 76.7 | Confident | 85.5 | Confident | 51 Ų | 51 | 74.3 Ų | 74.3 | 22% | 0.222 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -56.1 | -52.5 | 173.4 | 175.4 | -174.9 | 157.2 | 147.8 | 0 | 112.2 | K124 D125 W126 L131 E132 L269 L273 | K124-K128 VanDerWaalsContact O-CB 3.27Å; K124-K128 WeakPolarHBondContact O-CB 3.41Å; K124-K128 PolarHBondContact O-N 3.32Å; D125-K128 WeakPolarHBondContact O-CB 3.27Å; W126-K128 VanDerWaalsContact C-N 3.25Å; W126-K128 PolarHBondContact O-N 3.16Å; K128-L131 PolarHBondContact O-N 3.48Å; K128-E132 PolarHBondContact O-N 2.91Å; K128-L269 HydrophobicContact CD-CB 4.49Å; K128-L269 HydrophobicContact CD-CD1 4.28Å; K128-L269 HydrophobicContact CD-CD2 3.66Å; K128-L269 HydrophobicContact CD-CG 3.45Å; K128-L269 VanDerWaalsContact CD-CG 3.45Å; K128-L269 HydrophobicContact CG-CD1 3.89Å; K128-L269 HydrophobicContact CG-CD2 3.28Å; K128-L269 HydrophobicContact CG-CG 3.43Å; K128-L269 VanDerWaalsContact CG-CG 3.43Å; K128-L273 HydrophobicContact CD-CD1 4.04Å |
| 129 | G | 82 | Confident | 85.8 | Confident | 33 Ų | 33 | 69.2 Ų | 69.2 | 34% | 0.34 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -66.7 | -35.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | D125 W126 S133 | D125-G129 PolarHBondContact O-N 2.95Å; W126-G129 PolarHBondContact O-N 3.28Å; G129-S133 PolarHBondContact O-N 3.31Å; G129-S133 VanDerWaalsContact O-N 3.11Å |
| 130 | Q | 85.7 | Confident | 86 | Confident | 68 Ų | 68 | 68 Ų | 68 | 32% | 0.318 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -63.4 | -45.2 | 172 | -69.2 | -58.9 | -59.8 | 0 | 0 | 111.3 | W126 L127 S133 R134 | W126-Q130 HydrophobicContact CD2-CG 3.89Å; W126-Q130 HydrophobicContact CE3-CG 3.97Å; W126-Q130 HydrophobicContact CH2-CG 3.7Å; W126-Q130 HydrophobicContact CZ2-CG 3.58Å; W126-Q130 HydrophobicContact CZ3-CG 3.88Å; W126-Q130 WeakPolarHBondContact O-CG 3.26Å; W126-Q130 PolarHBondContact O-N 2.9Å; L127-Q130 PolarHBondContact O-N 3.41Å; Q130-S133 PolarHBondContact O-N 3.32Å; Q130-R134 VanDerWaalsContact O-CG 3.27Å; Q130-R134 WeakPolarHBondContact O-CG 3.42Å; Q130-R134 PolarHBondContact O-N 2.94Å |
| 131 | L | 82.9 | Confident | 86.4 | Confident | 99 Ų | 99 | 69.8 Ų | 69.8 | 52% | 0.518 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -63.3 | -44.8 | -179.6 | -176.5 | 61.7 | 0 | 0 | 0 | 111.3 | L127 K128 S133 R134 L135 | L127-L131 VanDerWaalsContact O-CB 3.27Å; L127-L131 WeakPolarHBondContact O-CB 3.49Å; L127-L131 PolarHBondContact O-N 2.97Å; K128-L131 PolarHBondContact O-N 3.48Å; L131-S133 PolarHBondContact O-N 2.82Å; L131-R134 PolarHBondContact O-N 2.89Å; L131-L135 HydrophobicContact CD1-CG 4.39Å; L131-L135 HydrophobicContact CG-CD1 4.13Å; L131-L135 HydrophobicContact CG-CG 4.41Å; L131-L135 WeakPolarHBondContact O-CB 3.42Å; L131-L135 VanDerWaalsContact O-CG 3.23Å; L131-L135 WeakPolarHBondContact O-CG 3.19Å; L131-L135 PolarHBondContact O-N 2.79Å |
| 132 | E | 81.3 | Confident | 86.9 | Confident | 70 Ų | 70 | 64.2 Ų | 64.2 | 33% | 0.327 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -56.7 | -49.1 | 174.3 | -73.5 | -178.1 | 149.1 | 0 | 0 | 111.3 | K128 R134 L135 D136 L269 | K128-E132 PolarHBondContact O-N 2.91Å; E132-R134 VanDerWaalsContact C-N 3.3Å; E132-R134 PolarHBondContact O-N 2.67Å; E132-L135 WeakPolarHBondContact O-CB 3.33Å; E132-L135 PolarHBondContact O-N 3.45Å; E132-L135 VanDerWaalsContact O-N 3.1Å; E132-D136 PolarHBondContact O-N 2.86Å; E132-L269 VanDerWaalsContact CD-CD2 3.46Å; E132-L269 HydrophobicContact CG-CD2 4.02Å; E132-L269 WeakPolarHBondContact OE1-CD2 3.25Å |
| 133 | S | 85 | Confident | 87 | Confident | 56 Ų | 56 | 64 Ų | 64 | 39% | 0.392 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -61 | -35.7 | 176.7 | 176.7 | 0 | 0 | 0 | 0 | 113.2 | G129 Q130 L131 D136 D137 | G129-S133 PolarHBondContact O-N 3.31Å; G129-S133 VanDerWaalsContact O-N 3.11Å; Q130-S133 PolarHBondContact O-N 3.32Å; L131-S133 PolarHBondContact O-N 2.82Å; S133-D136 PolarHBondContact O-N 3.49Å; S133-D137 PolarHBondContact O-N 2.88Å |
| 134 | R | 86 | Confident | 86.9 | Confident | 108 Ų | 108 | 61.8 Ų | 61.8 | 41% | 0.408 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -74.6 | -27.4 | 176 | -65.2 | -54.1 | 174.7 | -164.8 | -2.9 | 113.1 | Y66 Q130 L131 E132 D137 | Y66-R134 PolarHBondContact OH-NH1 2.87Å; Q130-R134 VanDerWaalsContact O-CG 3.27Å; Q130-R134 WeakPolarHBondContact O-CG 3.42Å; Q130-R134 PolarHBondContact O-N 2.94Å; L131-R134 PolarHBondContact O-N 2.89Å; E132-R134 VanDerWaalsContact C-N 3.3Å; E132-R134 PolarHBondContact O-N 2.67Å; R134-D137 IonicContact NH1-OD2 2.76Å; R134-D137 PolarHBondContact NH1-OD2 2.98Å; R134-D137 WeakPolarHBondContact O-CB 3.15Å |
| 135 | L | 89.2 | Confident | 87 | Confident | 28 Ų | 28 | 58.9 Ų | 58.9 | 15% | 0.147 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -72.1 | -36.8 | 172.7 | -71.2 | 171.6 | 0 | 0 | 0 | 110.7 | L131 E132 D137 M138 I165 L230 | L131-L135 HydrophobicContact CD1-CG 4.39Å; L131-L135 HydrophobicContact CG-CD1 4.13Å; L131-L135 HydrophobicContact CG-CG 4.41Å; L131-L135 WeakPolarHBondContact O-CB 3.42Å; L131-L135 VanDerWaalsContact O-CG 3.23Å; L131-L135 WeakPolarHBondContact O-CG 3.19Å; L131-L135 PolarHBondContact O-N 2.79Å; E132-L135 WeakPolarHBondContact O-CB 3.33Å; E132-L135 PolarHBondContact O-N 3.45Å; E132-L135 VanDerWaalsContact O-N 3.1Å; L135-D137 VanDerWaalsContact C-N 3.31Å; L135-D137 PolarHBondContact O-N 2.96Å; L135-M138 HydrophobicContact CD2-CE 4.06Å; L135-M138 HydrophobicContact CD2-SD 3.92Å; L135-M138 VanDerWaalsContact O-CB 3.26Å; L135-M138 WeakPolarHBondContact O-CB 3.44Å; L135-M138 PolarHBondContact O-N 3.47Å; L135-M138 VanDerWaalsContact O-N 3.11Å; L135-I165 HydrophobicContact CB-CD1 3.98Å; L135-I165 HydrophobicContact CB-CG1 4.15Å; L135-I165 HydrophobicContact CB-CG2 3.95Å; L135-I165 HydrophobicContact CD1-CG2 4.11Å; L135-L230 HydrophobicContact CD1-CD1 3.9Å; L135-L230 HydrophobicContact CD1-CD2 4.45Å |
| 136 | D | 91.3 | Very high | 87.3 | Confident | 48 Ų | 48 | 58 Ų | 58 | 26% | 0.257 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -62 | -38.8 | 173.6 | -68.3 | -19.1 | 0 | 0 | 0 | 111.7 | E132 S133 M138 I139 I140 L173 | E132-D136 PolarHBondContact O-N 2.86Å; S133-D136 PolarHBondContact O-N 3.49Å; D136-M138 PolarHBondContact O-N 3.27Å; D136-M138 VanDerWaalsContact O-N 3.16Å; D136-I139 PolarHBondContact O-N 2.95Å; D136-I140 WeakPolarHBondContact O-CG1 3.43Å; D136-I140 PolarHBondContact O-N 3.26Å; D136-L173 HydrophobicContact CB-CD1 4.13Å |
| 137 | D | 90.9 | Very high | 87.2 | Confident | 22 Ų | 22 | 52.8 Ų | 52.8 | 12% | 0.118 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -54.5 | -33.7 | 174.5 | -73 | -34.3 | 0 | 0 | 0 | 111.8 | Y66 L67 S133 R134 L135 I139 I140 Y141 | Y66-D137 HydrophobicContact CE2-CB 4.45Å; Y66-D137 PolarHBondContact OH-OD2 3.38Å; L67-D137 HydrophobicContact CD1-CB 4.36Å; L67-D137 HydrophobicContact CD2-CB 4.1Å; S133-D137 PolarHBondContact O-N 2.88Å; R134-D137 IonicContact NH1-OD2 2.76Å; R134-D137 PolarHBondContact NH1-OD2 2.98Å; R134-D137 WeakPolarHBondContact O-CB 3.15Å; L135-D137 VanDerWaalsContact C-N 3.31Å; L135-D137 PolarHBondContact O-N 2.96Å; D137-I139 VanDerWaalsContact C-N 3.34Å; D137-I139 PolarHBondContact O-N 2.81Å; D137-I140 PolarHBondContact O-N 3.5Å; D137-Y141 HydrophobicContact CB-CD2 4.2Å; D137-Y141 HydrophobicContact CB-CE2 4.3Å; D137-Y141 WeakPolarHBondContact O-CB 3.29Å; D137-Y141 WeakPolarHBondContact O-CD2 3.4Å; D137-Y141 PolarHBondContact O-N 3.03Å |
| 138 | M | 90.6 | Very high | 87.5 | Confident | 47 Ų | 47 | 49.4 Ų | 49.4 | 23% | 0.232 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -64.2 | -38.2 | 177.4 | -59.7 | -175.5 | 177.3 | 0 | 0 | 112.1 | L67 L135 D136 Y142 L148 I152 | L67-M138 HydrophobicContact CD2-CG 3.96Å; L135-M138 HydrophobicContact CD2-CE 4.06Å; L135-M138 HydrophobicContact CD2-SD 3.92Å; L135-M138 VanDerWaalsContact O-CB 3.26Å; L135-M138 WeakPolarHBondContact O-CB 3.44Å; L135-M138 PolarHBondContact O-N 3.47Å; L135-M138 VanDerWaalsContact O-N 3.11Å; D136-M138 PolarHBondContact O-N 3.27Å; D136-M138 VanDerWaalsContact O-N 3.16Å; M138-Y142 PolarHBondContact O-N 3.47Å; M138-L148 HydrophobicContact CB-CD1 4.32Å; M138-L148 HydrophobicContact CG-CD1 4.37Å; M138-I152 HydrophobicContact CB-CD1 3.98Å; M138-I152 WeakPolarHBondContact O-CD1 3.5Å |
| 139 | I | 94.3 | Very high | 88.2 | Confident | 2 Ų | 2 | 48.8 Ų | 48.8 | 1% | 0.01 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -75.6 | -44.2 | 176.9 | -60.2 | -61.4 | 0 | 0 | 0 | 110.5 | D136 D137 Y141 Y142 I165 D170 W171 L173 N174 | D136-I139 PolarHBondContact O-N 2.95Å; D137-I139 VanDerWaalsContact C-N 3.34Å; D137-I139 PolarHBondContact O-N 2.81Å; I139-Y141 VanDerWaalsContact C-N 3.28Å; I139-Y141 PolarHBondContact O-N 2.81Å; I139-Y142 WeakPolarHBondContact O-CB 3.39Å; I139-Y142 PolarHBondContact O-N 2.95Å; I139-I165 HydrophobicContact CD1-CD1 4.33Å; I139-I165 HydrophobicContact CD1-CG1 4.42Å; I139-I165 HydrophobicContact CG1-CD1 4.09Å; I139-I165 HydrophobicContact CG1-CG1 3.8Å; I139-D170 WeakPolarHBondContact CG2-O 3.42Å; I139-W171 HydrophobicContact CD1-CH2 3.83Å; I139-W171 HydrophobicContact CD1-CZ2 3.89Å; I139-W171 HydrophobicContact CD1-CZ3 4.19Å; I139-W171 HydrophobicContact CG2-CD2 4.29Å; I139-W171 HydrophobicContact CG2-CE3 3.8Å; I139-W171 HydrophobicContact CG2-CZ3 4.02Å; I139-L173 HydrophobicContact CG2-CB 4.3Å; I139-N174 HydrophobicContact CG2-CB 4.2Å; I139-N174 WeakPolarHBondContact O-CB 3.13Å; I139-N174 PolarHBondContact O-ND2 2.89Å |
| 140 | I | 94 | Very high | 88.7 | Confident | 56 Ų | 56 | 51 Ų | 51 | 29% | 0.287 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -56.7 | -44.5 | 180 | -66.6 | 167 | 0 | 0 | 0 | 110.5 | D136 D137 L173 N174 | D136-I140 WeakPolarHBondContact O-CG1 3.43Å; D136-I140 PolarHBondContact O-N 3.26Å; D137-I140 PolarHBondContact O-N 3.5Å; I140-L173 HydrophobicContact CG1-CB 4.03Å; I140-N174 PolarHBondContact O-ND2 2.89Å; I140-N174 VanDerWaalsContact O-ND2 3.14Å |
| 141 | Y | 91.8 | Very high | 89 | Confident | 66 Ų | 66 | 51.4 Ų | 51.4 | 26% | 0.259 | 26% | 0.261 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.2 | 13.2 | -175.4 | -60.2 | -56.3 | 0 | 0 | 0 | 114.7 | K64 L67 D137 I139 R143 D144 | K64-Y141 HydrophobicContact CD-CD1 4.45Å; K64-Y141 HydrophobicContact CD-CD2 4.42Å; K64-Y141 HydrophobicContact CD-CE1 4.42Å; K64-Y141 HydrophobicContact CD-CE2 4.4Å; K64-Y141 HydrophobicContact CD-CG 4.42Å; L67-Y141 HydrophobicContact CD1-CD2 3.41Å; L67-Y141 VanDerWaalsContact CD1-CD2 3.41Å; L67-Y141 HydrophobicContact CD1-CE2 4.16Å; L67-Y141 HydrophobicContact CD1-CG 4.13Å; D137-Y141 HydrophobicContact CB-CD2 4.2Å; D137-Y141 HydrophobicContact CB-CE2 4.3Å; D137-Y141 WeakPolarHBondContact O-CB 3.29Å; D137-Y141 WeakPolarHBondContact O-CD2 3.4Å; D137-Y141 PolarHBondContact O-N 3.03Å; I139-Y141 VanDerWaalsContact C-N 3.28Å; I139-Y141 PolarHBondContact O-N 2.81Å; Y141-R143 PolarHBondContact O-N 3.41Å; Y141-D144 WeakPolarHBondContact CD1-OD2 3.4Å; Y141-D144 WeakPolarHBondContact O-CB 3.21Å; Y141-D144 PolarHBondContact O-N 3.43Å |
| 142 | Y | 92.8 | Very high | 89.5 | Confident | 0 Ų | 0 | 47.1 Ų | 47.1 | 0% | 0 | 24% | 0.239 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -49.4 | -34.2 | -177.3 | 171.4 | -99.9 | 0 | 0 | 0 | 114.6 | M138 I139 Q149 I152 D153 W171 F177 P193 | M138-Y142 PolarHBondContact O-N 3.47Å; I139-Y142 WeakPolarHBondContact O-CB 3.39Å; I139-Y142 PolarHBondContact O-N 2.95Å; Y142-Q149 HydrophobicContact CD1-CG 4.3Å; Y142-Q149 HydrophobicContact CD2-CG 3.99Å; Y142-Q149 HydrophobicContact CE1-CG 3.77Å; Y142-Q149 HydrophobicContact CE2-CB 4.31Å; Y142-Q149 HydrophobicContact CE2-CG 3.43Å; Y142-Q149 VanDerWaalsContact CE2-CG 3.43Å; Y142-Q149 HydrophobicContact CG-CG 4.39Å; Y142-Q149 WeakPolarHBondContact O-CB 3.37Å; Y142-Q149 WeakPolarHBondContact O-CG 3.31Å; Y142-Q149 WeakPolarHBondContact OH-CG 3.48Å; Y142-Q149 PolarHBondContact OH-NE2 3.29Å; Y142-Q149 VanDerWaalsContact OH-NE2 3.1Å; Y142-I152 HydrophobicContact CD2-CB 4.02Å; Y142-I152 HydrophobicContact CD2-CD1 3.77Å; Y142-I152 HydrophobicContact CD2-CG2 3.9Å; Y142-I152 HydrophobicContact CE2-CB 4.1Å; Y142-I152 HydrophobicContact CE2-CG2 3.94Å; Y142-D153 WeakPolarHBondContact CE2-OD1 3.34Å; Y142-D153 VanDerWaalsContact OH-CG 3.27Å; Y142-D153 PolarHBondContact OH-OD1 2.9Å; Y142-D153 PolarHBondContact OH-OD2 3.44Å; Y142-W171 HydrophobicContact CD1-CH2 4.15Å; Y142-W171 AromaticContact CD1-CZ3 3.86Å; Y142-W171 HydrophobicContact CD1-CZ3 3.86Å; Y142-W171 AromaticContact CD2-CH2 3.68Å; Y142-W171 HydrophobicContact CD2-CH2 3.68Å; Y142-W171 HydrophobicContact CD2-CZ3 4.12Å; Y142-W171 HydrophobicContact CE1-CH2 4.44Å; Y142-W171 HydrophobicContact CE1-CZ3 4.42Å; Y142-W171 AromaticContact CE2-CH2 4Å; Y142-W171 HydrophobicContact CE2-CH2 4Å; Y142-W171 AromaticContact CG-CH2 3.77Å; Y142-W171 HydrophobicContact CG-CH2 3.77Å; Y142-W171 AromaticContact CG-CZ3 3.7Å; Y142-W171 HydrophobicContact CG-CZ3 3.7Å; Y142-F177 AromaticContact CD1-CE2 3.82Å; Y142-F177 HydrophobicContact CD1-CE2 3.82Å; Y142-F177 HydrophobicContact CD1-CZ 4.49Å; Y142-F177 AromaticContact CE1-CE2 3.91Å; Y142-F177 HydrophobicContact CE1-CE2 3.91Å; Y142-F177 HydrophobicContact CE1-CZ 4.13Å; Y142-P193 HydrophobicContact CD1-CG 4.49Å; Y142-P193 HydrophobicContact CE1-CB 4.12Å; Y142-P193 HydrophobicContact CE1-CG 3.85Å; Y142-P193 HydrophobicContact CE2-CG 4.33Å; Y142-P193 WeakPolarHBondContact OH-CB 2.8Å |
| 143 | R | 91.2 | Very high | 90.1 | Very high | 85 Ų | 85 | 44.6 Ų | 44.6 | 32% | 0.321 | 23% | 0.228 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -95.8 | -7.9 | 178.7 | -69.7 | -61.2 | -170.5 | 164.9 | -4.4 | 114.8 | Y141 Q149 Y176 E188 | Y141-R143 PolarHBondContact O-N 3.41Å; R143-Q149 VanDerWaalsContact NH1-NE2 3.11Å; R143-Y176 HydrophobicContact CB-CD2 3.67Å; R143-Y176 HydrophobicContact CB-CE2 3.43Å; R143-Y176 VanDerWaalsContact CB-CE2 3.43Å; R143-Y176 HydrophobicContact CG-CD2 3.47Å; R143-Y176 VanDerWaalsContact CG-CD2 3.47Å; R143-Y176 HydrophobicContact CG-CE2 3.77Å; R143-Y176 HydrophobicContact CG-CG 4.09Å; R143-E188 IonicContact CZ-OE1 3.64Å; R143-E188 IonicContact CZ-OE2 3.4Å; R143-E188 IonicContact NE-OE2 3.61Å; R143-E188 IonicContact NH2-OE1 3.01Å; R143-E188 PolarHBondContact NH2-OE1 3.34Å; R143-E188 IonicContact NH2-OE2 2.92Å; R143-E188 PolarHBondContact NH2-OE2 2.98Å |
| 144 | D | 87.3 | Confident | 90.5 | Very high | 59 Ų | 59 | 47.5 Ų | 47.5 | 32% | 0.316 | 23% | 0.23 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -78 | -25.9 | -177.3 | -76 | 22.5 | 0 | 0 | 0 | 112.1 | R61 K64 Y141 | R61-D144 PolarHBondContact NH1-O 3.08Å; R61-D144 PolarHBondContact NH2-O 2.98Å; K64-D144 IonicContact NZ-OD2 2.72Å; K64-D144 PolarHBondContact NZ-OD2 2.96Å; Y141-D144 WeakPolarHBondContact CD1-OD2 3.4Å; Y141-D144 WeakPolarHBondContact O-CB 3.21Å; Y141-D144 PolarHBondContact O-N 3.43Å |
| 145 | D | 82.6 | Confident | 90.9 | Very high | 11 Ų | 11 | 43.6 Ų | 43.6 | 6% | 0.059 | 22% | 0.217 | C | C | . | . | trans | -136.9 | 118.3 | -174 | -163.4 | -61.3 | 0 | 0 | 0 | 111.2 | R61 D147 L148 Q149 | R61-D145 IonicContact CZ-OD2 3.23Å; R61-D145 IonicContact NH1-OD2 3.68Å; R61-D145 PolarHBondContact NH1-OD2 3.13Å; D145-D147 PolarHBondContact O-N 2.82Å; D145-D147 WeakPolarHBondContact OD1-CB 3.3Å; D145-D147 PolarHBondContact OD1-N 3.46Å; D145-L148 HydrophobicContact CB-CB 3.86Å; D145-L148 PolarHBondContact O-N 2.81Å; D145-L148 PolarHBondContact OD1-N 3.28Å; D145-Q149 WeakPolarHBondContact O-CB 3.28Å; D145-Q149 PolarHBondContact O-N 3.36Å | ||
| 146 | P | 87.3 | Confident | 91.2 | Very high | 77 Ų | 77 | 42.4 Ų | 42.4 | 50% | 0.5 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -64.3 | -25 | -177.2 | 26.1 | -34 | 0 | 0 | 0 | 113.4 | S150 | P146-S150 WeakPolarHBondContact O-CB 3.46Å; P146-S150 PolarHBondContact O-N 3.37Å; P146-S150 PolarHBondContact O-OG 2.83Å |
| 147 | D | 85.1 | Confident | 91.3 | Very high | 49 Ų | 49 | 41.7 Ų | 41.7 | 26% | 0.262 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -81.8 | -38.4 | 178.5 | -57.3 | -104.4 | 0 | 0 | 0 | 111.7 | K52 P69 D145 Q149 S150 F151 | K52-D147 WeakPolarHBondContact CD-OD2 3.26Å; K52-D147 VanDerWaalsContact CE-OD1 3.3Å; K52-D147 WeakPolarHBondContact CE-OD1 3.49Å; K52-D147 WeakPolarHBondContact CE-OD2 3.35Å; K52-D147 IonicContact NZ-OD1 3.51Å; K52-D147 PolarHBondContact NZ-OD1 2.98Å; K52-D147 VanDerWaalsContact NZ-OD1 3.08Å; K52-D147 IonicContact NZ-OD2 2.82Å; K52-D147 PolarHBondContact NZ-OD2 3.38Å; P69-D147 HydrophobicContact CG-CB 3.93Å; D145-D147 PolarHBondContact O-N 2.82Å; D145-D147 WeakPolarHBondContact OD1-CB 3.3Å; D145-D147 PolarHBondContact OD1-N 3.46Å; D147-Q149 VanDerWaalsContact C-N 3.27Å; D147-Q149 PolarHBondContact O-N 2.99Å; D147-S150 PolarHBondContact O-N 2.97Å; D147-F151 WeakPolarHBondContact O-CB 3.47Å; D147-F151 PolarHBondContact O-N 3.2Å |
| 148 | L | 89.3 | Confident | 91.3 | Very high | 2 Ų | 2 | 45.3 Ų | 45.3 | 1% | 0.01 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -58.9 | -45 | 168 | 179.8 | 62 | 0 | 0 | 0 | 109.9 | L67 M138 D145 S150 F151 I152 | L67-L148 HydrophobicContact CB-CD2 4.32Å; M138-L148 HydrophobicContact CB-CD1 4.32Å; M138-L148 HydrophobicContact CG-CD1 4.37Å; D145-L148 HydrophobicContact CB-CB 3.86Å; D145-L148 PolarHBondContact O-N 2.81Å; D145-L148 PolarHBondContact OD1-N 3.28Å; L148-S150 PolarHBondContact O-N 3.4Å; L148-F151 PolarHBondContact O-N 2.92Å; L148-I152 HydrophobicContact CD1-CD1 3.69Å; L148-I152 HydrophobicContact CD1-CG1 4.11Å; L148-I152 HydrophobicContact CD2-CD1 4.43Å; L148-I152 HydrophobicContact CG-CD1 3.71Å; L148-I152 HydrophobicContact CG-CG1 4.47Å; L148-I152 WeakPolarHBondContact O-CB 3.47Å; L148-I152 VanDerWaalsContact O-CG1 3.32Å; L148-I152 WeakPolarHBondContact O-CG1 3.42Å; L148-I152 PolarHBondContact O-N 2.71Å |
| 149 | Q | 92.6 | Very high | 91.4 | Very high | 39 Ų | 39 | 47.7 Ų | 47.7 | 18% | 0.182 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -56.9 | -52 | 177 | -159.9 | -177.1 | -1.7 | 0 | 0 | 111.2 | Y142 R143 D145 D147 F151 I152 D153 | Y142-Q149 HydrophobicContact CD1-CG 4.3Å; Y142-Q149 HydrophobicContact CD2-CG 3.99Å; Y142-Q149 HydrophobicContact CE1-CG 3.77Å; Y142-Q149 HydrophobicContact CE2-CB 4.31Å; Y142-Q149 HydrophobicContact CE2-CG 3.43Å; Y142-Q149 VanDerWaalsContact CE2-CG 3.43Å; Y142-Q149 HydrophobicContact CG-CG 4.39Å; Y142-Q149 WeakPolarHBondContact O-CB 3.37Å; Y142-Q149 WeakPolarHBondContact O-CG 3.31Å; Y142-Q149 WeakPolarHBondContact OH-CG 3.48Å; Y142-Q149 PolarHBondContact OH-NE2 3.29Å; Y142-Q149 VanDerWaalsContact OH-NE2 3.1Å; R143-Q149 VanDerWaalsContact NH1-NE2 3.11Å; D145-Q149 WeakPolarHBondContact O-CB 3.28Å; D145-Q149 PolarHBondContact O-N 3.36Å; D147-Q149 VanDerWaalsContact C-N 3.27Å; D147-Q149 PolarHBondContact O-N 2.99Å; Q149-F151 VanDerWaalsContact C-N 3.32Å; Q149-F151 PolarHBondContact O-N 3.02Å; Q149-I152 PolarHBondContact O-N 3.22Å; Q149-D153 WeakPolarHBondContact O-CB 3.33Å; Q149-D153 PolarHBondContact O-N 3.42Å |
| 150 | S | 91.8 | Very high | 91.4 | Very high | 78 Ų | 78 | 48.2 Ų | 48.2 | 55% | 0.545 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -62.5 | -38.6 | -180 | -60.4 | 0 | 0 | 0 | 0 | 112.3 | P146 D147 L148 W154 | P146-S150 WeakPolarHBondContact O-CB 3.46Å; P146-S150 PolarHBondContact O-N 3.37Å; P146-S150 PolarHBondContact O-OG 2.83Å; D147-S150 PolarHBondContact O-N 2.97Å; L148-S150 PolarHBondContact O-N 3.4Å; S150-W154 WeakPolarHBondContact O-CB 3.28Å; S150-W154 PolarHBondContact O-N 2.77Å |
| 151 | F | 91.3 | Very high | 91.4 | Very high | 77 Ų | 77 | 50.3 Ų | 50.3 | 34% | 0.338 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -66.9 | -47.1 | 177.9 | 178.9 | -117.3 | 0 | 0 | 0 | 111.9 | D147 L148 Q149 D153 W154 I155 | D147-F151 WeakPolarHBondContact O-CB 3.47Å; D147-F151 PolarHBondContact O-N 3.2Å; L148-F151 PolarHBondContact O-N 2.92Å; Q149-F151 VanDerWaalsContact C-N 3.32Å; Q149-F151 PolarHBondContact O-N 3.02Å; F151-D153 VanDerWaalsContact C-N 3.33Å; F151-W154 HydrophobicContact CD2-CE3 4.25Å; F151-W154 HydrophobicContact CE2-CE3 4.26Å; F151-W154 HydrophobicContact CE2-CZ3 4.21Å; F151-W154 PolarHBondContact O-N 3.17Å; F151-I155 HydrophobicContact CD1-CD1 3.85Å; F151-I155 HydrophobicContact CD2-CD1 4.33Å; F151-I155 HydrophobicContact CE1-CD1 3.43Å; F151-I155 VanDerWaalsContact CE1-CD1 3.43Å; F151-I155 HydrophobicContact CE2-CD1 3.96Å; F151-I155 HydrophobicContact CE2-CG1 4.33Å; F151-I155 HydrophobicContact CG-CD1 4.29Å; F151-I155 HydrophobicContact CZ-CD1 3.51Å; F151-I155 HydrophobicContact CZ-CG1 4.33Å; F151-I155 WeakPolarHBondContact O-CG1 3.26Å; F151-I155 PolarHBondContact O-N 3.16Å |
| 152 | I | 93.7 | Very high | 91.6 | Very high | 9 Ų | 9 | 47.2 Ų | 47.2 | 5% | 0.046 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -62.9 | -43.2 | 176.2 | -68.7 | 166.7 | 0 | 0 | 0 | 110.3 | M138 Y142 L148 Q149 W154 I155 Q156 W171 | M138-I152 HydrophobicContact CB-CD1 3.98Å; M138-I152 WeakPolarHBondContact O-CD1 3.5Å; Y142-I152 HydrophobicContact CD2-CB 4.02Å; Y142-I152 HydrophobicContact CD2-CD1 3.77Å; Y142-I152 HydrophobicContact CD2-CG2 3.9Å; Y142-I152 HydrophobicContact CE2-CB 4.1Å; Y142-I152 HydrophobicContact CE2-CG2 3.94Å; L148-I152 HydrophobicContact CD1-CD1 3.69Å; L148-I152 HydrophobicContact CD1-CG1 4.11Å; L148-I152 HydrophobicContact CD2-CD1 4.43Å; L148-I152 HydrophobicContact CG-CD1 3.71Å; L148-I152 HydrophobicContact CG-CG1 4.47Å; L148-I152 WeakPolarHBondContact O-CB 3.47Å; L148-I152 VanDerWaalsContact O-CG1 3.32Å; L148-I152 WeakPolarHBondContact O-CG1 3.42Å; L148-I152 PolarHBondContact O-N 2.71Å; Q149-I152 PolarHBondContact O-N 3.22Å; I152-W154 VanDerWaalsContact C-N 3.34Å; I152-W154 PolarHBondContact O-N 2.85Å; I152-I155 PolarHBondContact O-N 3.28Å; I152-Q156 HydrophobicContact CG2-CG 4.4Å; I152-Q156 WeakPolarHBondContact O-CB 3.49Å; I152-Q156 WeakPolarHBondContact O-CG 3.5Å; I152-Q156 PolarHBondContact O-N 2.97Å; I152-W171 HydrophobicContact CG2-CH2 4.32Å |
| 153 | D | 94.5 | Very high | 91.7 | Very high | 17 Ų | 17 | 47.2 Ų | 47.2 | 9% | 0.091 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61.6 | -43 | 178.5 | -75 | -14.7 | 0 | 0 | 0 | 111.7 | Y142 Q149 F151 Q156 K157 F194 S195 | Y142-D153 WeakPolarHBondContact CE2-OD1 3.34Å; Y142-D153 VanDerWaalsContact OH-CG 3.27Å; Y142-D153 PolarHBondContact OH-OD1 2.9Å; Y142-D153 PolarHBondContact OH-OD2 3.44Å; Q149-D153 WeakPolarHBondContact O-CB 3.33Å; Q149-D153 PolarHBondContact O-N 3.42Å; F151-D153 VanDerWaalsContact C-N 3.33Å; D153-Q156 PolarHBondContact O-N 3.37Å; D153-K157 WeakPolarHBondContact O-CB 3.35Å; D153-K157 PolarHBondContact O-N 3.18Å; D153-F194 VanDerWaalsContact OD2-CE1 3.3Å; D153-F194 WeakPolarHBondContact OD2-CE1 3.3Å; D153-F194 WeakPolarHBondContact OD2-CZ 3.37Å; D153-S195 VanDerWaalsContact CA-CB 3.49Å; D153-S195 VanDerWaalsContact OD1-CB 3.23Å; D153-S195 WeakPolarHBondContact OD1-CB 3.32Å; D153-S195 PolarHBondContact OD1-OG 3.12Å |
| 154 | W | 93.7 | Very high | 91.9 | Very high | 117 Ų | 117 | 43.1 Ų | 43.1 | 44% | 0.443 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -63 | -43.6 | 174.8 | 173 | 76.1 | 0 | 0 | 0 | 112 | S150 F151 I152 Q156 D158 W159 | S150-W154 WeakPolarHBondContact O-CB 3.28Å; S150-W154 PolarHBondContact O-N 2.77Å; F151-W154 HydrophobicContact CD2-CE3 4.25Å; F151-W154 HydrophobicContact CE2-CE3 4.26Å; F151-W154 HydrophobicContact CE2-CZ3 4.21Å; F151-W154 PolarHBondContact O-N 3.17Å; I152-W154 VanDerWaalsContact C-N 3.34Å; I152-W154 PolarHBondContact O-N 2.85Å; W154-Q156 PolarHBondContact O-N 3.43Å; W154-D158 HydrophobicContact CG-CB 4.47Å; W154-D158 WeakPolarHBondContact O-CA 3.26Å; W154-D158 WeakPolarHBondContact O-CB 3.23Å; W154-D158 PolarHBondContact O-N 3.38Å; W154-W159 HydrophobicContact CE3-CE3 4.24Å; W154-W159 HydrophobicContact CH2-CB 4.12Å; W154-W159 AromaticContact CH2-CD2 3.69Å; W154-W159 HydrophobicContact CH2-CD2 3.69Å; W154-W159 AromaticContact CH2-CE3 3.45Å; W154-W159 HydrophobicContact CH2-CE3 3.45Å; W154-W159 VanDerWaalsContact CH2-CE3 3.45Å; W154-W159 AromaticContact CH2-CG 3.99Å; W154-W159 HydrophobicContact CH2-CG 3.99Å; W154-W159 HydrophobicContact CH2-CZ3 4.1Å; W154-W159 HydrophobicContact CZ2-CB 4.06Å; W154-W159 HydrophobicContact CZ2-CD2 4.4Å; W154-W159 HydrophobicContact CZ2-CE3 4.48Å; W154-W159 HydrophobicContact CZ2-CG 4.24Å; W154-W159 HydrophobicContact CZ3-CB 4.41Å; W154-W159 HydrophobicContact CZ3-CD2 4.01Å; W154-W159 AromaticContact CZ3-CE3 3.31Å; W154-W159 HydrophobicContact CZ3-CE3 3.31Å; W154-W159 HydrophobicContact CZ3-CG 4.49Å; W154-W159 AromaticContact CZ3-CZ3 3.87Å; W154-W159 HydrophobicContact CZ3-CZ3 3.87Å; W154-W159 PolarHBondContact O-N 2.9Å |
| 155 | I | 93.6 | Very high | 92.2 | Very high | 26 Ų | 26 | 41 Ų | 41 | 13% | 0.133 | 20% | 0.203 | C | C | . | . | I | π-helix | trans | -58.1 | -51.9 | 175.8 | -71.9 | 169 | 0 | 0 | 0 | 110.3 | F151 I152 W159 L160 C229 | F151-I155 HydrophobicContact CD1-CD1 3.85Å; F151-I155 HydrophobicContact CD2-CD1 4.33Å; F151-I155 HydrophobicContact CE1-CD1 3.43Å; F151-I155 VanDerWaalsContact CE1-CD1 3.43Å; F151-I155 HydrophobicContact CE2-CD1 3.96Å; F151-I155 HydrophobicContact CE2-CG1 4.33Å; F151-I155 HydrophobicContact CG-CD1 4.29Å; F151-I155 HydrophobicContact CZ-CD1 3.51Å; F151-I155 HydrophobicContact CZ-CG1 4.33Å; F151-I155 WeakPolarHBondContact O-CG1 3.26Å; F151-I155 PolarHBondContact O-N 3.16Å; I152-I155 PolarHBondContact O-N 3.28Å; I155-W159 HydrophobicContact CG1-CE3 4.03Å; I155-W159 HydrophobicContact CG1-CZ3 4.42Å; I155-L160 HydrophobicContact CG2-CD1 3.78Å; I155-L160 HydrophobicContact CG2-CG 4.33Å; I155-L160 WeakPolarHBondContact O-CB 3.34Å; I155-L160 PolarHBondContact O-N 3.44Å; I155-C229 HydrophobicContact CG2-CB 4.33Å |
| 156 | Q | 95.5 | Very high | 92.6 | Very high | 3 Ų | 3 | 45.3 Ų | 45.3 | 1% | 0.014 | 23% | 0.226 | C | C | . | . | I | π-helix | trans | -68.5 | -45.1 | -173.5 | -76.9 | -178.5 | -7.4 | 0 | 0 | 112.4 | I152 D153 W154 H161 C162 S195 C196 C229 | I152-Q156 HydrophobicContact CG2-CG 4.4Å; I152-Q156 WeakPolarHBondContact O-CB 3.49Å; I152-Q156 WeakPolarHBondContact O-CG 3.5Å; I152-Q156 PolarHBondContact O-N 2.97Å; D153-Q156 PolarHBondContact O-N 3.37Å; W154-Q156 PolarHBondContact O-N 3.43Å; Q156-H161 CarbonylContact O-C 3.05Å; Q156-H161 WeakPolarHBondContact O-CA 3.32Å; Q156-H161 PolarHBondContact O-N 3.41Å; Q156-H161 VanDerWaalsContact O-N 3.15Å; Q156-C162 WeakPolarHBondContact CB-O 3.34Å; Q156-C162 WeakPolarHBondContact CG-O 3.41Å; Q156-C162 PolarHBondContact O-N 2.96Å; Q156-C162 VanDerWaalsContact O-N 3.09Å; Q156-S195 PolarHBondContact OE1-OG 2.67Å; Q156-C196 PolarHBondContact OE1-SG 3.23Å; Q156-C196 VanDerWaalsContact OE1-SG 3.35Å; Q156-C229 VanDerWaalsContact CG-SG 3.5Å |
| 157 | K | 93.1 | Very high | 92.9 | Very high | 33 Ų | 33 | 42.1 Ų | 42.1 | 14% | 0.143 | 21% | 0.207 | C | C | . | . | I | π-helix | trans | -88.3 | -49.7 | -172.1 | -179 | 178.4 | 164.9 | 169.1 | 0 | 113.5 | D153 H161 S200 | D153-K157 WeakPolarHBondContact O-CB 3.35Å; D153-K157 PolarHBondContact O-N 3.18Å; K157-H161 PolarHBondContact O-CE1 3.43Å; K157-H161 PolarHBondContact O-ND1 3.09Å; K157-S200 WeakPolarHBondContact CE-OG 3.34Å; K157-S200 PolarHBondContact NZ-OG 3.4Å; K157-S200 VanDerWaalsContact NZ-OG 3.1Å |
| 158 | D | 91.1 | Very high | 93.3 | Very high | 98 Ų | 98 | 40.2 Ų | 40.2 | 52% | 0.524 | 20% | 0.198 | S | C | . | . | I | π-helix | trans | -100.6 | -32.4 | -164.6 | -61.4 | -56.3 | 0 | 0 | 0 | 112.6 | W154 | W154-D158 HydrophobicContact CG-CB 4.47Å; W154-D158 WeakPolarHBondContact O-CA 3.26Å; W154-D158 WeakPolarHBondContact O-CB 3.23Å; W154-D158 PolarHBondContact O-N 3.38Å |
| 159 | W | 93.4 | Very high | 93.5 | Very high | 98 Ų | 98 | 42.3 Ų | 42.3 | 37% | 0.371 | 22% | 0.219 | S | C | . | . | I | π-helix | trans | -96.4 | -55.1 | -175.6 | -172.9 | 18.1 | 0 | 0 | 0 | 114.1 | W154 I155 W236 | W154-W159 HydrophobicContact CE3-CE3 4.24Å; W154-W159 HydrophobicContact CH2-CB 4.12Å; W154-W159 AromaticContact CH2-CD2 3.69Å; W154-W159 HydrophobicContact CH2-CD2 3.69Å; W154-W159 AromaticContact CH2-CE3 3.45Å; W154-W159 HydrophobicContact CH2-CE3 3.45Å; W154-W159 VanDerWaalsContact CH2-CE3 3.45Å; W154-W159 AromaticContact CH2-CG 3.99Å; W154-W159 HydrophobicContact CH2-CG 3.99Å; W154-W159 HydrophobicContact CH2-CZ3 4.1Å; W154-W159 HydrophobicContact CZ2-CB 4.06Å; W154-W159 HydrophobicContact CZ2-CD2 4.4Å; W154-W159 HydrophobicContact CZ2-CE3 4.48Å; W154-W159 HydrophobicContact CZ2-CG 4.24Å; W154-W159 HydrophobicContact CZ3-CB 4.41Å; W154-W159 HydrophobicContact CZ3-CD2 4.01Å; W154-W159 AromaticContact CZ3-CE3 3.31Å; W154-W159 HydrophobicContact CZ3-CE3 3.31Å; W154-W159 HydrophobicContact CZ3-CG 4.49Å; W154-W159 AromaticContact CZ3-CZ3 3.87Å; W154-W159 HydrophobicContact CZ3-CZ3 3.87Å; W154-W159 PolarHBondContact O-N 2.9Å; I155-W159 HydrophobicContact CG1-CE3 4.03Å; I155-W159 HydrophobicContact CG1-CZ3 4.42Å; W159-W236 HydrophobicContact CZ2-CD2 4.41Å; W159-W236 HydrophobicContact CZ2-CE3 4.13Å; W159-W236 HydrophobicContact CZ2-CH2 4.18Å; W159-W236 HydrophobicContact CZ2-CZ2 4.42Å; W159-W236 HydrophobicContact CZ2-CZ3 4.02Å; W159-W236 AromaticContact NE1-CE2 3.69Å; W159-W236 AromaticContact NE1-CZ2 3.98Å; W159-W236 AromaticContact NE1-NE1 3.79Å |
| 160 | L | 93.9 | Very high | 93.6 | Very high | 12 Ų | 12 | 41.9 Ų | 41.9 | 6% | 0.063 | 22% | 0.218 | C | C | . | . | S | Bend | trans | -112.5 | -11.2 | -166.4 | -66.8 | -179.1 | 0 | 0 | 0 | 114.9 | I155 C162 C229 Q232 A233 W236 | I155-L160 HydrophobicContact CG2-CD1 3.78Å; I155-L160 HydrophobicContact CG2-CG 4.33Å; I155-L160 WeakPolarHBondContact O-CB 3.34Å; I155-L160 PolarHBondContact O-N 3.44Å; L160-C162 HydrophobicContact CB-CB 4.2Å; L160-C162 WeakPolarHBondContact CB-SG 3.28Å; L160-C162 PolarHBondContact O-N 3.11Å; L160-C229 HydrophobicContact CD1-CB 4.46Å; L160-Q232 HydrophobicContact CB-CB 4.1Å; L160-Q232 PolarHBondContact O-NE2 3.33Å; L160-A233 HydrophobicContact CD1-CB 3.66Å; L160-W236 HydrophobicContact CD2-CB 3.95Å; L160-W236 HydrophobicContact CD2-CG 4.24Å |
| 161 | H | 94.2 | Very high | 93.7 | Very high | 101 Ų | 101 | 38.1 Ų | 38.1 | 47% | 0.468 | 19% | 0.192 | S | C | . | . | trans | 50.7 | 55.8 | -178.6 | -65.6 | -42.3 | 0 | 0 | 0 | 111.6 | Q156 K157 F225 | Q156-H161 CarbonylContact O-C 3.05Å; Q156-H161 WeakPolarHBondContact O-CA 3.32Å; Q156-H161 PolarHBondContact O-N 3.41Å; Q156-H161 VanDerWaalsContact O-N 3.15Å; K157-H161 PolarHBondContact O-CE1 3.43Å; K157-H161 PolarHBondContact O-ND1 3.09Å; H161-F225 VanDerWaalsContact C-CG 3.41Å; H161-F225 HydrophobicContact CB-CD1 3.94Å; H161-F225 HydrophobicContact CB-CE1 3.45Å; H161-F225 VanDerWaalsContact CB-CE1 3.45Å; H161-F225 HydrophobicContact CB-CE2 4.35Å; H161-F225 HydrophobicContact CB-CZ 3.69Å; H161-F225 AromaticContact CG-CE1 3.99Å; H161-F225 AromaticContact CG-CZ 3.88Å; H161-F225 AromaticContact ND1-CZ 3.52Å; H161-F225 WeakPolarHBondContact O-CD1 3.43Å; H161-F225 WeakPolarHBondContact O-CG 3.19Å | ||
| 162 | C | 95.6 | Very high | 93.9 | Very high | 0 Ų | 0 | 37.5 Ų | 37.5 | 0% | 0 | 19% | 0.192 | C | C | . | . | trans | -134.1 | 171.1 | -169.8 | 61.3 | 0 | 0 | 0 | 0 | 110.8 | Q156 L160 E227 C229 Q232 | Q156-C162 WeakPolarHBondContact CB-O 3.34Å; Q156-C162 WeakPolarHBondContact CG-O 3.41Å; Q156-C162 PolarHBondContact O-N 2.96Å; Q156-C162 VanDerWaalsContact O-N 3.09Å; L160-C162 HydrophobicContact CB-CB 4.2Å; L160-C162 WeakPolarHBondContact CB-SG 3.28Å; L160-C162 PolarHBondContact O-N 3.11Å; C162-E227 CarbonylContact C-O 3.36Å; C162-E227 VanDerWaalsContact CA-O 3.3Å; C162-E227 WeakPolarHBondContact CA-O 3.28Å; C162-E227 WeakPolarHBondContact CB-O 3.43Å; C162-C229 HydrophobicContact CB-CB 3.89Å; C162-C229 WeakPolarHBondContact CB-SG 3.49Å; C162-C229 WeakPolarHBondContact SG-CA 3.21Å; C162-C229 WeakPolarHBondContact SG-CB 3.22Å; C162-C229 CovalentContact SG-SG 2.03Å; C162-C229 PolarHBondContact SG-SG 3.41Å; C162-Q232 HydrophobicContact CB-CB 4.06Å; C162-Q232 HydrophobicContact CB-CG 3.88Å | ||
| 163 | C | 95.7 | Very high | 93.9 | Very high | 0 Ų | 0 | 40.9 Ų | 40.9 | 0% | 0 | 21% | 0.21 | C | C | . | . | trans | -146 | 129.3 | 175.4 | -172.3 | 0 | 0 | 0 | 0 | 111.4 | G167 P168 W171 C196 F225 E227 | C163-G167 CarbonylContact O-C 3.54Å; C163-G167 WeakPolarHBondContact O-CA 3.4Å; C163-P168 HydrophobicContact CB-CG 4.01Å; C163-W171 PolarHBondContact SG-NE1 3.28Å; C163-W171 VanDerWaalsContact SG-NE1 3.39Å; C163-C196 WeakPolarHBondContact CA-SG 3.49Å; C163-C196 HydrophobicContact CB-CB 3.65Å; C163-C196 WeakPolarHBondContact CB-SG 3.49Å; C163-C196 WeakPolarHBondContact SG-CB 3.34Å; C163-C196 CovalentContact SG-SG 2.04Å; C163-C196 PolarHBondContact SG-SG 2.78Å; C163-F225 HydrophobicContact CB-CB 4.12Å; C163-F225 VanDerWaalsContact CB-O 3.25Å; C163-F225 WeakPolarHBondContact CB-O 3.01Å; C163-E227 PolarHBondContact N-O 3.08Å | ||
| 164 | G | 94.5 | Very high | 94 | Very high | 0 Ų | 0 | 40.1 Ų | 40.1 | 0% | 0 | 21% | 0.206 | C | C | . | . | S | Bend | trans | 69 | -176.1 | -173.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | G167 C229 | G164-G167 WeakPolarHBondContact CA-O 3.3Å; G164-C229 WeakPolarHBondContact O-CB 3.49Å; G164-C229 PolarHBondContact O-N 3.14Å; G164-C229 PolarHBondContact O-SG 2.82Å |
| 165 | I | 93.1 | Very high | 94 | Very high | 15 Ų | 15 | 39.6 Ų | 39.6 | 8% | 0.077 | 21% | 0.211 | C | C | . | . | S | Bend | trans | -78.9 | -60.1 | 177.8 | -57.6 | -53.1 | 0 | 0 | 0 | 109.5 | L135 I139 D170 G228 C229 L230 | L135-I165 HydrophobicContact CB-CD1 3.98Å; L135-I165 HydrophobicContact CB-CG1 4.15Å; L135-I165 HydrophobicContact CB-CG2 3.95Å; L135-I165 HydrophobicContact CD1-CG2 4.11Å; I139-I165 HydrophobicContact CD1-CD1 4.33Å; I139-I165 HydrophobicContact CD1-CG1 4.42Å; I139-I165 HydrophobicContact CG1-CD1 4.09Å; I139-I165 HydrophobicContact CG1-CG1 3.8Å; I165-D170 WeakPolarHBondContact CA-OD2 3.12Å; I165-D170 PolarHBondContact N-OD2 3.48Å; I165-G228 CarbonylContact O-C 3.42Å; I165-G228 VanDerWaalsContact O-C 3.27Å; I165-G228 VanDerWaalsContact O-CA 3.31Å; I165-G228 WeakPolarHBondContact O-CA 3.21Å; I165-C229 PolarHBondContact O-N 3.29Å; I165-L230 HydrophobicContact CG2-CB 3.99Å; I165-L230 HydrophobicContact CG2-CD2 4.28Å; I165-L230 WeakPolarHBondContact O-CB 3.43Å; I165-L230 PolarHBondContact O-N 2.87Å |
| 166 | N | 91.7 | Very high | 94 | Very high | 100 Ų | 100 | 43.1 Ų | 43.1 | 54% | 0.535 | 22% | 0.223 | S | C | . | . | S | Bend | trans | -96.5 | -25.8 | 174.9 | -62.9 | -53.6 | 0 | 0 | 0 | 112.2 | D170 G228 | N166-D170 WeakPolarHBondContact CA-OD2 3.35Å; N166-D170 PolarHBondContact N-OD2 3.29Å; N166-G228 VanDerWaalsContact C-CA 3.44Å; N166-G228 WeakPolarHBondContact O-CA 3.47Å; N166-G228 PolarHBondContact O-N 3.02Å |
| 167 | G | 93.2 | Very high | 94 | Very high | 10 Ų | 10 | 43 Ų | 43 | 10% | 0.103 | 22% | 0.223 | C | C | . | . | S | Bend | trans | 172.1 | -176.5 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | C163 G164 G169 D170 | C163-G167 CarbonylContact O-C 3.54Å; C163-G167 WeakPolarHBondContact O-CA 3.4Å; G164-G167 WeakPolarHBondContact CA-O 3.3Å; G167-G169 PolarHBondContact O-N 3.11Å; G167-D170 PolarHBondContact N-OD2 3.5Å; G167-D170 VanDerWaalsContact O-CG 3.26Å; G167-D170 PolarHBondContact O-N 3.1Å; G167-D170 VanDerWaalsContact O-N 3.09Å; G167-D170 VanDerWaalsContact O-OD2 3.07Å |
| 168 | P | 93.6 | Very high | 94.1 | Very high | 10 Ų | 10 | 43.7 Ų | 43.7 | 7% | 0.065 | 23% | 0.228 | C | C | . | . | G | 310 helix | trans | -57.5 | -23.9 | -177.3 | -29.4 | 37.7 | 0 | 0 | 0 | 115.1 | C163 D170 V192 R215 L220 I224 F225 Q226 | C163-P168 HydrophobicContact CB-CG 4.01Å; P168-D170 VanDerWaalsContact C-N 3.25Å; P168-D170 PolarHBondContact O-N 2.89Å; P168-V192 HydrophobicContact CB-CG1 4.29Å; P168-R215 WeakPolarHBondContact O-CD 3.17Å; P168-L220 HydrophobicContact CB-CD2 4.04Å; P168-L220 HydrophobicContact CG-CD2 3.83Å; P168-I224 HydrophobicContact CB-CD1 4.23Å; P168-I224 HydrophobicContact CG-CD1 4.3Å; P168-F225 VanDerWaalsContact CG-O 3.3Å; P168-F225 WeakPolarHBondContact CG-O 3.39Å; P168-Q226 VanDerWaalsContact CD-O 3.31Å; P168-Q226 WeakPolarHBondContact CD-O 3.41Å |
| 169 | G | 93.4 | Very high | 94.1 | Very high | 45 Ų | 45 | 41.5 Ų | 41.5 | 46% | 0.464 | 22% | 0.22 | S | C | . | . | G | 310 helix | trans | -65.6 | -24.3 | 178 | 0 | 0 | 0 | 0 | 0 | 114.1 | G167 W171 D172 | G167-G169 PolarHBondContact O-N 3.11Å; G169-W171 PolarHBondContact O-N 2.96Å; G169-D172 PolarHBondContact O-N 2.95Å |
| 170 | D | 94.6 | Very high | 94 | Very high | 30 Ų | 30 | 41.1 Ų | 41.1 | 16% | 0.16 | 23% | 0.232 | C | C | . | . | G | 310 helix | trans | -63.4 | -20.2 | -177.8 | -55.9 | -28.4 | 0 | 0 | 0 | 112.4 | I139 I165 N166 G167 P168 D172 L173 | I139-D170 WeakPolarHBondContact CG2-O 3.42Å; I165-D170 WeakPolarHBondContact CA-OD2 3.12Å; I165-D170 PolarHBondContact N-OD2 3.48Å; N166-D170 WeakPolarHBondContact CA-OD2 3.35Å; N166-D170 PolarHBondContact N-OD2 3.29Å; G167-D170 PolarHBondContact N-OD2 3.5Å; G167-D170 VanDerWaalsContact O-CG 3.26Å; G167-D170 PolarHBondContact O-N 3.1Å; G167-D170 VanDerWaalsContact O-N 3.09Å; G167-D170 VanDerWaalsContact O-OD2 3.07Å; P168-D170 VanDerWaalsContact C-N 3.25Å; P168-D170 PolarHBondContact O-N 2.89Å; D170-D172 PolarHBondContact O-N 3.45Å; D170-D172 VanDerWaalsContact O-N 3.11Å; D170-L173 VanDerWaalsContact O-CB 3.25Å; D170-L173 WeakPolarHBondContact O-CB 3.48Å; D170-L173 WeakPolarHBondContact O-CG 3.32Å; D170-L173 PolarHBondContact O-N 3.36Å |
| 171 | W | 95.6 | Very high | 94 | Very high | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 23% | 0.232 | C | C | . | . | G | 310 helix | trans | -64.3 | -9.9 | 174.8 | -70.7 | 109.7 | 0 | 0 | 0 | 113.9 | I139 Y142 I152 C163 G169 L173 N174 F177 V192 P193 C196 | I139-W171 HydrophobicContact CD1-CH2 3.83Å; I139-W171 HydrophobicContact CD1-CZ2 3.89Å; I139-W171 HydrophobicContact CD1-CZ3 4.19Å; I139-W171 HydrophobicContact CG2-CD2 4.29Å; I139-W171 HydrophobicContact CG2-CE3 3.8Å; I139-W171 HydrophobicContact CG2-CZ3 4.02Å; Y142-W171 HydrophobicContact CD1-CH2 4.15Å; Y142-W171 AromaticContact CD1-CZ3 3.86Å; Y142-W171 HydrophobicContact CD1-CZ3 3.86Å; Y142-W171 AromaticContact CD2-CH2 3.68Å; Y142-W171 HydrophobicContact CD2-CH2 3.68Å; Y142-W171 HydrophobicContact CD2-CZ3 4.12Å; Y142-W171 HydrophobicContact CE1-CH2 4.44Å; Y142-W171 HydrophobicContact CE1-CZ3 4.42Å; Y142-W171 AromaticContact CE2-CH2 4Å; Y142-W171 HydrophobicContact CE2-CH2 4Å; Y142-W171 AromaticContact CG-CH2 3.77Å; Y142-W171 HydrophobicContact CG-CH2 3.77Å; Y142-W171 AromaticContact CG-CZ3 3.7Å; Y142-W171 HydrophobicContact CG-CZ3 3.7Å; I152-W171 HydrophobicContact CG2-CH2 4.32Å; C163-W171 PolarHBondContact SG-NE1 3.28Å; C163-W171 VanDerWaalsContact SG-NE1 3.39Å; G169-W171 PolarHBondContact O-N 2.96Å; W171-L173 PolarHBondContact O-N 3.18Å; W171-N174 HydrophobicContact CE3-CB 4.24Å; W171-N174 PolarHBondContact O-N 3.49Å; W171-F177 HydrophobicContact CB-CB 4.08Å; W171-F177 AromaticContact CE3-CD2 3.63Å; W171-F177 HydrophobicContact CE3-CD2 3.63Å; W171-F177 AromaticContact CE3-CE2 3.97Å; W171-F177 HydrophobicContact CE3-CE2 3.97Å; W171-F177 HydrophobicContact CE3-CG 4.14Å; W171-F177 HydrophobicContact CZ3-CD2 4.04Å; W171-F177 AromaticContact CZ3-CE2 3.96Å; W171-F177 HydrophobicContact CZ3-CE2 3.96Å; W171-F177 VanDerWaalsContact O-CB 3.24Å; W171-F177 WeakPolarHBondContact O-CB 3.29Å; W171-V192 HydrophobicContact CB-CG1 4.38Å; W171-V192 VanDerWaalsContact CD1-CG1 3.47Å; W171-V192 HydrophobicContact CG-CB 4.34Å; W171-V192 HydrophobicContact CG-CG1 4.08Å; W171-P193 VanDerWaalsContact CD2-CD 3.44Å; W171-P193 HydrophobicContact CD2-CG 4.03Å; W171-P193 HydrophobicContact CE3-CG 3.96Å; W171-P193 HydrophobicContact CH2-CG 3.18Å; W171-P193 HydrophobicContact CZ2-CG 3.2Å; W171-P193 HydrophobicContact CZ3-CG 3.57Å; W171-C196 PolarHBondContact NE1-SG 3.27Å; W171-C196 VanDerWaalsContact NE1-SG 3.44Å |
| 172 | D | 94.3 | Very high | 93.8 | Very high | 63 Ų | 63 | 41.6 Ų | 41.6 | 34% | 0.337 | 24% | 0.236 | S | C | . | . | G | 310 helix | trans | -68.7 | -18.7 | 166.6 | -79 | -37.2 | 0 | 0 | 0 | 113.7 | G169 D170 N174 N178 S179 R215 | G169-D172 PolarHBondContact O-N 2.95Å; D170-D172 PolarHBondContact O-N 3.45Å; D170-D172 VanDerWaalsContact O-N 3.11Å; D172-N174 VanDerWaalsContact C-N 3.26Å; D172-N174 PolarHBondContact O-N 3.05Å; D172-N178 WeakPolarHBondContact O-CB 3.48Å; D172-N178 PolarHBondContact O-ND2 2.92Å; D172-S179 PolarHBondContact OD1-N 2.83Å; D172-S179 PolarHBondContact OD1-OG 3.3Å; D172-R215 IonicContact OD1-CZ 3.62Å; D172-R215 IonicContact OD1-NH1 3.5Å; D172-R215 PolarHBondContact OD1-NH1 3.04Å; D172-R215 IonicContact OD1-NH2 2.78Å; D172-R215 IonicContact OD2-NH1 2.58Å; D172-R215 PolarHBondContact OD2-NH1 3.11Å |
| 173 | L | 94.5 | Very high | 93.6 | Very high | 81 Ų | 81 | 46.2 Ų | 46.2 | 42% | 0.424 | 27% | 0.274 | S | S | . | . | G | 310 helix | trans | -70.7 | -23.9 | 174.3 | -61.3 | 175.3 | 0 | 0 | 0 | 112.4 | D136 I139 I140 D170 W171 | D136-L173 HydrophobicContact CB-CD1 4.13Å; I139-L173 HydrophobicContact CG2-CB 4.3Å; I140-L173 HydrophobicContact CG1-CB 4.03Å; D170-L173 VanDerWaalsContact O-CB 3.25Å; D170-L173 WeakPolarHBondContact O-CB 3.48Å; D170-L173 WeakPolarHBondContact O-CG 3.32Å; D170-L173 PolarHBondContact O-N 3.36Å; W171-L173 PolarHBondContact O-N 3.18Å |
| 174 | N | 95.2 | Very high | 93.5 | Very high | 1 Ų | 1 | 53.4 Ų | 53.4 | 1% | 0.005 | 31% | 0.312 | C | S | . | . | S | Bend | trans | -87.7 | 131.6 | -179.7 | -174.8 | -79 | 0 | 0 | 0 | 111.4 | I139 I140 W171 D172 Y176 F177 N178 | I139-N174 HydrophobicContact CG2-CB 4.2Å; I139-N174 WeakPolarHBondContact O-CB 3.13Å; I139-N174 PolarHBondContact O-ND2 2.89Å; I140-N174 PolarHBondContact O-ND2 2.89Å; I140-N174 VanDerWaalsContact O-ND2 3.14Å; W171-N174 HydrophobicContact CE3-CB 4.24Å; W171-N174 PolarHBondContact O-N 3.49Å; D172-N174 VanDerWaalsContact C-N 3.26Å; D172-N174 PolarHBondContact O-N 3.05Å; N174-Y176 PolarHBondContact O-N 2.95Å; N174-Y176 VanDerWaalsContact O-N 3.11Å; N174-Y176 WeakPolarHBondContact OD1-CB 3.15Å; N174-Y176 WeakPolarHBondContact OD1-CD2 3.48Å; N174-Y176 PolarHBondContact OD1-N 3.02Å; N174-F177 HydrophobicContact CB-CB 4.45Å; N174-F177 HydrophobicContact CB-CD2 3.97Å; N174-F177 PolarHBondContact O-N 3.5Å; N174-F177 WeakPolarHBondContact OD1-CD2 3.16Å; N174-N178 WeakPolarHBondContact O-CB 3.32Å; N174-N178 PolarHBondContact O-N 2.89Å |
| 175 | I | 94.6 | Very high | 93.3 | Very high | 106 Ų | 106 | 56.3 Ų | 56.3 | 54% | 0.544 | 34% | 0.342 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62 | -21 | -176.4 | 66 | 173.3 | 0 | 0 | 0 | 114.7 | S181 | I175-S181 VanDerWaalsContact O-CB 3.27Å; I175-S181 WeakPolarHBondContact O-CB 3.46Å; I175-S181 PolarHBondContact O-OG 3.24Å |
| 176 | Y | 93.9 | Very high | 93.2 | Very high | 99 Ų | 99 | 56.7 Ų | 56.7 | 39% | 0.388 | 35% | 0.346 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.9 | -34.3 | 179.4 | -62.9 | -83.8 | 0 | 0 | 0 | 112.1 | R143 N174 S186 E188 A189 | R143-Y176 HydrophobicContact CB-CD2 3.67Å; R143-Y176 HydrophobicContact CB-CE2 3.43Å; R143-Y176 VanDerWaalsContact CB-CE2 3.43Å; R143-Y176 HydrophobicContact CG-CD2 3.47Å; R143-Y176 VanDerWaalsContact CG-CD2 3.47Å; R143-Y176 HydrophobicContact CG-CE2 3.77Å; R143-Y176 HydrophobicContact CG-CG 4.09Å; N174-Y176 PolarHBondContact O-N 2.95Å; N174-Y176 VanDerWaalsContact O-N 3.11Å; N174-Y176 WeakPolarHBondContact OD1-CB 3.15Å; N174-Y176 WeakPolarHBondContact OD1-CD2 3.48Å; N174-Y176 PolarHBondContact OD1-N 3.02Å; Y176-S186 PolarHBondContact O-OG 3.47Å; Y176-E188 CarbonylContact O-C 3.53Å; Y176-A189 PolarHBondContact O-N 3.38Å |
| 177 | F | 95.7 | Very high | 93.2 | Very high | 1 Ų | 1 | 56.8 Ų | 56.8 | 0% | 0.004 | 35% | 0.351 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -93.3 | -20.2 | -176.8 | -65.3 | -79.6 | 0 | 0 | 0 | 113 | Y142 W171 N174 S179 E188 G190 G191 V192 P193 R215 | Y142-F177 AromaticContact CD1-CE2 3.82Å; Y142-F177 HydrophobicContact CD1-CE2 3.82Å; Y142-F177 HydrophobicContact CD1-CZ 4.49Å; Y142-F177 AromaticContact CE1-CE2 3.91Å; Y142-F177 HydrophobicContact CE1-CE2 3.91Å; Y142-F177 HydrophobicContact CE1-CZ 4.13Å; W171-F177 HydrophobicContact CB-CB 4.08Å; W171-F177 AromaticContact CE3-CD2 3.63Å; W171-F177 HydrophobicContact CE3-CD2 3.63Å; W171-F177 AromaticContact CE3-CE2 3.97Å; W171-F177 HydrophobicContact CE3-CE2 3.97Å; W171-F177 HydrophobicContact CE3-CG 4.14Å; W171-F177 HydrophobicContact CZ3-CD2 4.04Å; W171-F177 AromaticContact CZ3-CE2 3.96Å; W171-F177 HydrophobicContact CZ3-CE2 3.96Å; W171-F177 VanDerWaalsContact O-CB 3.24Å; W171-F177 WeakPolarHBondContact O-CB 3.29Å; N174-F177 HydrophobicContact CB-CB 4.45Å; N174-F177 HydrophobicContact CB-CD2 3.97Å; N174-F177 PolarHBondContact O-N 3.5Å; N174-F177 WeakPolarHBondContact OD1-CD2 3.16Å; F177-S179 PolarHBondContact O-N 3.15Å; F177-E188 HydrophobicContact CD1-CB 3.87Å; F177-E188 HydrophobicContact CE1-CB 3.85Å; F177-E188 HydrophobicContact CE1-CG 4.34Å; F177-E188 WeakPolarHBondContact CZ-OE2 3.47Å; F177-G190 PolarHBondContact O-N 3.44Å; F177-G191 WeakPolarHBondContact CD1-O 3.1Å; F177-V192 VanDerWaalsContact CE1-C 3.44Å; F177-P193 HydrophobicContact CE1-CB 4.48Å; F177-P193 HydrophobicContact CE1-CG 4.12Å; F177-P193 HydrophobicContact CE2-CG 3.98Å; F177-P193 HydrophobicContact CZ-CB 4.02Å; F177-P193 HydrophobicContact CZ-CG 3.59Å; F177-R215 PolarHBondContact O-NH2 3.16Å |
| 178 | N | 94.7 | Very high | 93.3 | Very high | 47 Ų | 47 | 57.9 Ų | 57.9 | 25% | 0.251 | 35% | 0.354 | S | S | . | . | S | Bend | trans | -50.5 | 134.1 | 176.4 | -171.2 | -53.1 | 0 | 0 | 0 | 110.8 | D172 N174 S180 S181 | D172-N178 WeakPolarHBondContact O-CB 3.48Å; D172-N178 PolarHBondContact O-ND2 2.92Å; N174-N178 WeakPolarHBondContact O-CB 3.32Å; N174-N178 PolarHBondContact O-N 2.89Å; N178-S180 PolarHBondContact O-N 3.02Å; N178-S180 VanDerWaalsContact O-N 3.15Å; N178-S180 VanDerWaalsContact OD1-CB 3.28Å; N178-S180 WeakPolarHBondContact OD1-CB 3.43Å; N178-S180 PolarHBondContact OD1-N 3.41Å; N178-S180 PolarHBondContact OD1-OG 3.07Å; N178-S181 VanDerWaalsContact O-CB 3.22Å; N178-S181 WeakPolarHBondContact O-CB 3.07Å; N178-S181 PolarHBondContact O-N 3.43Å; N178-S181 PolarHBondContact O-OG 2.78Å |
| 179 | S | 91 | Very high | 93.3 | Very high | 52 Ų | 52 | 57.5 Ų | 57.5 | 36% | 0.364 | 35% | 0.352 | S | S | . | . | G | 310 helix | trans | -56 | -32.3 | -179.5 | -59.3 | 0 | 0 | 0 | 0 | 112.8 | D172 F177 S181 E182 | D172-S179 PolarHBondContact OD1-N 2.83Å; D172-S179 PolarHBondContact OD1-OG 3.3Å; F177-S179 PolarHBondContact O-N 3.15Å; S179-S181 PolarHBondContact O-N 2.85Å; S179-E182 WeakPolarHBondContact O-CB 3.41Å; S179-E182 PolarHBondContact O-N 3.36Å |
| 180 | S | 92.2 | Very high | 93.3 | Very high | 90 Ų | 90 | 55.4 Ų | 55.4 | 63% | 0.629 | 33% | 0.33 | S | S | * | . | G | 310 helix | trans | -67.4 | -20.5 | 177.7 | -45.6 | 0 | 0 | 0 | 0 | 113.2 | N178 E182 A183 | N178-S180 PolarHBondContact O-N 3.02Å; N178-S180 VanDerWaalsContact O-N 3.15Å; N178-S180 VanDerWaalsContact OD1-CB 3.28Å; N178-S180 WeakPolarHBondContact OD1-CB 3.43Å; N178-S180 PolarHBondContact OD1-N 3.41Å; N178-S180 PolarHBondContact OD1-OG 3.07Å; S180-E182 PolarHBondContact O-N 3.43Å; S180-A183 WeakPolarHBondContact O-CB 3.37Å; S180-A183 PolarHBondContact O-N 3.11Å; S180-A183 VanDerWaalsContact O-N 3.16Å |
| 181 | S | 92.5 | Very high | 93.3 | Very high | 9 Ų | 9 | 54 Ų | 54 | 6% | 0.063 | 32% | 0.322 | C | S | . | . | G | 310 helix | trans | -72.9 | -7 | -179.1 | -53.4 | 0 | 0 | 0 | 0 | 113.2 | I175 N178 S179 A183 L184 G185 S186 | I175-S181 VanDerWaalsContact O-CB 3.27Å; I175-S181 WeakPolarHBondContact O-CB 3.46Å; I175-S181 PolarHBondContact O-OG 3.24Å; N178-S181 VanDerWaalsContact O-CB 3.22Å; N178-S181 WeakPolarHBondContact O-CB 3.07Å; N178-S181 PolarHBondContact O-N 3.43Å; N178-S181 PolarHBondContact O-OG 2.78Å; S179-S181 PolarHBondContact O-N 2.85Å; S181-A183 PolarHBondContact O-N 2.79Å; S181-L184 CarbonylContact O-C 3.56Å; S181-L184 WeakPolarHBondContact O-CB 3.46Å; S181-L184 PolarHBondContact O-N 3.38Å; S181-L184 VanDerWaalsContact O-N 3.07Å; S181-G185 PolarHBondContact O-N 2.85Å; S181-S186 WeakPolarHBondContact O-CB 3.23Å; S181-S186 PolarHBondContact O-N 2.99Å |
| 182 | E | 90.9 | Very high | 93.3 | Very high | 115 Ų | 115 | 54 Ų | 54 | 54% | 0.537 | 32% | 0.323 | S | S | . | . | G | 310 helix | trans | -59.7 | -37 | 167.3 | 179.4 | 160.3 | -144.8 | 0 | 0 | 111.2 | S179 S180 L184 G185 A189 K216 | S179-E182 WeakPolarHBondContact O-CB 3.41Å; S179-E182 PolarHBondContact O-N 3.36Å; S180-E182 PolarHBondContact O-N 3.43Å; E182-L184 PolarHBondContact O-N 3.2Å; E182-G185 PolarHBondContact O-N 3.33Å; E182-A189 HydrophobicContact CB-CB 3.78Å; E182-K216 IonicContact OE1-NZ 2.78Å; E182-K216 PolarHBondContact OE1-NZ 2.89Å; E182-K216 IonicContact OE2-NZ 2.81Å; E182-K216 PolarHBondContact OE2-NZ 3.43Å |
| 183 | A | 91.7 | Very high | 93.4 | Very high | 97 Ų | 97 | 51.2 Ų | 51.2 | 80% | 0.802 | 31% | 0.308 | S | S | * | . | G | 310 helix | trans | -65.4 | -22.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113 | S180 S181 | S180-A183 WeakPolarHBondContact O-CB 3.37Å; S180-A183 PolarHBondContact O-N 3.11Å; S180-A183 VanDerWaalsContact O-N 3.16Å; S181-A183 PolarHBondContact O-N 2.79Å |
| 184 | L | 91.8 | Very high | 93.3 | Very high | 151 Ų | 151 | 48.6 Ų | 48.6 | 79% | 0.791 | 29% | 0.293 | S | S | * | . | G | 310 helix | trans | -93.1 | 3.4 | 175.2 | -64 | 167.9 | 0 | 0 | 0 | 112.4 | S181 E182 | S181-L184 CarbonylContact O-C 3.56Å; S181-L184 WeakPolarHBondContact O-CB 3.46Å; S181-L184 PolarHBondContact O-N 3.38Å; S181-L184 VanDerWaalsContact O-N 3.07Å; E182-L184 PolarHBondContact O-N 3.2Å |
| 185 | G | 91 | Very high | 93.3 | Very high | 61 Ų | 61 | 48.5 Ų | 48.5 | 63% | 0.629 | 29% | 0.292 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 75.3 | 19.8 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | S181 E182 P187 | S181-G185 PolarHBondContact O-N 2.85Å; E182-G185 PolarHBondContact O-N 3.33Å; G185-P187 WeakPolarHBondContact O-CD 3.35Å |
| 186 | S | 91.9 | Very high | 93.3 | Very high | 23 Ų | 23 | 43.5 Ų | 43.5 | 16% | 0.161 | 27% | 0.267 | C | S | . | . | trans | -67.6 | 120.3 | 174.8 | 179.3 | 0 | 0 | 0 | 0 | 110 | Y176 S181 E188 A189 | Y176-S186 PolarHBondContact O-OG 3.47Å; S181-S186 WeakPolarHBondContact O-CB 3.23Å; S181-S186 PolarHBondContact O-N 2.99Å; S186-E188 PolarHBondContact O-N 3.41Å; S186-E188 PolarHBondContact OG-N 2.77Å; S186-A189 WeakPolarHBondContact O-CB 3.26Å; S186-A189 PolarHBondContact O-N 2.95Å | ||
| 187 | P | 92.1 | Very high | 93.3 | Very high | 101 Ų | 101 | 38.9 Ų | 38.9 | 66% | 0.656 | 25% | 0.249 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -66.5 | -18.2 | 176.6 | 27.3 | -33.1 | 0 | 0 | 0 | 112.3 | G185 H212 | G185-P187 WeakPolarHBondContact O-CD 3.35Å; P187-H212 PolarHBondContact O-CE1 3.43Å; P187-H212 PolarHBondContact O-ND1 3.37Å |
| 188 | E | 93.7 | Very high | 93.1 | Very high | 34 Ų | 34 | 44.3 Ų | 44.3 | 16% | 0.159 | 27% | 0.273 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -93.1 | -3.7 | -175.8 | -59.3 | -175.3 | 161.5 | 0 | 0 | 113.1 | R143 Y176 F177 S186 G190 G191 | R143-E188 IonicContact CZ-OE1 3.64Å; R143-E188 IonicContact CZ-OE2 3.4Å; R143-E188 IonicContact NE-OE2 3.61Å; R143-E188 IonicContact NH2-OE1 3.01Å; R143-E188 PolarHBondContact NH2-OE1 3.34Å; R143-E188 IonicContact NH2-OE2 2.92Å; R143-E188 PolarHBondContact NH2-OE2 2.98Å; Y176-E188 CarbonylContact O-C 3.53Å; F177-E188 HydrophobicContact CD1-CB 3.87Å; F177-E188 HydrophobicContact CE1-CB 3.85Å; F177-E188 HydrophobicContact CE1-CG 4.34Å; F177-E188 WeakPolarHBondContact CZ-OE2 3.47Å; S186-E188 PolarHBondContact O-N 3.41Å; S186-E188 PolarHBondContact OG-N 2.77Å; E188-G190 PolarHBondContact O-N 2.73Å; E188-G191 WeakPolarHBondContact O-CA 3.2Å; E188-G191 PolarHBondContact O-N 3.45Å |
| 189 | A | 94.5 | Very high | 92.5 | Very high | 2 Ų | 2 | 46 Ų | 46 | 2% | 0.017 | 29% | 0.288 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -56.3 | 132.1 | -177.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y176 E182 S186 G191 K216 | Y176-A189 PolarHBondContact O-N 3.38Å; E182-A189 HydrophobicContact CB-CB 3.78Å; S186-A189 WeakPolarHBondContact O-CB 3.26Å; S186-A189 PolarHBondContact O-N 2.95Å; A189-G191 PolarHBondContact O-N 2.9Å; A189-K216 WeakPolarHBondContact O-CE 3.45Å |
| 190 | G | 93.4 | Very high | 91.7 | Very high | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 27% | 0.273 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 65.8 | 17.8 | -174.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | F177 E188 G213 V214 R215 | F177-G190 PolarHBondContact O-N 3.44Å; E188-G190 PolarHBondContact O-N 2.73Å; G190-G213 CarbonylContact O-C 3.2Å; G190-G213 WeakPolarHBondContact O-CA 3.44Å; G190-V214 PolarHBondContact O-N 3.09Å; G190-R215 WeakPolarHBondContact O-CA 3.47Å; G190-R215 VanDerWaalsContact O-CB 3.25Å; G190-R215 WeakPolarHBondContact O-CB 3.5Å; G190-R215 PolarHBondContact O-N 3.31Å |
| 191 | G | 94.8 | Very high | 90.9 | Very high | 0 Ų | 0 | 45.5 Ų | 45.5 | 0% | 0 | 27% | 0.269 | C | S | . | . | trans | -108.4 | -176.8 | 178 | 0 | 0 | 0 | 0 | 0 | 113.6 | F177 E188 A189 G211 R215 | F177-G191 WeakPolarHBondContact CD1-O 3.1Å; E188-G191 WeakPolarHBondContact O-CA 3.2Å; E188-G191 PolarHBondContact O-N 3.45Å; A189-G191 PolarHBondContact O-N 2.9Å; G191-G211 CarbonylContact C-O 3.54Å; G191-G211 WeakPolarHBondContact CA-O 3.45Å; G191-R215 PolarHBondContact O-NE 3.19Å; G191-R215 PolarHBondContact O-NH2 3.22Å | ||
| 192 | V | 95.3 | Very high | 90.1 | Very high | 2 Ų | 2 | 49.7 Ų | 49.7 | 1% | 0.012 | 29% | 0.29 | C | S | . | . | trans | -128.3 | 160.4 | 167.8 | -59 | 0 | 0 | 0 | 0 | 108.1 | P168 W171 F177 C196 G211 V214 R215 I224 | P168-V192 HydrophobicContact CB-CG1 4.29Å; W171-V192 HydrophobicContact CB-CG1 4.38Å; W171-V192 VanDerWaalsContact CD1-CG1 3.47Å; W171-V192 HydrophobicContact CG-CB 4.34Å; W171-V192 HydrophobicContact CG-CG1 4.08Å; F177-V192 VanDerWaalsContact CE1-C 3.44Å; V192-C196 HydrophobicContact CB-CB 4.07Å; V192-C196 HydrophobicContact CG2-CB 3.6Å; V192-G211 PolarHBondContact N-O 3.49Å; V192-G211 CarbonylContact O-C 3.53Å; V192-G211 WeakPolarHBondContact O-CA 3.48Å; V192-V214 HydrophobicContact CG1-CG2 4.18Å; V192-V214 HydrophobicContact CG2-CG2 3.87Å; V192-R215 HydrophobicContact CG1-CG 4.2Å; V192-I224 HydrophobicContact CG2-CD1 4.28Å; V192-I224 HydrophobicContact CG2-CG2 4.21Å | ||
| 193 | P | 95.5 | Very high | 89.6 | Confident | 4 Ų | 4 | 53.3 Ų | 53.3 | 3% | 0.026 | 31% | 0.306 | C | S | . | . | trans | -63.8 | 158.3 | 175.1 | -13.3 | 23.5 | 0 | 0 | 0 | 111.9 | Y142 W171 F177 S195 C196 | Y142-P193 HydrophobicContact CD1-CG 4.49Å; Y142-P193 HydrophobicContact CE1-CB 4.12Å; Y142-P193 HydrophobicContact CE1-CG 3.85Å; Y142-P193 HydrophobicContact CE2-CG 4.33Å; Y142-P193 WeakPolarHBondContact OH-CB 2.8Å; W171-P193 VanDerWaalsContact CD2-CD 3.44Å; W171-P193 HydrophobicContact CD2-CG 4.03Å; W171-P193 HydrophobicContact CE3-CG 3.96Å; W171-P193 HydrophobicContact CH2-CG 3.18Å; W171-P193 HydrophobicContact CZ2-CG 3.2Å; W171-P193 HydrophobicContact CZ3-CG 3.57Å; F177-P193 HydrophobicContact CE1-CB 4.48Å; F177-P193 HydrophobicContact CE1-CG 4.12Å; F177-P193 HydrophobicContact CE2-CG 3.98Å; F177-P193 HydrophobicContact CZ-CB 4.02Å; F177-P193 HydrophobicContact CZ-CG 3.59Å; P193-S195 PolarHBondContact O-N 3.35Å; P193-S195 VanDerWaalsContact O-N 3.11Å; P193-C196 WeakPolarHBondContact O-CB 3.24Å; P193-C196 PolarHBondContact O-N 3.41Å | ||
| 194 | F | 93.5 | Very high | 89 | Confident | 25 Ų | 25 | 51.5 Ų | 51.5 | 11% | 0.11 | 30% | 0.297 | C | S | . | . | G | 310 helix | trans | -60.5 | -23 | 179.8 | 77.7 | -83.1 | 0 | 0 | 0 | 113.4 | D153 C196 C197 I206 Y208 | D153-F194 VanDerWaalsContact OD2-CE1 3.3Å; D153-F194 WeakPolarHBondContact OD2-CE1 3.3Å; D153-F194 WeakPolarHBondContact OD2-CZ 3.37Å; F194-C196 PolarHBondContact O-N 3.25Å; F194-C197 VanDerWaalsContact O-CB 3.27Å; F194-C197 WeakPolarHBondContact O-CB 3.3Å; F194-C197 PolarHBondContact O-N 2.97Å; F194-C197 VanDerWaalsContact O-N 3.09Å; F194-I206 HydrophobicContact CD2-CG2 3.53Å; F194-I206 HydrophobicContact CE2-CG2 3.74Å; F194-I206 HydrophobicContact CG-CG2 4.34Å; F194-Y208 HydrophobicContact CB-CD1 4.28Å; F194-Y208 AromaticContact CD1-CD1 3.47Å; F194-Y208 HydrophobicContact CD1-CD1 3.47Å; F194-Y208 VanDerWaalsContact CD1-CD1 3.47Å; F194-Y208 AromaticContact CD1-CE1 3.72Å; F194-Y208 HydrophobicContact CD1-CE1 3.72Å; F194-Y208 HydrophobicContact CD2-CD1 4.29Å; F194-Y208 HydrophobicContact CD2-CE1 4.29Å; F194-Y208 AromaticContact CE1-CD1 3.86Å; F194-Y208 HydrophobicContact CE1-CD1 3.86Å; F194-Y208 AromaticContact CE1-CE1 3.59Å; F194-Y208 HydrophobicContact CE1-CE1 3.59Å; F194-Y208 HydrophobicContact CE2-CE1 4.17Å; F194-Y208 AromaticContact CG-CD1 3.72Å; F194-Y208 HydrophobicContact CG-CD1 3.72Å; F194-Y208 HydrophobicContact CG-CE1 4.08Å; F194-Y208 HydrophobicContact CZ-CD1 4.41Å; F194-Y208 AromaticContact CZ-CE1 3.83Å; F194-Y208 HydrophobicContact CZ-CE1 3.83Å |
| 195 | S | 95 | Very high | 88.6 | Confident | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 29% | 0.291 | C | S | . | . | G | 310 helix | trans | -66.9 | -22.3 | 176.5 | 49.4 | 0 | 0 | 0 | 0 | 113.1 | D153 Q156 P193 C197 | D153-S195 VanDerWaalsContact CA-CB 3.49Å; D153-S195 VanDerWaalsContact OD1-CB 3.23Å; D153-S195 WeakPolarHBondContact OD1-CB 3.32Å; D153-S195 PolarHBondContact OD1-OG 3.12Å; Q156-S195 PolarHBondContact OE1-OG 2.67Å; P193-S195 PolarHBondContact O-N 3.35Å; P193-S195 VanDerWaalsContact O-N 3.11Å; S195-C197 PolarHBondContact O-N 2.96Å |
| 196 | C | 95.5 | Very high | 88.2 | Confident | 0 Ų | 0 | 50.4 Ų | 50.4 | 0% | 0 | 28% | 0.276 | C | S | . | . | G | 310 helix | trans | -73.6 | -7.8 | 170.3 | -73.2 | 0 | 0 | 0 | 0 | 114 | Q156 C163 W171 V192 P193 F194 I224 F225 | Q156-C196 PolarHBondContact OE1-SG 3.23Å; Q156-C196 VanDerWaalsContact OE1-SG 3.35Å; C163-C196 WeakPolarHBondContact CA-SG 3.49Å; C163-C196 HydrophobicContact CB-CB 3.65Å; C163-C196 WeakPolarHBondContact CB-SG 3.49Å; C163-C196 WeakPolarHBondContact SG-CB 3.34Å; C163-C196 CovalentContact SG-SG 2.04Å; C163-C196 PolarHBondContact SG-SG 2.78Å; W171-C196 PolarHBondContact NE1-SG 3.27Å; W171-C196 VanDerWaalsContact NE1-SG 3.44Å; V192-C196 HydrophobicContact CB-CB 4.07Å; V192-C196 HydrophobicContact CG2-CB 3.6Å; P193-C196 WeakPolarHBondContact O-CB 3.24Å; P193-C196 PolarHBondContact O-N 3.41Å; F194-C196 PolarHBondContact O-N 3.25Å; C196-I224 CarbonylContact O-C 3.54Å; C196-I224 VanDerWaalsContact O-CA 3.3Å; C196-I224 WeakPolarHBondContact O-CA 3.38Å; C196-I224 WeakPolarHBondContact O-CB 3.44Å; C196-F225 WeakPolarHBondContact O-CD2 3.19Å; C196-F225 PolarHBondContact O-N 2.87Å |
| 197 | C | 93.8 | Very high | 88 | Confident | 2 Ų | 2 | 51.3 Ų | 51.3 | 1% | 0.014 | 28% | 0.28 | C | S | . | . | B | Isolated β-bridge | trans | -84 | 131.8 | -177.1 | -74.3 | 0 | 0 | 0 | 0 | 113 | F194 S195 S199 C210 | F194-C197 VanDerWaalsContact O-CB 3.27Å; F194-C197 WeakPolarHBondContact O-CB 3.3Å; F194-C197 PolarHBondContact O-N 2.97Å; F194-C197 VanDerWaalsContact O-N 3.09Å; S195-C197 PolarHBondContact O-N 2.96Å; C197-S199 VanDerWaalsContact C-N 3.34Å; C197-S199 PolarHBondContact O-N 3.37Å; C197-C210 HydrophobicContact CB-CB 3.9Å; C197-C210 WeakPolarHBondContact CB-SG 3.37Å; C197-C210 WeakPolarHBondContact SG-CB 3.27Å; C197-C210 CovalentContact SG-SG 2.03Å; C197-C210 PolarHBondContact SG-SG 3.38Å |
| 198 | K | 91 | Very high | 87.8 | Confident | 116 Ų | 116 | 52.7 Ų | 52.7 | 50% | 0.504 | 27% | 0.273 | S | S | . | . | S | Bend | trans | -61.5 | -41.3 | 177 | -70.2 | 177.7 | 179.4 | 164.7 | 0 | 112.5 | S222 N223 I224 F225 | K198-S222 WeakPolarHBondContact CD-O 3.23Å; K198-S222 WeakPolarHBondContact CE-O 3.3Å; K198-S222 PolarHBondContact NZ-O 3.42Å; K198-N223 WeakPolarHBondContact CB-O 3.3Å; K198-N223 PolarHBondContact N-O 2.62Å; K198-I224 VanDerWaalsContact CE-O 3.23Å; K198-I224 WeakPolarHBondContact CE-O 3.1Å; K198-F225 HydrophobicContact CB-CE1 4.29Å; K198-F225 HydrophobicContact CB-CZ 4.38Å; K198-F225 HydrophobicContact CG-CD1 3.72Å; K198-F225 HydrophobicContact CG-CE1 3.55Å; K198-F225 HydrophobicContact CG-CG 4.35Å; K198-F225 HydrophobicContact CG-CZ 4.05Å |
| 199 | S | 82.6 | Confident | 87.6 | Confident | 81 Ų | 81 | 59.5 Ų | 59.5 | 57% | 0.566 | 30% | 0.298 | S | S | * | . | trans | -120 | 88.6 | 172.6 | -169.1 | 0 | 0 | 0 | 0 | 109 | C197 K201 | C197-S199 VanDerWaalsContact C-N 3.34Å; C197-S199 PolarHBondContact O-N 3.37Å; S199-K201 VanDerWaalsContact C-N 3.29Å | ||
| 200 | S | 72.6 | Confident | 87.4 | Confident | 9 Ų | 9 | 60.7 Ų | 60.7 | 6% | 0.063 | 31% | 0.306 | C | S | . | . | trans | -84.5 | -1 | 175.5 | 56.6 | 0 | 0 | 0 | 0 | 112.8 | K157 I206 N207 | K157-S200 WeakPolarHBondContact CE-OG 3.34Å; K157-S200 PolarHBondContact NZ-OG 3.4Å; K157-S200 VanDerWaalsContact NZ-OG 3.1Å; S200-I206 CarbonylContact O-C 3.27Å; S200-I206 VanDerWaalsContact O-CA 3.24Å; S200-I206 WeakPolarHBondContact O-CA 3.48Å; S200-N207 PolarHBondContact O-N 2.89Å | ||
| 201 | K | 76.9 | Confident | 87.3 | Confident | 123 Ų | 123 | 60.7 Ų | 60.7 | 54% | 0.535 | 31% | 0.306 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.4 | 126.5 | 179.3 | -68.3 | -175.6 | -179 | -179.4 | 0 | 111.8 | S199 L205 | S199-K201 VanDerWaalsContact C-N 3.29Å; K201-L205 CarbonylContact C-O 3.59Å; K201-L205 VanDerWaalsContact CA-O 3.22Å; K201-L205 WeakPolarHBondContact CA-O 3.32Å |
| 202 | I | 75.7 | Confident | 87.2 | Confident | 98 Ų | 98 | 63.3 Ų | 63.3 | 50% | 0.503 | 32% | 0.318 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.5 | 117.4 | 168.3 | -58.6 | 175.5 | 0 | 0 | 0 | 105.8 | G204 L205 N207 | I202-G204 PolarHBondContact O-N 2.92Å; I202-G204 VanDerWaalsContact O-N 3.11Å; I202-L205 PolarHBondContact N-O 3.18Å; I202-L205 PolarHBondContact O-N 2.76Å; I202-N207 HydrophobicContact CD1-CB 3.97Å; I202-N207 WeakPolarHBondContact CD1-ND2 3.21Å; I202-N207 HydrophobicContact CG1-CB 4.2Å |
| 203 | E | 79.7 | Confident | 86.9 | Confident | 190 Ų | 190 | 63.9 Ų | 63.9 | 89% | 0.888 | 32% | 0.324 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.3 | 31.5 | -179.5 | -59.1 | -178.2 | 165.3 | 0 | 0 | 114.4 | L205 | E203-L205 VanDerWaalsContact C-N 3.28Å; E203-L205 PolarHBondContact O-N 2.74Å |
| 204 | G | 79 | Confident | 86.7 | Confident | 59 Ų | 59 | 64.1 Ų | 64.1 | 61% | 0.608 | 33% | 0.326 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 85.7 | -12.9 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | I202 | I202-G204 PolarHBondContact O-N 2.92Å; I202-G204 VanDerWaalsContact O-N 3.11Å |
| 205 | L | 82.7 | Confident | 86.6 | Confident | 127 Ų | 127 | 64.6 Ų | 64.6 | 67% | 0.665 | 33% | 0.327 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -87.2 | 142.8 | 174.8 | -74.7 | 80.4 | 0 | 0 | 0 | 111.1 | K201 I202 E203 N207 | K201-L205 CarbonylContact C-O 3.59Å; K201-L205 VanDerWaalsContact CA-O 3.22Å; K201-L205 WeakPolarHBondContact CA-O 3.32Å; I202-L205 PolarHBondContact N-O 3.18Å; I202-L205 PolarHBondContact O-N 2.76Å; E203-L205 VanDerWaalsContact C-N 3.28Å; E203-L205 PolarHBondContact O-N 2.74Å; L205-N207 PolarHBondContact O-N 2.65Å |
| 206 | I | 82.8 | Confident | 86.3 | Confident | 62 Ų | 62 | 69.4 Ų | 69.4 | 32% | 0.318 | 35% | 0.347 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.3 | 121.8 | 177.6 | -60 | 173.5 | 0 | 0 | 0 | 109.5 | F194 S200 Y208 | F194-I206 HydrophobicContact CD2-CG2 3.53Å; F194-I206 HydrophobicContact CE2-CG2 3.74Å; F194-I206 HydrophobicContact CG-CG2 4.34Å; S200-I206 CarbonylContact O-C 3.27Å; S200-I206 VanDerWaalsContact O-CA 3.24Å; S200-I206 WeakPolarHBondContact O-CA 3.48Å; I206-Y208 HydrophobicContact CB-CD2 4.3Å; I206-Y208 HydrophobicContact CB-CE2 3.76Å; I206-Y208 HydrophobicContact CG2-CD1 4.3Å; I206-Y208 HydrophobicContact CG2-CD2 4.07Å; I206-Y208 HydrophobicContact CG2-CE1 4.02Å; I206-Y208 HydrophobicContact CG2-CE2 3.77Å; I206-Y208 HydrophobicContact CG2-CG 4.32Å; I206-Y208 WeakPolarHBondContact O-CD2 3.48Å; I206-Y208 PolarHBondContact O-N 2.64Å |
| 207 | N | 87.7 | Confident | 85.7 | Confident | 43 Ų | 43 | 76.4 Ų | 76.4 | 23% | 0.23 | 38% | 0.378 | C | S | . | . | trans | -82.8 | 89.6 | 172.9 | -178.4 | 6.5 | 0 | 0 | 0 | 110.3 | S200 I202 L205 Y209 C210 | S200-N207 PolarHBondContact O-N 2.89Å; I202-N207 HydrophobicContact CD1-CB 3.97Å; I202-N207 WeakPolarHBondContact CD1-ND2 3.21Å; I202-N207 HydrophobicContact CG1-CB 4.2Å; L205-N207 PolarHBondContact O-N 2.65Å; N207-Y209 PolarHBondContact O-N 2.85Å; N207-Y209 WeakPolarHBondContact OD1-CB 2.95Å; N207-Y209 PolarHBondContact OD1-N 3.41Å; N207-C210 HydrophobicContact CB-CB 4.46Å; N207-C210 PolarHBondContact O-N 3.38Å; N207-C210 PolarHBondContact OD1-N 3.31Å | ||
| 208 | Y | 88.1 | Confident | 85 | Confident | 129 Ų | 129 | 81.6 Ų | 81.6 | 51% | 0.506 | 42% | 0.422 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.2 | -19.9 | 175.8 | -68.8 | -82.1 | 0 | 0 | 0 | 113.5 | F194 I206 | F194-Y208 HydrophobicContact CB-CD1 4.28Å; F194-Y208 AromaticContact CD1-CD1 3.47Å; F194-Y208 HydrophobicContact CD1-CD1 3.47Å; F194-Y208 VanDerWaalsContact CD1-CD1 3.47Å; F194-Y208 AromaticContact CD1-CE1 3.72Å; F194-Y208 HydrophobicContact CD1-CE1 3.72Å; F194-Y208 HydrophobicContact CD2-CD1 4.29Å; F194-Y208 HydrophobicContact CD2-CE1 4.29Å; F194-Y208 AromaticContact CE1-CD1 3.86Å; F194-Y208 HydrophobicContact CE1-CD1 3.86Å; F194-Y208 AromaticContact CE1-CE1 3.59Å; F194-Y208 HydrophobicContact CE1-CE1 3.59Å; F194-Y208 HydrophobicContact CE2-CE1 4.17Å; F194-Y208 AromaticContact CG-CD1 3.72Å; F194-Y208 HydrophobicContact CG-CD1 3.72Å; F194-Y208 HydrophobicContact CG-CE1 4.08Å; F194-Y208 HydrophobicContact CZ-CD1 4.41Å; F194-Y208 AromaticContact CZ-CE1 3.83Å; F194-Y208 HydrophobicContact CZ-CE1 3.83Å; I206-Y208 HydrophobicContact CB-CD2 4.3Å; I206-Y208 HydrophobicContact CB-CE2 3.76Å; I206-Y208 HydrophobicContact CG2-CD1 4.3Å; I206-Y208 HydrophobicContact CG2-CD2 4.07Å; I206-Y208 HydrophobicContact CG2-CE1 4.02Å; I206-Y208 HydrophobicContact CG2-CE2 3.77Å; I206-Y208 HydrophobicContact CG2-CG 4.32Å; I206-Y208 WeakPolarHBondContact O-CD2 3.48Å; I206-Y208 PolarHBondContact O-N 2.64Å |
| 209 | Y | 89.6 | Confident | 84.6 | Confident | 178 Ų | 178 | 83.2 Ų | 83.2 | 70% | 0.698 | 43% | 0.434 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.9 | -10.1 | -176.4 | -69.7 | -82.3 | 0 | 0 | 0 | 114.5 | N207 G211 H212 | N207-Y209 PolarHBondContact O-N 2.85Å; N207-Y209 WeakPolarHBondContact OD1-CB 2.95Å; N207-Y209 PolarHBondContact OD1-N 3.41Å; Y209-G211 PolarHBondContact O-N 3.49Å; Y209-G211 VanDerWaalsContact O-N 3.12Å; Y209-H212 WeakPolarHBondContact O-CB 3.38Å; Y209-H212 PolarHBondContact O-N 3.41Å |
| 210 | C | 90.5 | Very high | 84.7 | Confident | 26 Ų | 26 | 81.8 Ų | 81.8 | 18% | 0.176 | 42% | 0.42 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -56.7 | -33.7 | -173.5 | 161.9 | 0 | 0 | 0 | 0 | 113.8 | C197 N207 V214 | C197-C210 HydrophobicContact CB-CB 3.9Å; C197-C210 WeakPolarHBondContact CB-SG 3.37Å; C197-C210 WeakPolarHBondContact SG-CB 3.27Å; C197-C210 CovalentContact SG-SG 2.03Å; C197-C210 PolarHBondContact SG-SG 3.38Å; N207-C210 HydrophobicContact CB-CB 4.46Å; N207-C210 PolarHBondContact O-N 3.38Å; N207-C210 PolarHBondContact OD1-N 3.31Å; C210-V214 WeakPolarHBondContact O-CG1 3.46Å |
| 211 | G | 91.3 | Very high | 85.1 | Confident | 0 Ų | 0 | 83.2 Ų | 83.2 | 0% | 0 | 43% | 0.43 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -88.5 | -3.4 | -179.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | G191 V192 Y209 G213 V214 | G191-G211 CarbonylContact C-O 3.54Å; G191-G211 WeakPolarHBondContact CA-O 3.45Å; V192-G211 PolarHBondContact N-O 3.49Å; V192-G211 CarbonylContact O-C 3.53Å; V192-G211 WeakPolarHBondContact O-CA 3.48Å; Y209-G211 PolarHBondContact O-N 3.49Å; Y209-G211 VanDerWaalsContact O-N 3.12Å; G211-G213 PolarHBondContact O-N 2.91Å; G211-V214 WeakPolarHBondContact O-CG2 3.13Å |
| 212 | H | 91.9 | Very high | 85.6 | Confident | 55 Ų | 55 | 81.2 Ų | 81.2 | 26% | 0.255 | 43% | 0.432 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.1 | 131.7 | -175.3 | -80.5 | -120.3 | 0 | 0 | 0 | 112.2 | P187 Y209 V214 | P187-H212 PolarHBondContact O-CE1 3.43Å; P187-H212 PolarHBondContact O-ND1 3.37Å; Y209-H212 WeakPolarHBondContact O-CB 3.38Å; Y209-H212 PolarHBondContact O-N 3.41Å; H212-V214 PolarHBondContact O-N 3.39Å |
| 213 | G | 90.1 | Very high | 86.2 | Confident | 14 Ų | 14 | 81.4 Ų | 81.4 | 14% | 0.144 | 43% | 0.433 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 63.8 | 5.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 115.8 | G190 G211 R215 K216 F217 | G190-G213 CarbonylContact O-C 3.2Å; G190-G213 WeakPolarHBondContact O-CA 3.44Å; G211-G213 PolarHBondContact O-N 2.91Å; G213-R215 PolarHBondContact O-N 2.88Å; G213-R215 VanDerWaalsContact O-N 3.12Å; G213-K216 WeakPolarHBondContact O-CB 3.34Å; G213-K216 PolarHBondContact O-N 3.36Å; G213-F217 WeakPolarHBondContact O-CD2 3.41Å; G213-F217 WeakPolarHBondContact O-CE2 3.49Å |
| 214 | V | 91.2 | Very high | 86.8 | Confident | 9 Ų | 9 | 72.3 Ų | 72.3 | 6% | 0.055 | 39% | 0.391 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -63.1 | -22 | -174 | -60.9 | 0 | 0 | 0 | 0 | 113.6 | G190 V192 C210 G211 H212 I224 | G190-V214 PolarHBondContact O-N 3.09Å; V192-V214 HydrophobicContact CG1-CG2 4.18Å; V192-V214 HydrophobicContact CG2-CG2 3.87Å; C210-V214 WeakPolarHBondContact O-CG1 3.46Å; G211-V214 WeakPolarHBondContact O-CG2 3.13Å; H212-V214 PolarHBondContact O-N 3.39Å; V214-I224 HydrophobicContact CG1-CG2 4.46Å; V214-I224 HydrophobicContact CG2-CD1 3.88Å |
| 215 | R | 91.9 | Very high | 87.5 | Confident | 36 Ų | 36 | 70.7 Ų | 70.7 | 14% | 0.136 | 37% | 0.367 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -93.4 | -3.7 | 177.5 | -55.2 | -175.1 | -71.9 | 117.5 | 1.9 | 113.2 | P168 D172 F177 G190 G191 V192 G213 F217 L220 | P168-R215 WeakPolarHBondContact O-CD 3.17Å; D172-R215 IonicContact OD1-CZ 3.62Å; D172-R215 IonicContact OD1-NH1 3.5Å; D172-R215 PolarHBondContact OD1-NH1 3.04Å; D172-R215 IonicContact OD1-NH2 2.78Å; D172-R215 IonicContact OD2-NH1 2.58Å; D172-R215 PolarHBondContact OD2-NH1 3.11Å; F177-R215 PolarHBondContact O-NH2 3.16Å; G190-R215 WeakPolarHBondContact O-CA 3.47Å; G190-R215 VanDerWaalsContact O-CB 3.25Å; G190-R215 WeakPolarHBondContact O-CB 3.5Å; G190-R215 PolarHBondContact O-N 3.31Å; G191-R215 PolarHBondContact O-NE 3.19Å; G191-R215 PolarHBondContact O-NH2 3.22Å; V192-R215 HydrophobicContact CG1-CG 4.2Å; G213-R215 PolarHBondContact O-N 2.88Å; G213-R215 VanDerWaalsContact O-N 3.12Å; R215-F217 VanDerWaalsContact C-N 3.32Å; R215-L220 HydrophobicContact CG-CD1 4.09Å |
| 216 | K | 87.4 | Confident | 87.9 | Confident | 100 Ų | 100 | 69.6 Ų | 69.6 | 44% | 0.435 | 36% | 0.359 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.7 | -21.3 | 172.7 | -60.4 | -169.8 | -177 | -170.9 | 0 | 112.7 | E182 A189 G213 | E182-K216 IonicContact OE1-NZ 2.78Å; E182-K216 PolarHBondContact OE1-NZ 2.89Å; E182-K216 IonicContact OE2-NZ 2.81Å; E182-K216 PolarHBondContact OE2-NZ 3.43Å; A189-K216 WeakPolarHBondContact O-CE 3.45Å; G213-K216 WeakPolarHBondContact O-CB 3.34Å; G213-K216 PolarHBondContact O-N 3.36Å |
| 217 | F | 83.8 | Confident | 88.4 | Confident | 147 Ų | 147 | 72.5 Ų | 72.5 | 65% | 0.645 | 37% | 0.371 | S | S | * | . | S | Bend | trans | -86.4 | 143.5 | 177.8 | -56.5 | -79.8 | 0 | 0 | 0 | 110.4 | G213 R215 I219 | G213-F217 WeakPolarHBondContact O-CD2 3.41Å; G213-F217 WeakPolarHBondContact O-CE2 3.49Å; R215-F217 VanDerWaalsContact C-N 3.32Å; F217-I219 PolarHBondContact O-N 2.91Å |
| 218 | A | 78.6 | Confident | 88.6 | Confident | 112 Ų | 112 | 70.7 Ų | 70.7 | 93% | 0.926 | 36% | 0.363 | S | S | * | . | S | Bend | trans | -61.5 | -28.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 219 | I | 82.1 | Confident | 88.9 | Confident | 149 Ų | 149 | 65.1 Ų | 65.1 | 76% | 0.764 | 34% | 0.342 | S | S | * | . | S | Bend | trans | -108.2 | 117.8 | 176.1 | -58.1 | 174.7 | 0 | 0 | 0 | 107.8 | F217 S221 | F217-I219 PolarHBondContact O-N 2.91Å; I219-S221 PolarHBondContact O-N 2.85Å |
| 220 | L | 84.4 | Confident | 88.9 | Confident | 51 Ų | 51 | 58.1 Ų | 58.1 | 27% | 0.267 | 32% | 0.317 | S | S | . | . | trans | -64.2 | 133.6 | 177.4 | -165.7 | 67.6 | 0 | 0 | 0 | 110.4 | P168 R215 S222 I224 Q226 | P168-L220 HydrophobicContact CB-CD2 4.04Å; P168-L220 HydrophobicContact CG-CD2 3.83Å; R215-L220 HydrophobicContact CG-CD1 4.09Å; L220-S222 PolarHBondContact O-N 3.09Å; L220-I224 HydrophobicContact CD1-CD1 3.65Å; L220-I224 HydrophobicContact CD2-CD1 3.95Å; L220-I224 HydrophobicContact CD2-CG1 4.41Å; L220-I224 HydrophobicContact CG-CD1 3.73Å; L220-I224 HydrophobicContact CG-CG1 4.22Å; L220-Q226 HydrophobicContact CD2-CG 4.05Å | ||
| 221 | S | 82.2 | Confident | 88.7 | Confident | 39 Ų | 39 | 58.3 Ų | 58.3 | 27% | 0.273 | 32% | 0.323 | S | S | . | . | trans | -55.7 | 137.6 | -178.1 | -176 | 0 | 0 | 0 | 0 | 112.2 | I219 N223 I224 | I219-S221 PolarHBondContact O-N 2.85Å; S221-N223 PolarHBondContact O-N 2.03Å; S221-N223 PolarHBondContact OG-N 3.16Å; S221-I224 WeakPolarHBondContact O-CG1 3.33Å | ||
| 222 | S | 86.1 | Confident | 88.6 | Confident | 82 Ų | 82 | 61 Ų | 61 | 57% | 0.573 | 34% | 0.335 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.3 | -12.4 | 173.8 | 57.3 | 0 | 0 | 0 | 0 | 113 | K198 L220 I224 | K198-S222 WeakPolarHBondContact CD-O 3.23Å; K198-S222 WeakPolarHBondContact CE-O 3.3Å; K198-S222 PolarHBondContact NZ-O 3.42Å; L220-S222 PolarHBondContact O-N 3.09Å; S222-I224 VanDerWaalsContact C-N 3.33Å |
| 223 | N | 88.2 | Confident | 88.3 | Confident | 101 Ų | 101 | 60 Ų | 60 | 54% | 0.54 | 34% | 0.337 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.6 | -8.2 | -178.2 | -67.3 | -23.1 | 0 | 0 | 0 | 114.1 | K198 S221 | K198-N223 WeakPolarHBondContact CB-O 3.3Å; K198-N223 PolarHBondContact N-O 2.62Å; S221-N223 PolarHBondContact O-N 2.03Å; S221-N223 PolarHBondContact OG-N 3.16Å |
| 224 | I | 92.9 | Very high | 87.8 | Confident | 0 Ų | 0 | 61.3 Ų | 61.3 | 0% | 0 | 34% | 0.339 | C | S | . | . | B | Isolated β-bridge | trans | -108.6 | 157.4 | 175.9 | 70.3 | 172 | 0 | 0 | 0 | 111.4 | P168 V192 C196 K198 V214 L220 S221 S222 | P168-I224 HydrophobicContact CB-CD1 4.23Å; P168-I224 HydrophobicContact CG-CD1 4.3Å; V192-I224 HydrophobicContact CG2-CD1 4.28Å; V192-I224 HydrophobicContact CG2-CG2 4.21Å; C196-I224 CarbonylContact O-C 3.54Å; C196-I224 VanDerWaalsContact O-CA 3.3Å; C196-I224 WeakPolarHBondContact O-CA 3.38Å; C196-I224 WeakPolarHBondContact O-CB 3.44Å; K198-I224 VanDerWaalsContact CE-O 3.23Å; K198-I224 WeakPolarHBondContact CE-O 3.1Å; V214-I224 HydrophobicContact CG1-CG2 4.46Å; V214-I224 HydrophobicContact CG2-CD1 3.88Å; L220-I224 HydrophobicContact CD1-CD1 3.65Å; L220-I224 HydrophobicContact CD2-CD1 3.95Å; L220-I224 HydrophobicContact CD2-CG1 4.41Å; L220-I224 HydrophobicContact CG-CD1 3.73Å; L220-I224 HydrophobicContact CG-CG1 4.22Å; S221-I224 WeakPolarHBondContact O-CG1 3.33Å; S222-I224 VanDerWaalsContact C-N 3.33Å |
| 225 | F | 94.2 | Very high | 87.3 | Confident | 25 Ų | 25 | 64.1 Ų | 64.1 | 11% | 0.11 | 36% | 0.359 | C | S | . | . | trans | -67.8 | 132.5 | 168.3 | -58.2 | -64 | 0 | 0 | 0 | 109.5 | H161 C163 P168 C196 K198 | H161-F225 VanDerWaalsContact C-CG 3.41Å; H161-F225 HydrophobicContact CB-CD1 3.94Å; H161-F225 HydrophobicContact CB-CE1 3.45Å; H161-F225 VanDerWaalsContact CB-CE1 3.45Å; H161-F225 HydrophobicContact CB-CE2 4.35Å; H161-F225 HydrophobicContact CB-CZ 3.69Å; H161-F225 AromaticContact CG-CE1 3.99Å; H161-F225 AromaticContact CG-CZ 3.88Å; H161-F225 AromaticContact ND1-CZ 3.52Å; H161-F225 WeakPolarHBondContact O-CD1 3.43Å; H161-F225 WeakPolarHBondContact O-CG 3.19Å; C163-F225 HydrophobicContact CB-CB 4.12Å; C163-F225 VanDerWaalsContact CB-O 3.25Å; C163-F225 WeakPolarHBondContact CB-O 3.01Å; P168-F225 VanDerWaalsContact CG-O 3.3Å; P168-F225 WeakPolarHBondContact CG-O 3.39Å; C196-F225 WeakPolarHBondContact O-CD2 3.19Å; C196-F225 PolarHBondContact O-N 2.87Å; K198-F225 HydrophobicContact CB-CE1 4.29Å; K198-F225 HydrophobicContact CB-CZ 4.38Å; K198-F225 HydrophobicContact CG-CD1 3.72Å; K198-F225 HydrophobicContact CG-CE1 3.55Å; K198-F225 HydrophobicContact CG-CG 4.35Å; K198-F225 HydrophobicContact CG-CZ 4.05Å | ||
| 226 | Q | 91.4 | Very high | 87 | Confident | 103 Ų | 103 | 67.1 Ų | 67.1 | 48% | 0.481 | 37% | 0.37 | S | S | . | . | trans | -101.2 | -18.2 | -178.4 | -61.5 | -173.3 | -15.8 | 0 | 0 | 112.4 | P168 L220 | P168-Q226 VanDerWaalsContact CD-O 3.31Å; P168-Q226 WeakPolarHBondContact CD-O 3.41Å; L220-Q226 HydrophobicContact CD2-CG 4.05Å | ||
| 227 | E | 92.2 | Very high | 86.4 | Confident | 124 Ų | 124 | 65.6 Ų | 65.6 | 58% | 0.579 | 37% | 0.367 | S | S | * | . | S | Bend | trans | -84.1 | 136.6 | -179.6 | -59.5 | -61.4 | 150.3 | 0 | 0 | 111.1 | C162 C163 Q232 | C162-E227 CarbonylContact C-O 3.36Å; C162-E227 VanDerWaalsContact CA-O 3.3Å; C162-E227 WeakPolarHBondContact CA-O 3.28Å; C162-E227 WeakPolarHBondContact CB-O 3.43Å; C163-E227 PolarHBondContact N-O 3.08Å; E227-Q232 HydrophobicContact CB-CG 3.8Å |
| 228 | G | 92.8 | Very high | 85.7 | Confident | 5 Ų | 5 | 63.1 Ų | 63.1 | 5% | 0.052 | 36% | 0.358 | C | S | . | . | trans | -68.5 | 146.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | I165 N166 L230 G231 Q232 | I165-G228 CarbonylContact O-C 3.42Å; I165-G228 VanDerWaalsContact O-C 3.27Å; I165-G228 VanDerWaalsContact O-CA 3.31Å; I165-G228 WeakPolarHBondContact O-CA 3.21Å; N166-G228 VanDerWaalsContact C-CA 3.44Å; N166-G228 WeakPolarHBondContact O-CA 3.47Å; N166-G228 PolarHBondContact O-N 3.02Å; G228-L230 VanDerWaalsContact C-N 3.31Å; G228-L230 PolarHBondContact O-N 3.45Å; G228-G231 PolarHBondContact O-N 3.05Å; G228-Q232 WeakPolarHBondContact O-CG 3.38Å; G228-Q232 PolarHBondContact O-N 3.44Å | ||
| 229 | C | 93.9 | Very high | 85.7 | Confident | 12 Ų | 12 | 65.6 Ų | 65.6 | 8% | 0.081 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -66.4 | -30.8 | 179.8 | -63.6 | 0 | 0 | 0 | 0 | 113.4 | I155 Q156 L160 C162 G164 I165 Q232 A233 | I155-C229 HydrophobicContact CG2-CB 4.33Å; Q156-C229 VanDerWaalsContact CG-SG 3.5Å; L160-C229 HydrophobicContact CD1-CB 4.46Å; C162-C229 HydrophobicContact CB-CB 3.89Å; C162-C229 WeakPolarHBondContact CB-SG 3.49Å; C162-C229 WeakPolarHBondContact SG-CA 3.21Å; C162-C229 WeakPolarHBondContact SG-CB 3.22Å; C162-C229 CovalentContact SG-SG 2.03Å; C162-C229 PolarHBondContact SG-SG 3.41Å; G164-C229 WeakPolarHBondContact O-CB 3.49Å; G164-C229 PolarHBondContact O-N 3.14Å; G164-C229 PolarHBondContact O-SG 2.82Å; I165-C229 PolarHBondContact O-N 3.29Å; C229-Q232 PolarHBondContact O-N 3.44Å; C229-A233 WeakPolarHBondContact O-CB 3.48Å; C229-A233 PolarHBondContact O-N 3.23Å |
| 230 | L | 89.3 | Confident | 85.3 | Confident | 31 Ų | 31 | 60.9 Ų | 60.9 | 16% | 0.162 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -62.6 | -45.9 | 174.8 | -177.8 | 60.7 | 0 | 0 | 0 | 110.7 | L135 I165 G228 Q234 | L135-L230 HydrophobicContact CD1-CD1 3.9Å; L135-L230 HydrophobicContact CD1-CD2 4.45Å; I165-L230 HydrophobicContact CG2-CB 3.99Å; I165-L230 HydrophobicContact CG2-CD2 4.28Å; I165-L230 WeakPolarHBondContact O-CB 3.43Å; I165-L230 PolarHBondContact O-N 2.87Å; G228-L230 VanDerWaalsContact C-N 3.31Å; G228-L230 PolarHBondContact O-N 3.45Å; L230-Q234 WeakPolarHBondContact O-CB 3.43Å; L230-Q234 WeakPolarHBondContact O-CG 3.32Å; L230-Q234 PolarHBondContact O-N 3.23Å |
| 231 | G | 85.9 | Confident | 84.5 | Confident | 29 Ų | 29 | 58.9 Ų | 58.9 | 30% | 0.299 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -65.2 | -43.8 | 177 | 0 | 0 | 0 | 0 | 0 | 112.5 | G228 Q234 S235 | G228-G231 PolarHBondContact O-N 3.05Å; G231-Q234 PolarHBondContact O-N 3.35Å; G231-S235 WeakPolarHBondContact O-CB 3.27Å; G231-S235 PolarHBondContact O-N 3.33Å |
| 232 | Q | 89.7 | Confident | 83.5 | Confident | 56 Ų | 56 | 60.9 Ų | 60.9 | 26% | 0.262 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -67.6 | -40 | 178.4 | -71.1 | -78.9 | 76.5 | 0 | 0 | 112.3 | L160 C162 E227 G228 C229 S235 W236 | L160-Q232 HydrophobicContact CB-CB 4.1Å; L160-Q232 PolarHBondContact O-NE2 3.33Å; C162-Q232 HydrophobicContact CB-CB 4.06Å; C162-Q232 HydrophobicContact CB-CG 3.88Å; E227-Q232 HydrophobicContact CB-CG 3.8Å; G228-Q232 WeakPolarHBondContact O-CG 3.38Å; G228-Q232 PolarHBondContact O-N 3.44Å; C229-Q232 PolarHBondContact O-N 3.44Å; Q232-S235 PolarHBondContact O-N 2.92Å; Q232-W236 WeakPolarHBondContact O-CB 3.49Å; Q232-W236 PolarHBondContact O-N 3.39Å |
| 233 | A | 86.9 | Confident | 82.6 | Confident | 35 Ų | 35 | 60.6 Ų | 60.6 | 29% | 0.289 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -62.1 | -45 | 175.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | L160 C229 W236 L237 | L160-A233 HydrophobicContact CD1-CB 3.66Å; C229-A233 WeakPolarHBondContact O-CB 3.48Å; C229-A233 PolarHBondContact O-N 3.23Å; A233-W236 PolarHBondContact O-N 3.46Å; A233-L237 VanDerWaalsContact O-CB 3.29Å; A233-L237 WeakPolarHBondContact O-CB 3.31Å; A233-L237 PolarHBondContact O-N 2.95Å |
| 234 | Q | 78 | Confident | 81.4 | Confident | 41 Ų | 41 | 59.9 Ų | 59.9 | 19% | 0.192 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -60.9 | -48.3 | 174.5 | -73.3 | 170.8 | -1.5 | 0 | 0 | 111 | L230 G231 W236 L237 M238 | L230-Q234 WeakPolarHBondContact O-CB 3.43Å; L230-Q234 WeakPolarHBondContact O-CG 3.32Å; L230-Q234 PolarHBondContact O-N 3.23Å; G231-Q234 PolarHBondContact O-N 3.35Å; Q234-W236 PolarHBondContact O-N 2.72Å; Q234-L237 WeakPolarHBondContact O-CB 3.33Å; Q234-L237 PolarHBondContact O-N 2.75Å; Q234-M238 WeakPolarHBondContact O-CB 3.26Å; Q234-M238 WeakPolarHBondContact O-CG 3.48Å; Q234-M238 PolarHBondContact O-N 2.94Å |
| 235 | S | 82.1 | Confident | 79.7 | Confident | 68 Ų | 68 | 60.3 Ų | 60.3 | 48% | 0.476 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -59.6 | -44.5 | 177.9 | -174.2 | 0 | 0 | 0 | 0 | 112.4 | G231 Q232 M238 K239 | G231-S235 WeakPolarHBondContact O-CB 3.27Å; G231-S235 PolarHBondContact O-N 3.33Å; Q232-S235 PolarHBondContact O-N 2.92Å; S235-M238 PolarHBondContact O-N 2.74Å; S235-K239 WeakPolarHBondContact O-CB 3.5Å; S235-K239 PolarHBondContact O-N 2.93Å |
| 236 | W | 84.2 | Confident | 78 | Confident | 99 Ų | 99 | 62.2 Ų | 62.2 | 38% | 0.375 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -61 | -45.6 | 174.9 | 179.9 | 94.1 | 0 | 0 | 0 | 111.4 | W159 L160 Q232 A233 Q234 K239 N240 | W159-W236 HydrophobicContact CZ2-CD2 4.41Å; W159-W236 HydrophobicContact CZ2-CE3 4.13Å; W159-W236 HydrophobicContact CZ2-CH2 4.18Å; W159-W236 HydrophobicContact CZ2-CZ2 4.42Å; W159-W236 HydrophobicContact CZ2-CZ3 4.02Å; W159-W236 AromaticContact NE1-CE2 3.69Å; W159-W236 AromaticContact NE1-CZ2 3.98Å; W159-W236 AromaticContact NE1-NE1 3.79Å; L160-W236 HydrophobicContact CD2-CB 3.95Å; L160-W236 HydrophobicContact CD2-CG 4.24Å; Q232-W236 WeakPolarHBondContact O-CB 3.49Å; Q232-W236 PolarHBondContact O-N 3.39Å; A233-W236 PolarHBondContact O-N 3.46Å; Q234-W236 PolarHBondContact O-N 2.72Å; W236-K239 PolarHBondContact O-N 3.03Å; W236-N240 HydrophobicContact CZ2-CB 4.46Å; W236-N240 PolarHBondContact NE1-ND2 3.28Å; W236-N240 WeakPolarHBondContact O-CB 3.48Å; W236-N240 PolarHBondContact O-N 3.29Å; W236-N240 PolarHBondContact O-ND2 3.42Å |
| 237 | L | 76 | Confident | 76.6 | Confident | 69 Ų | 69 | 62.8 Ų | 62.8 | 36% | 0.361 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -60.5 | -51 | 177.1 | -179.1 | 65.4 | 0 | 0 | 0 | 110.2 | A233 Q234 K239 N240 V241 | A233-L237 VanDerWaalsContact O-CB 3.29Å; A233-L237 WeakPolarHBondContact O-CB 3.31Å; A233-L237 PolarHBondContact O-N 2.95Å; Q234-L237 WeakPolarHBondContact O-CB 3.33Å; Q234-L237 PolarHBondContact O-N 2.75Å; L237-K239 PolarHBondContact O-N 2.86Å; L237-N240 PolarHBondContact O-N 3.41Å; L237-N240 VanDerWaalsContact O-N 3.16Å; L237-V241 WeakPolarHBondContact O-CA 2.93Å; L237-V241 WeakPolarHBondContact O-CB 3.4Å; L237-V241 PolarHBondContact O-N 2.87Å |
| 238 | M | 69.1 | Low | 74.9 | Confident | 94 Ų | 94 | 58.4 Ų | 58.4 | 46% | 0.463 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -56.4 | -37.2 | 178.2 | -67 | -70.9 | -56.7 | 0 | 0 | 112.9 | Q234 S235 W275 | Q234-M238 WeakPolarHBondContact O-CB 3.26Å; Q234-M238 WeakPolarHBondContact O-CG 3.48Å; Q234-M238 PolarHBondContact O-N 2.94Å; S235-M238 PolarHBondContact O-N 2.74Å; M238-W275 HydrophobicContact CE-CB 4.18Å; M238-W275 HydrophobicContact CE-CG 3.8Å; M238-W275 HydrophobicContact SD-CB 3.67Å; M238-W275 HydrophobicContact SD-CD2 3.8Å; M238-W275 HydrophobicContact SD-CG 3.15Å; M238-W275 PolarHBondContact SD-NE1 2.79Å; M238-W275 VanDerWaalsContact SD-NE1 3.42Å |
| 239 | K | 77.6 | Confident | 72.8 | Confident | 165 Ų | 165 | 62 Ų | 62 | 72% | 0.717 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -75 | -37.7 | 179.5 | -173.2 | 178.5 | 179.7 | -177.4 | 0 | 112.6 | S235 W236 L237 | S235-K239 WeakPolarHBondContact O-CB 3.5Å; S235-K239 PolarHBondContact O-N 2.93Å; W236-K239 PolarHBondContact O-N 3.03Å; L237-K239 PolarHBondContact O-N 2.86Å |
| 240 | N | 75 | Confident | 70.8 | Confident | 49 Ų | 49 | 64.7 Ų | 64.7 | 26% | 0.262 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -98.7 | -10.2 | -174.2 | -67.8 | -77.8 | 0 | 0 | 0 | 113.5 | W236 L237 T242 V243 L244 | W236-N240 HydrophobicContact CZ2-CB 4.46Å; W236-N240 PolarHBondContact NE1-ND2 3.28Å; W236-N240 WeakPolarHBondContact O-CB 3.48Å; W236-N240 PolarHBondContact O-N 3.29Å; W236-N240 PolarHBondContact O-ND2 3.42Å; L237-N240 PolarHBondContact O-N 3.41Å; L237-N240 VanDerWaalsContact O-N 3.16Å; N240-T242 VanDerWaalsContact C-N 3.27Å; N240-T242 PolarHBondContact O-N 2.88Å; N240-V243 WeakPolarHBondContact O-CA 3.45Å; N240-V243 WeakPolarHBondContact O-CB 3.39Å; N240-V243 PolarHBondContact O-N 2.93Å; N240-L244 PolarHBondContact O-N 2.78Å |
| 241 | V | 67.2 | Low | 69.2 | Low | 9 Ų | 9 | 69 Ų | 69 | 6% | 0.055 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -66.8 | -30.7 | -176.3 | 70.1 | 0 | 0 | 0 | 0 | 112.4 | L237 V243 L244 C245 W275 | L237-V241 WeakPolarHBondContact O-CA 2.93Å; L237-V241 WeakPolarHBondContact O-CB 3.4Å; L237-V241 PolarHBondContact O-N 2.87Å; V241-V243 VanDerWaalsContact C-N 3.26Å; V241-V243 PolarHBondContact O-N 3.32Å; V241-L244 PolarHBondContact O-N 2.98Å; V241-C245 WeakPolarHBondContact O-CB 3.29Å; V241-C245 PolarHBondContact O-N 3.46Å; V241-C245 PolarHBondContact O-SG 3.1Å; V241-W275 HydrophobicContact CB-CZ2 3.81Å; V241-W275 HydrophobicContact CG1-CZ2 3.56Å; V241-W275 HydrophobicContact CG2-CH2 3.73Å; V241-W275 HydrophobicContact CG2-CZ2 3.32Å |
| 242 | T | 60.2 | Low | 67.3 | Low | 82 Ų | 82 | 70.2 Ų | 70.2 | 50% | 0.503 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -62.3 | -36.9 | 171.5 | 52.2 | 0 | 0 | 0 | 0 | 111.3 | N240 S246 | N240-T242 VanDerWaalsContact C-N 3.27Å; N240-T242 PolarHBondContact O-N 2.88Å; T242-S246 WeakPolarHBondContact O-CA 3.48Å; T242-S246 WeakPolarHBondContact O-CB 3.37Å; T242-S246 PolarHBondContact O-N 3.48Å; T242-S246 PolarHBondContact O-OG 3.28Å; T242-S246 VanDerWaalsContact O-OG 3.1Å |
| 243 | V | 68.2 | Low | 65.2 | Low | 76 Ų | 76 | 71.1 Ų | 71.1 | 46% | 0.461 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -68.8 | -47.6 | 174.8 | -178.5 | 0 | 0 | 0 | 0 | 110.4 | N240 V241 S246 L247 | N240-V243 WeakPolarHBondContact O-CA 3.45Å; N240-V243 WeakPolarHBondContact O-CB 3.39Å; N240-V243 PolarHBondContact O-N 2.93Å; V241-V243 VanDerWaalsContact C-N 3.26Å; V241-V243 PolarHBondContact O-N 3.32Å; V243-S246 VanDerWaalsContact CA-OG 3.32Å; V243-S246 WeakPolarHBondContact CA-OG 3.5Å; V243-S246 PolarHBondContact O-N 3.16Å; V243-S246 PolarHBondContact O-OG 3.02Å; V243-L247 HydrophobicContact CG1-CD1 4.11Å; V243-L247 HydrophobicContact CG1-CG 4.5Å; V243-L247 WeakPolarHBondContact O-CG 3.15Å; V243-L247 PolarHBondContact O-N 3.47Å |
| 244 | L | 62.9 | Low | 63.2 | Low | 86 Ų | 86 | 77.7 Ų | 77.7 | 45% | 0.45 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -60.3 | -48.3 | 177.5 | -68.2 | 171.8 | 0 | 0 | 0 | 112 | N240 V241 S246 L247 A248 | N240-L244 PolarHBondContact O-N 2.78Å; V241-L244 PolarHBondContact O-N 2.98Å; L244-S246 VanDerWaalsContact C-N 3.34Å; L244-L247 PolarHBondContact O-N 3.28Å; L244-A248 PolarHBondContact O-N 3.24Å; L244-A248 VanDerWaalsContact O-N 3.14Å |
| 245 | C | 57.6 | Low | 61.4 | Low | 9 Ų | 9 | 82.9 Ų | 82.9 | 6% | 0.061 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -63.6 | -39.6 | 174 | -69.1 | 0 | 0 | 0 | 0 | 110.9 | V241 A248 M249 A282 | V241-C245 WeakPolarHBondContact O-CB 3.29Å; V241-C245 PolarHBondContact O-N 3.46Å; V241-C245 PolarHBondContact O-SG 3.1Å; C245-A248 PolarHBondContact O-N 3.02Å; C245-M249 HydrophobicContact CB-SD 4.31Å; C245-M249 WeakPolarHBondContact O-CA 3.26Å; C245-M249 WeakPolarHBondContact O-CB 3.44Å; C245-M249 WeakPolarHBondContact O-CG 3Å; C245-M249 PolarHBondContact O-N 3.35Å; C245-A282 HydrophobicContact CB-CB 4.34Å |
| 246 | S | 57.6 | Low | 59.9 | Low | 64 Ų | 64 | 84.8 Ų | 84.8 | 45% | 0.448 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -68.4 | -33.9 | 177.7 | 72.1 | 0 | 0 | 0 | 0 | 113.3 | T242 V243 L244 A248 G250 | T242-S246 WeakPolarHBondContact O-CA 3.48Å; T242-S246 WeakPolarHBondContact O-CB 3.37Å; T242-S246 PolarHBondContact O-N 3.48Å; T242-S246 PolarHBondContact O-OG 3.28Å; T242-S246 VanDerWaalsContact O-OG 3.1Å; V243-S246 VanDerWaalsContact CA-OG 3.32Å; V243-S246 WeakPolarHBondContact CA-OG 3.5Å; V243-S246 PolarHBondContact O-N 3.16Å; V243-S246 PolarHBondContact O-OG 3.02Å; L244-S246 VanDerWaalsContact C-N 3.34Å; S246-A248 VanDerWaalsContact C-N 3.33Å; S246-G250 WeakPolarHBondContact O-CA 2.99Å; S246-G250 PolarHBondContact O-N 2.93Å |
| 247 | L | 62.7 | Low | 57.7 | Low | 116 Ų | 116 | 86.2 Ų | 86.2 | 61% | 0.607 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -66.6 | -39.9 | 174.6 | -77.5 | 167 | 0 | 0 | 0 | 110.6 | V243 L244 | V243-L247 HydrophobicContact CG1-CD1 4.11Å; V243-L247 HydrophobicContact CG1-CG 4.5Å; V243-L247 WeakPolarHBondContact O-CG 3.15Å; V243-L247 PolarHBondContact O-N 3.47Å; L244-L247 PolarHBondContact O-N 3.28Å |
| 248 | A | 55.7 | Low | 56.3 | Low | 31 Ų | 31 | 88.1 Ų | 88.1 | 26% | 0.256 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -78.6 | -35.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | L244 C245 S246 V251 A252 L286 | L244-A248 PolarHBondContact O-N 3.24Å; L244-A248 VanDerWaalsContact O-N 3.14Å; C245-A248 PolarHBondContact O-N 3.02Å; S246-A248 VanDerWaalsContact C-N 3.33Å; A248-V251 WeakPolarHBondContact O-CB 3.46Å; A248-V251 PolarHBondContact O-N 3.44Å; A248-A252 PolarHBondContact O-N 3.08Å; A248-L286 HydrophobicContact CB-CD2 3.09Å; A248-L286 HydrophobicContact CB-CG 4.14Å |
| 249 | M | 48.3 | Very low | 54.9 | Low | 81 Ų | 81 | 88 Ų | 88 | 40% | 0.399 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -73.4 | -28.8 | 174.6 | -73.6 | 170.9 | 60.7 | 0 | 0 | 111.9 | C245 V251 A252 V253 | C245-M249 HydrophobicContact CB-SD 4.31Å; C245-M249 WeakPolarHBondContact O-CA 3.26Å; C245-M249 WeakPolarHBondContact O-CB 3.44Å; C245-M249 WeakPolarHBondContact O-CG 3Å; C245-M249 PolarHBondContact O-N 3.35Å; M249-V251 PolarHBondContact O-N 3.35Å; M249-A252 WeakPolarHBondContact O-CA 3.47Å; M249-A252 PolarHBondContact O-N 2.03Å; M249-V253 PolarHBondContact O-N 2.04Å |
| 250 | G | 53.6 | Low | 53.1 | Low | 68 Ų | 68 | 86 Ų | 86 | 70% | 0.701 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -65 | -21.6 | 172.3 | 0 | 0 | 0 | 0 | 0 | 113 | S246 | S246-G250 WeakPolarHBondContact O-CA 2.99Å; S246-G250 PolarHBondContact O-N 2.93Å |
| 251 | V | 54.8 | Low | 51.4 | Low | 123 Ų | 123 | 90.7 Ų | 90.7 | 75% | 0.745 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -83 | -22.6 | 168.3 | 177 | 0 | 0 | 0 | 0 | 111.7 | A248 M249 | A248-V251 WeakPolarHBondContact O-CB 3.46Å; A248-V251 PolarHBondContact O-N 3.44Å; M249-V251 PolarHBondContact O-N 3.35Å |
| 252 | A | 47 | Very low | 50.2 | Low | 53 Ų | 53 | 98.1 Ų | 98.1 | 44% | 0.438 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -96.9 | -48.8 | -172.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | A248 M249 | A248-A252 PolarHBondContact O-N 3.08Å; M249-A252 WeakPolarHBondContact O-CA 3.47Å; M249-A252 PolarHBondContact O-N 2.03Å |
| 253 | V | 43.6 | Very low | 49.2 | Very low | 76 Ų | 76 | 101.3 Ų | 101.3 | 46% | 0.461 | 62% | 0.617 | S | S | . | * | trans | -163.7 | 124.5 | -168.9 | -140.1 | 0 | 0 | 0 | 0 | 108.7 | M249 Q255 | M249-V253 PolarHBondContact O-N 2.04Å; V253-Q255 HydrophobicContact CB-CB 4.28Å; V253-Q255 HydrophobicContact CG1-CB 3.88Å; V253-Q255 HydrophobicContact CG1-CG 4.46Å; V253-Q255 PolarHBondContact O-N 3.39Å; V253-Q255 VanDerWaalsContact O-N 3.15Å | ||
| 254 | L | 46.4 | Very low | 48.4 | Very low | 172 Ų | 172 | 102.4 Ų | 102.4 | 90% | 0.901 | 61% | 0.614 | S | S | * | * | 44.9 | 23.5 | 62.3 | -114.6 | 164.9 | 0 | 0 | 0 | 114.5 | |||||
| 255 | Q | 40.6 | Very low | 47.5 | Very low | 151 Ų | 151 | 104.4 Ų | 104.4 | 71% | 0.706 | 63% | 0.633 | S | S | * | * | trans | -164.5 | 98 | 169.7 | -106.9 | 144.5 | 42.8 | 0 | 0 | 114.7 | V253 | V253-Q255 HydrophobicContact CB-CB 4.28Å; V253-Q255 HydrophobicContact CG1-CB 3.88Å; V253-Q255 HydrophobicContact CG1-CG 4.46Å; V253-Q255 PolarHBondContact O-N 3.39Å; V253-Q255 VanDerWaalsContact O-N 3.15Å | ||
| 256 | S | 48.8 | Very low | 47 | Very low | 107 Ų | 107 | 110.8 Ų | 110.8 | 75% | 0.748 | 66% | 0.662 | S | S | * | * | trans | 50.3 | 133.2 | 149.2 | 60.9 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 257 | P | 38.7 | Very low | 46.7 | Very low | 129 Ų | 129 | 110.2 Ų | 110.2 | 84% | 0.838 | 67% | 0.667 | S | S | * | * | trans | -96.5 | 144.3 | 176.8 | 37.6 | -30 | 0 | 0 | 0 | 112.5 | ||||
| 258 | A | 46.9 | Very low | 46.5 | Very low | 109 Ų | 109 | 108.2 Ų | 108.2 | 90% | 0.901 | 66% | 0.662 | S | S | * | * | trans | -157.6 | 108.1 | 153.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 259 | A | 38.8 | Very low | 46.5 | Very low | 92 Ų | 92 | 108.4 Ų | 108.4 | 76% | 0.76 | 66% | 0.659 | S | S | * | * | trans | -131.6 | 128.4 | 162.7 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 260 | C | 40.6 | Very low | 47.1 | Very low | 122 Ų | 122 | 109.9 Ų | 109.9 | 82% | 0.824 | 66% | 0.664 | S | S | * | * | trans | -148.5 | 139.3 | 160.1 | -164.2 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 261 | L | 38.5 | Very low | 47.3 | Very low | 148 Ų | 148 | 111.3 Ų | 111.3 | 78% | 0.775 | 65% | 0.649 | S | S | * | * | trans | -13.4 | 135.8 | 178 | -85.8 | 78.5 | 0 | 0 | 0 | 120.6 | ||||
| 262 | K | 42 | Very low | 47.6 | Very low | 166 Ų | 166 | 106.8 Ų | 106.8 | 72% | 0.722 | 63% | 0.627 | S | S | * | * | trans | -152 | 132.4 | 133.1 | -120.8 | -178.7 | -176.7 | 177.5 | 0 | 112.4 | Y264 | K262-Y264 HydrophobicContact CB-CD2 4.38Å; K262-Y264 HydrophobicContact CB-CE2 3.65Å; K262-Y264 HydrophobicContact CD-CE2 4.37Å; K262-Y264 WeakPolarHBondContact CD-OH 3.23Å; K262-Y264 HydrophobicContact CG-CE2 4.48Å | ||
| 263 | I | 40.9 | Very low | 48.3 | Very low | 149 Ų | 149 | 105.4 Ų | 105.4 | 76% | 0.764 | 61% | 0.612 | S | S | * | * | trans | -76.7 | 138.1 | 173.3 | -61.7 | 163.8 | 0 | 0 | 0 | 108.4 | ||||
| 264 | Y | 50.9 | Low | 49.2 | Very low | 98 Ų | 98 | 104.3 Ų | 104.3 | 38% | 0.384 | 61% | 0.605 | S | S | . | * | trans | -133.3 | 156.4 | 173.1 | -72.4 | -81.9 | 0 | 0 | 0 | 111.2 | K262 R271 R278 | K262-Y264 HydrophobicContact CB-CD2 4.38Å; K262-Y264 HydrophobicContact CB-CE2 3.65Å; K262-Y264 HydrophobicContact CD-CE2 4.37Å; K262-Y264 WeakPolarHBondContact CD-OH 3.23Å; K262-Y264 HydrophobicContact CG-CE2 4.48Å; Y264-R271 PolarHBondContact O-NH1 3.1Å; Y264-R271 PolarHBondContact O-NH2 2.86Å; Y264-R278 PolarHBondContact OH-NH2 3.46Å | ||
| 265 | C | 42.8 | Very low | 49.7 | Very low | 128 Ų | 128 | 97.6 Ų | 97.6 | 87% | 0.865 | 57% | 0.568 | S | S | * | * | trans | -116.6 | 10.8 | -174.2 | -67.1 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 266 | E | 46.9 | Very low | 50.9 | Low | 143 Ų | 143 | 93.1 Ų | 93.1 | 67% | 0.668 | 55% | 0.549 | S | S | * | . | S | Bend | trans | -101.1 | 161.3 | -177.3 | -64.6 | 175 | -178.3 | 0 | 0 | 114.7 | R271 | E266-R271 PolarHBondContact O-NE 2.75Å; E266-R271 PolarHBondContact O-NH2 3.18Å |
| 267 | G | 51.8 | Low | 51.7 | Low | 53 Ų | 53 | 94.3 Ų | 94.3 | 55% | 0.546 | 54% | 0.543 | S | S | . | . | trans | -53.6 | 143.3 | -169.2 | 0 | 0 | 0 | 0 | 0 | 117.2 | L269 Q270 R271 | G267-L269 PolarHBondContact O-N 2.99Å; G267-Q270 PolarHBondContact O-N 3.16Å; G267-R271 PolarHBondContact O-N 3.11Å | ||
| 268 | C | 58.6 | Low | 52.8 | Low | 74 Ų | 74 | 95.4 Ų | 95.4 | 50% | 0.5 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65.2 | -35.4 | -161.6 | -57.9 | 0 | 0 | 0 | 0 | 114.9 | R271 G272 | C268-R271 WeakPolarHBondContact O-CB 3.3Å; C268-R271 PolarHBondContact O-N 2.82Å; C268-G272 PolarHBondContact O-N 2.92Å |
| 269 | L | 56.7 | Low | 53.5 | Low | 35 Ų | 35 | 92.2 Ų | 92.2 | 18% | 0.183 | 50% | 0.498 | C | S | . | . | H | α-helix | trans | -81.1 | -28.5 | -175 | -162 | 48.6 | 0 | 0 | 0 | 112.8 | K128 E132 G267 R271 G272 L273 | K128-L269 HydrophobicContact CD-CB 4.49Å; K128-L269 HydrophobicContact CD-CD1 4.28Å; K128-L269 HydrophobicContact CD-CD2 3.66Å; K128-L269 HydrophobicContact CD-CG 3.45Å; K128-L269 VanDerWaalsContact CD-CG 3.45Å; K128-L269 HydrophobicContact CG-CD1 3.89Å; K128-L269 HydrophobicContact CG-CD2 3.28Å; K128-L269 HydrophobicContact CG-CG 3.43Å; K128-L269 VanDerWaalsContact CG-CG 3.43Å; E132-L269 VanDerWaalsContact CD-CD2 3.46Å; E132-L269 HydrophobicContact CG-CD2 4.02Å; E132-L269 WeakPolarHBondContact OE1-CD2 3.25Å; G267-L269 PolarHBondContact O-N 2.99Å; L269-R271 VanDerWaalsContact C-N 3.3Å; L269-G272 PolarHBondContact O-N 3.3Å; L269-L273 PolarHBondContact O-N 3.3Å |
| 270 | Q | 60.4 | Low | 55 | Low | 112 Ų | 112 | 93.2 Ų | 93.2 | 52% | 0.523 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -66.9 | -36.5 | 166.2 | -159.8 | 74.9 | -15.4 | 0 | 0 | 110.4 | G267 L273 V274 | G267-Q270 PolarHBondContact O-N 3.16Å; Q270-L273 WeakPolarHBondContact O-CB 3.48Å; Q270-L273 PolarHBondContact O-N 3.47Å; Q270-V274 VanDerWaalsContact O-CG2 3.31Å; Q270-V274 WeakPolarHBondContact O-CG2 3.37Å; Q270-V274 PolarHBondContact O-N 3.25Å |
| 271 | R | 57.2 | Low | 56.4 | Low | 98 Ų | 98 | 90.3 Ų | 90.3 | 37% | 0.37 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -67.3 | -35.2 | 174.3 | -70 | -164.5 | -161.6 | 162.9 | 19.7 | 113.6 | Y264 E266 G267 C268 L269 L273 V274 W275 | Y264-R271 PolarHBondContact O-NH1 3.1Å; Y264-R271 PolarHBondContact O-NH2 2.86Å; E266-R271 PolarHBondContact O-NE 2.75Å; E266-R271 PolarHBondContact O-NH2 3.18Å; G267-R271 PolarHBondContact O-N 3.11Å; C268-R271 WeakPolarHBondContact O-CB 3.3Å; C268-R271 PolarHBondContact O-N 2.82Å; L269-R271 VanDerWaalsContact C-N 3.3Å; R271-L273 VanDerWaalsContact C-N 3.31Å; R271-V274 PolarHBondContact O-N 2.87Å; R271-W275 WeakPolarHBondContact O-CB 3.23Å; R271-W275 PolarHBondContact O-N 3.43Å |
| 272 | G | 60.8 | Low | 57.8 | Low | 28 Ų | 28 | 84.3 Ų | 84.3 | 29% | 0.289 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -58.9 | -44.5 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | C268 L269 W275 L276 | C268-G272 PolarHBondContact O-N 2.92Å; L269-G272 PolarHBondContact O-N 3.3Å; G272-W275 PolarHBondContact O-N 2.98Å; G272-L276 WeakPolarHBondContact O-CB 3.46Å; G272-L276 PolarHBondContact O-N 3.31Å |
| 273 | L | 63.2 | Low | 59.3 | Low | 23 Ų | 23 | 79.8 Ų | 79.8 | 12% | 0.12 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -63.9 | -46.2 | 174.9 | -78.8 | 154.4 | 0 | 0 | 0 | 112.7 | K124 K128 L269 Q270 R271 W275 L276 E277 | K124-L273 HydrophobicContact CB-CD2 3.62Å; K124-L273 HydrophobicContact CD-CD2 3.35Å; K124-L273 HydrophobicContact CG-CD2 3.42Å; K124-L273 VanDerWaalsContact CG-CD2 3.42Å; K128-L273 HydrophobicContact CD-CD1 4.04Å; L269-L273 PolarHBondContact O-N 3.3Å; Q270-L273 WeakPolarHBondContact O-CB 3.48Å; Q270-L273 PolarHBondContact O-N 3.47Å; R271-L273 VanDerWaalsContact C-N 3.31Å; L273-W275 VanDerWaalsContact C-N 3.29Å; L273-W275 PolarHBondContact O-N 2.66Å; L273-L276 WeakPolarHBondContact O-CB 3.48Å; L273-L276 PolarHBondContact O-N 3.38Å; L273-E277 WeakPolarHBondContact O-CB 3.18Å; L273-E277 PolarHBondContact O-N 2.95Å |
| 274 | V | 61.4 | Low | 61 | Low | 54 Ų | 54 | 74 Ų | 74 | 33% | 0.327 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -65.8 | -33.5 | 175.9 | 172 | 0 | 0 | 0 | 0 | 111.4 | Q270 R271 E277 R278 | Q270-V274 VanDerWaalsContact O-CG2 3.31Å; Q270-V274 WeakPolarHBondContact O-CG2 3.37Å; Q270-V274 PolarHBondContact O-N 3.25Å; R271-V274 PolarHBondContact O-N 2.87Å; V274-E277 PolarHBondContact O-N 3.19Å; V274-R278 HydrophobicContact CG1-CG 4.38Å; V274-R278 WeakPolarHBondContact O-CB 3.31Å; V274-R278 VanDerWaalsContact O-CG 3.23Å; V274-R278 WeakPolarHBondContact O-CG 3.49Å; V274-R278 PolarHBondContact O-N 3.36Å |
| 275 | W | 57.4 | Low | 62.2 | Low | 31 Ų | 31 | 71.4 Ų | 71.4 | 12% | 0.117 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -67.5 | -44.2 | 174.5 | 174.2 | 79.6 | 0 | 0 | 0 | 111.5 | M238 V241 R271 G272 L273 E277 R278 N279 M283 | M238-W275 HydrophobicContact CE-CB 4.18Å; M238-W275 HydrophobicContact CE-CG 3.8Å; M238-W275 HydrophobicContact SD-CB 3.67Å; M238-W275 HydrophobicContact SD-CD2 3.8Å; M238-W275 HydrophobicContact SD-CG 3.15Å; M238-W275 PolarHBondContact SD-NE1 2.79Å; M238-W275 VanDerWaalsContact SD-NE1 3.42Å; V241-W275 HydrophobicContact CB-CZ2 3.81Å; V241-W275 HydrophobicContact CG1-CZ2 3.56Å; V241-W275 HydrophobicContact CG2-CH2 3.73Å; V241-W275 HydrophobicContact CG2-CZ2 3.32Å; R271-W275 WeakPolarHBondContact O-CB 3.23Å; R271-W275 PolarHBondContact O-N 3.43Å; G272-W275 PolarHBondContact O-N 2.98Å; L273-W275 VanDerWaalsContact C-N 3.29Å; L273-W275 PolarHBondContact O-N 2.66Å; W275-E277 VanDerWaalsContact C-N 3.26Å; W275-E277 PolarHBondContact O-N 2.99Å; W275-R278 PolarHBondContact O-N 3.47Å; W275-N279 HydrophobicContact CD2-CB 4.47Å; W275-N279 HydrophobicContact CH2-CB 4.28Å; W275-N279 HydrophobicContact CZ2-CB 3.77Å; W275-N279 PolarHBondContact NE1-ND2 2.87Å; W275-N279 WeakPolarHBondContact O-CB 3.27Å; W275-N279 PolarHBondContact O-N 3.27Å; W275-N279 PolarHBondContact O-ND2 3.01Å; W275-M283 HydrophobicContact CH2-CG 4.31Å; W275-M283 HydrophobicContact CH2-SD 3.79Å; W275-M283 HydrophobicContact CZ3-SD 3.6Å |
| 276 | L | 64.9 | Low | 63.9 | Low | 56 Ų | 56 | 68 Ų | 68 | 29% | 0.293 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -58.7 | -42.1 | 174.1 | -172 | 116.8 | 0 | 0 | 0 | 110.3 | G272 L273 N279 F280 M283 | G272-L276 WeakPolarHBondContact O-CB 3.46Å; G272-L276 PolarHBondContact O-N 3.31Å; L273-L276 WeakPolarHBondContact O-CB 3.48Å; L273-L276 PolarHBondContact O-N 3.38Å; L276-N279 CarbonylContact O-C 3.59Å; L276-F280 VanDerWaalsContact O-CA 3.26Å; L276-F280 WeakPolarHBondContact O-CA 3.27Å; L276-F280 WeakPolarHBondContact O-CB 3.31Å; L276-F280 PolarHBondContact O-N 3.09Å; L276-M283 HydrophobicContact CD1-CE 3.68Å; L276-M283 HydrophobicContact CD1-SD 3.78Å; L276-M283 HydrophobicContact CG-CE 4.5Å; L276-M283 HydrophobicContact CG-SD 4.07Å |
| 277 | E | 66.6 | Low | 65.6 | Low | 133 Ų | 133 | 63 Ų | 63 | 62% | 0.621 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -67.2 | -37.5 | 175.7 | -164.7 | 169.5 | -162 | 0 | 0 | 112.5 | L273 V274 W275 F280 | L273-E277 WeakPolarHBondContact O-CB 3.18Å; L273-E277 PolarHBondContact O-N 2.95Å; V274-E277 PolarHBondContact O-N 3.19Å; W275-E277 VanDerWaalsContact C-N 3.26Å; W275-E277 PolarHBondContact O-N 2.99Å; E277-F280 VanDerWaalsContact O-CB 3.28Å; E277-F280 WeakPolarHBondContact O-CB 3.37Å |
| 278 | R | 62 | Low | 67 | Low | 151 Ų | 151 | 64.3 Ų | 64.3 | 57% | 0.57 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -74.9 | -33.5 | 177 | -76.2 | 177.2 | -176.7 | -157.5 | 2.7 | 113.9 | Y264 V274 W275 F280 | Y264-R278 PolarHBondContact OH-NH2 3.46Å; V274-R278 HydrophobicContact CG1-CG 4.38Å; V274-R278 WeakPolarHBondContact O-CB 3.31Å; V274-R278 VanDerWaalsContact O-CG 3.23Å; V274-R278 WeakPolarHBondContact O-CG 3.49Å; V274-R278 PolarHBondContact O-N 3.36Å; W275-R278 PolarHBondContact O-N 3.47Å; R278-F280 VanDerWaalsContact C-N 3.34Å |
| 279 | N | 61.9 | Low | 68.1 | Low | 42 Ų | 42 | 63.2 Ų | 63.2 | 23% | 0.225 | 35% | 0.353 | C | S | . | . | S | Bend | trans | -100.1 | 12.2 | 179.1 | -67.8 | -97.4 | 0 | 0 | 0 | 111.7 | W275 L276 G281 A282 M283 | W275-N279 HydrophobicContact CD2-CB 4.47Å; W275-N279 HydrophobicContact CH2-CB 4.28Å; W275-N279 HydrophobicContact CZ2-CB 3.77Å; W275-N279 PolarHBondContact NE1-ND2 2.87Å; W275-N279 WeakPolarHBondContact O-CB 3.27Å; W275-N279 PolarHBondContact O-N 3.27Å; W275-N279 PolarHBondContact O-ND2 3.01Å; L276-N279 CarbonylContact O-C 3.59Å; N279-G281 PolarHBondContact O-N 3.34Å; N279-G281 VanDerWaalsContact O-N 3.12Å; N279-A282 PolarHBondContact O-N 3.23Å; N279-M283 PolarHBondContact O-N 3.33Å |
| 280 | F | 70.6 | Confident | 69.4 | Low | 114 Ų | 114 | 65.3 Ų | 65.3 | 50% | 0.5 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -53.5 | -36.5 | 179.9 | -167.6 | -96.4 | 0 | 0 | 0 | 111.5 | F121 L276 E277 R278 G284 | F121-F280 AromaticContact CD2-CE2 3.96Å; F121-F280 HydrophobicContact CD2-CE2 3.96Å; F121-F280 HydrophobicContact CE2-CE2 4.03Å; L276-F280 VanDerWaalsContact O-CA 3.26Å; L276-F280 WeakPolarHBondContact O-CA 3.27Å; L276-F280 WeakPolarHBondContact O-CB 3.31Å; L276-F280 PolarHBondContact O-N 3.09Å; E277-F280 VanDerWaalsContact O-CB 3.28Å; E277-F280 WeakPolarHBondContact O-CB 3.37Å; R278-F280 VanDerWaalsContact C-N 3.34Å; F280-G284 WeakPolarHBondContact O-CA 2.85Å; F280-G284 PolarHBondContact O-N 2.58Å |
| 281 | G | 69.4 | Low | 70.8 | Confident | 60 Ų | 60 | 61.5 Ų | 61.5 | 62% | 0.619 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -63.3 | -45.9 | 174 | 0 | 0 | 0 | 0 | 0 | 113.8 | N279 A285 | N279-G281 PolarHBondContact O-N 3.34Å; N279-G281 VanDerWaalsContact O-N 3.12Å; G281-A285 WeakPolarHBondContact O-CB 3.43Å; G281-A285 PolarHBondContact O-N 2.91Å |
| 282 | A | 68.5 | Low | 72.2 | Confident | 22 Ų | 22 | 59 Ų | 59 | 18% | 0.182 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -72.9 | -41 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | C245 N279 G284 A285 L286 | C245-A282 HydrophobicContact CB-CB 4.34Å; N279-A282 PolarHBondContact O-N 3.23Å; A282-G284 VanDerWaalsContact C-N 3.34Å; A282-A285 PolarHBondContact O-N 3.36Å; A282-L286 PolarHBondContact O-N 2.74Å |
| 283 | M | 71.8 | Confident | 73.4 | Confident | 71 Ų | 71 | 63 Ų | 63 | 35% | 0.35 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -64.8 | -40.9 | 172.9 | -67.5 | -175.1 | 68.1 | 0 | 0 | 111.4 | W275 L276 N279 A285 L286 A287 | W275-M283 HydrophobicContact CH2-CG 4.31Å; W275-M283 HydrophobicContact CH2-SD 3.79Å; W275-M283 HydrophobicContact CZ3-SD 3.6Å; L276-M283 HydrophobicContact CD1-CE 3.68Å; L276-M283 HydrophobicContact CD1-SD 3.78Å; L276-M283 HydrophobicContact CG-CE 4.5Å; L276-M283 HydrophobicContact CG-SD 4.07Å; N279-M283 PolarHBondContact O-N 3.33Å; M283-A285 VanDerWaalsContact C-N 3.33Å; M283-A285 PolarHBondContact O-N 3.21Å; M283-L286 WeakPolarHBondContact O-CB 3.27Å; M283-L286 PolarHBondContact O-N 3.06Å; M283-A287 WeakPolarHBondContact O-CB 3.43Å; M283-A287 PolarHBondContact O-N 2.86Å |
| 284 | G | 78.1 | Confident | 74.7 | Confident | 28 Ų | 28 | 63.3 Ų | 63.3 | 29% | 0.289 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -62.5 | -38.7 | 174 | 0 | 0 | 0 | 0 | 0 | 112.1 | F280 A282 S288 | F280-G284 WeakPolarHBondContact O-CA 2.85Å; F280-G284 PolarHBondContact O-N 2.58Å; A282-G284 VanDerWaalsContact C-N 3.34Å; G284-S288 WeakPolarHBondContact O-CB 3.44Å; G284-S288 PolarHBondContact O-N 3.14Å; G284-S288 PolarHBondContact O-OG 2.81Å |
| 285 | A | 75.6 | Confident | 76 | Confident | 43 Ų | 43 | 64.5 Ų | 64.5 | 36% | 0.355 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -66.7 | -41.7 | 175 | 0 | 0 | 0 | 0 | 0 | 112.3 | G281 A282 M283 S288 T289 | G281-A285 WeakPolarHBondContact O-CB 3.43Å; G281-A285 PolarHBondContact O-N 2.91Å; A282-A285 PolarHBondContact O-N 3.36Å; M283-A285 VanDerWaalsContact C-N 3.33Å; M283-A285 PolarHBondContact O-N 3.21Å; A285-S288 PolarHBondContact O-N 2.82Å; A285-T289 WeakPolarHBondContact O-CB 3.47Å; A285-T289 PolarHBondContact O-N 3.32Å; A285-T289 PolarHBondContact O-OG1 3.3Å |
| 286 | L | 77.6 | Confident | 77.5 | Confident | 58 Ų | 58 | 68.7 Ų | 68.7 | 30% | 0.304 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -58.6 | -54.6 | 172.8 | -85.7 | 171.5 | 0 | 0 | 0 | 111.8 | A248 A282 M283 S288 T289 I290 | A248-L286 HydrophobicContact CB-CD2 3.09Å; A248-L286 HydrophobicContact CB-CG 4.14Å; A282-L286 PolarHBondContact O-N 2.74Å; M283-L286 WeakPolarHBondContact O-CB 3.27Å; M283-L286 PolarHBondContact O-N 3.06Å; L286-S288 VanDerWaalsContact C-N 3.31Å; L286-S288 PolarHBondContact O-N 3.12Å; L286-T289 WeakPolarHBondContact O-CB 3.43Å; L286-T289 PolarHBondContact O-N 2.81Å; L286-T289 VanDerWaalsContact O-N 3.1Å; L286-I290 WeakPolarHBondContact O-CG1 3.46Å; L286-I290 PolarHBondContact O-N 3.26Å |
| 287 | A | 82.6 | Confident | 78.5 | Confident | 38 Ų | 38 | 66.7 Ų | 66.7 | 31% | 0.314 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -58.7 | -44 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | M283 T289 I290 V291 | M283-A287 WeakPolarHBondContact O-CB 3.43Å; M283-A287 PolarHBondContact O-N 2.86Å; A287-T289 VanDerWaalsContact C-N 3.27Å; A287-T289 PolarHBondContact O-N 3.01Å; A287-I290 PolarHBondContact O-N 3.01Å; A287-V291 WeakPolarHBondContact O-CB 3.12Å; A287-V291 VanDerWaalsContact O-CG2 3.29Å; A287-V291 WeakPolarHBondContact O-CG2 3.42Å; A287-V291 PolarHBondContact O-N 3Å |
| 288 | S | 82.8 | Confident | 79.7 | Confident | 79 Ų | 79 | 62 Ų | 62 | 55% | 0.552 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -61.8 | -35.2 | 176.7 | -60.8 | 0 | 0 | 0 | 0 | 112.5 | G284 A285 L286 A292 | G284-S288 WeakPolarHBondContact O-CB 3.44Å; G284-S288 PolarHBondContact O-N 3.14Å; G284-S288 PolarHBondContact O-OG 2.81Å; A285-S288 PolarHBondContact O-N 2.82Å; L286-S288 VanDerWaalsContact C-N 3.31Å; L286-S288 PolarHBondContact O-N 3.12Å; S288-A292 VanDerWaalsContact O-CB 3.26Å; S288-A292 WeakPolarHBondContact O-CB 3.4Å; S288-A292 PolarHBondContact O-N 3.34Å |
| 289 | T | 80.5 | Confident | 81.2 | Confident | 52 Ų | 52 | 57.7 Ų | 57.7 | 32% | 0.319 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -68.5 | -43.5 | 176.5 | -56.4 | 0 | 0 | 0 | 0 | 110.9 | A285 L286 A287 A292 I293 | A285-T289 WeakPolarHBondContact O-CB 3.47Å; A285-T289 PolarHBondContact O-N 3.32Å; A285-T289 PolarHBondContact O-OG1 3.3Å; L286-T289 WeakPolarHBondContact O-CB 3.43Å; L286-T289 PolarHBondContact O-N 2.81Å; L286-T289 VanDerWaalsContact O-N 3.1Å; A287-T289 VanDerWaalsContact C-N 3.27Å; A287-T289 PolarHBondContact O-N 3.01Å; T289-A292 PolarHBondContact O-N 3.46Å; T289-I293 HydrophobicContact CG2-CD1 4.11Å; T289-I293 VanDerWaalsContact O-CG1 3.29Å; T289-I293 WeakPolarHBondContact O-CG1 3.48Å; T289-I293 PolarHBondContact O-N 2.75Å |
| 290 | I | 84.6 | Confident | 82.5 | Confident | 79 Ų | 79 | 61.1 Ų | 61.1 | 41% | 0.405 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -61.7 | -51.8 | 176.3 | -65.6 | 167.9 | 0 | 0 | 0 | 109.8 | E113 L286 A287 A292 I293 E294 | E113-I290 WeakPolarHBondContact OE2-CG2 3.41Å; L286-I290 WeakPolarHBondContact O-CG1 3.46Å; L286-I290 PolarHBondContact O-N 3.26Å; A287-I290 PolarHBondContact O-N 3.01Å; I290-A292 VanDerWaalsContact C-N 3.28Å; I290-A292 PolarHBondContact O-N 2.89Å; I290-I293 WeakPolarHBondContact O-CB 3.18Å; I290-I293 PolarHBondContact O-N 2.8Å; I290-E294 WeakPolarHBondContact O-CG 3.01Å; I290-E294 PolarHBondContact O-N 3.32Å |
| 291 | V | 88.6 | Confident | 83.4 | Confident | 31 Ų | 31 | 55.8 Ų | 55.8 | 19% | 0.188 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -55.2 | -42.6 | 175.9 | 167.8 | 0 | 0 | 0 | 0 | 111.5 | L110 A287 E294 I295 | L110-V291 HydrophobicContact CD1-CG1 4.06Å; A287-V291 WeakPolarHBondContact O-CB 3.12Å; A287-V291 VanDerWaalsContact O-CG2 3.29Å; A287-V291 WeakPolarHBondContact O-CG2 3.42Å; A287-V291 PolarHBondContact O-N 3Å; V291-E294 PolarHBondContact O-N 2.98Å; V291-I295 HydrophobicContact CG1-CD1 3.69Å; V291-I295 HydrophobicContact CG1-CG1 4.41Å; V291-I295 WeakPolarHBondContact O-CB 3.38Å; V291-I295 VanDerWaalsContact O-CG1 3.23Å; V291-I295 WeakPolarHBondContact O-CG1 3.5Å; V291-I295 PolarHBondContact O-N 2.95Å |
| 292 | A | 87.5 | Confident | 84.5 | Confident | 46 Ų | 46 | 56.1 Ų | 56.1 | 38% | 0.38 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -63.9 | -42.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | S288 T289 I290 I295 L296 | S288-A292 VanDerWaalsContact O-CB 3.26Å; S288-A292 WeakPolarHBondContact O-CB 3.4Å; S288-A292 PolarHBondContact O-N 3.34Å; T289-A292 PolarHBondContact O-N 3.46Å; I290-A292 VanDerWaalsContact C-N 3.28Å; I290-A292 PolarHBondContact O-N 2.89Å; A292-I295 PolarHBondContact O-N 3.23Å; A292-L296 WeakPolarHBondContact O-CB 3.16Å; A292-L296 WeakPolarHBondContact O-CG 3.25Å; A292-L296 PolarHBondContact O-N 3.37Å |
| 293 | I | 85.7 | Confident | 85.6 | Confident | 111 Ų | 111 | 59.8 Ų | 59.8 | 57% | 0.569 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -62.4 | -43.5 | 176.6 | -69.6 | 165.2 | 0 | 0 | 0 | 110.7 | T289 I290 L296 G297 | T289-I293 HydrophobicContact CG2-CD1 4.11Å; T289-I293 VanDerWaalsContact O-CG1 3.29Å; T289-I293 WeakPolarHBondContact O-CG1 3.48Å; T289-I293 PolarHBondContact O-N 2.75Å; I290-I293 WeakPolarHBondContact O-CB 3.18Å; I290-I293 PolarHBondContact O-N 2.8Å; I293-L296 PolarHBondContact O-N 3.44Å; I293-G297 PolarHBondContact O-N 3.06Å |
| 294 | E | 89.9 | Confident | 86.5 | Confident | 31 Ų | 31 | 57.7 Ų | 57.7 | 15% | 0.145 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -64.3 | -46.5 | 177.8 | -69.5 | -169.4 | 153 | 0 | 0 | 112.1 | V106 L110 I290 V291 L296 G297 I298 | V106-E294 HydrophobicContact CG1-CB 3.77Å; V106-E294 HydrophobicContact CG1-CG 4.03Å; L110-E294 VanDerWaalsContact CA-OE2 3.26Å; L110-E294 WeakPolarHBondContact CA-OE2 3.35Å; L110-E294 VanDerWaalsContact CB-OE2 3.27Å; L110-E294 WeakPolarHBondContact CB-OE2 3.45Å; L110-E294 HydrophobicContact CD1-CB 3.95Å; L110-E294 WeakPolarHBondContact CD1-OE2 3.43Å; I290-E294 WeakPolarHBondContact O-CG 3.01Å; I290-E294 PolarHBondContact O-N 3.32Å; V291-E294 PolarHBondContact O-N 2.98Å; E294-L296 VanDerWaalsContact C-N 3.33Å; E294-L296 PolarHBondContact O-N 3.44Å; E294-G297 PolarHBondContact O-N 3.09Å; E294-I298 WeakPolarHBondContact O-CG1 3.33Å; E294-I298 PolarHBondContact O-N 3.3Å |
| 295 | I | 90.4 | Very high | 87.1 | Confident | 79 Ų | 79 | 60 Ų | 60 | 41% | 0.405 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -60.5 | -44.5 | 176.2 | -68.9 | 168.4 | 0 | 0 | 0 | 110.4 | L110 V291 A292 G297 I298 C299 | L110-I295 HydrophobicContact CD1-CD1 4.47Å; L110-I295 HydrophobicContact CD1-CG1 3.9Å; V291-I295 HydrophobicContact CG1-CD1 3.69Å; V291-I295 HydrophobicContact CG1-CG1 4.41Å; V291-I295 WeakPolarHBondContact O-CB 3.38Å; V291-I295 VanDerWaalsContact O-CG1 3.23Å; V291-I295 WeakPolarHBondContact O-CG1 3.5Å; V291-I295 PolarHBondContact O-N 2.95Å; A292-I295 PolarHBondContact O-N 3.23Å; I295-G297 VanDerWaalsContact C-N 3.32Å; I295-G297 PolarHBondContact O-N 3.03Å; I295-I298 PolarHBondContact O-N 2.94Å; I295-C299 WeakPolarHBondContact O-CB 3.35Å; I295-C299 PolarHBondContact O-N 2.98Å; I295-C299 PolarHBondContact O-SG 3.32Å |
| 296 | L | 88.6 | Confident | 87.9 | Confident | 119 Ų | 119 | 61.3 Ų | 61.3 | 62% | 0.623 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -59.9 | -42.9 | 175.9 | -75.4 | 171.6 | 0 | 0 | 0 | 111.5 | A292 I293 E294 C299 F300 | A292-L296 WeakPolarHBondContact O-CB 3.16Å; A292-L296 WeakPolarHBondContact O-CG 3.25Å; A292-L296 PolarHBondContact O-N 3.37Å; I293-L296 PolarHBondContact O-N 3.44Å; E294-L296 VanDerWaalsContact C-N 3.33Å; E294-L296 PolarHBondContact O-N 3.44Å; L296-C299 PolarHBondContact O-N 3.48Å; L296-F300 VanDerWaalsContact O-CB 3.31Å; L296-F300 WeakPolarHBondContact O-CB 3.32Å; L296-F300 PolarHBondContact O-N 3.38Å |
| 297 | G | 86 | Confident | 88.6 | Confident | 13 Ų | 13 | 60.7 Ų | 60.7 | 13% | 0.134 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -59.4 | -46.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | I293 E294 I295 F300 A301 | I293-G297 PolarHBondContact O-N 3.06Å; E294-G297 PolarHBondContact O-N 3.09Å; I295-G297 VanDerWaalsContact C-N 3.32Å; I295-G297 PolarHBondContact O-N 3.03Å; G297-F300 PolarHBondContact O-N 3.43Å; G297-A301 WeakPolarHBondContact O-CB 3.41Å; G297-A301 PolarHBondContact O-N 3.36Å |
| 298 | I | 91.6 | Very high | 89 | Confident | 36 Ų | 36 | 59.1 Ų | 59.1 | 19% | 0.185 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -62.3 | -48.9 | 176.6 | -65.9 | 165.7 | 0 | 0 | 0 | 110.6 | V106 E294 I295 F300 A301 Q302 | V106-I298 HydrophobicContact CB-CD1 4.4Å; V106-I298 HydrophobicContact CB-CG1 4.06Å; V106-I298 HydrophobicContact CG1-CD1 3.95Å; V106-I298 HydrophobicContact CG1-CG1 3.8Å; E294-I298 WeakPolarHBondContact O-CG1 3.33Å; E294-I298 PolarHBondContact O-N 3.3Å; I295-I298 PolarHBondContact O-N 2.94Å; I298-F300 VanDerWaalsContact C-N 3.33Å; I298-F300 PolarHBondContact O-N 2.87Å; I298-A301 PolarHBondContact O-N 3.2Å; I298-Q302 HydrophobicContact CG2-CG 4.36Å; I298-Q302 WeakPolarHBondContact O-CG 3.35Å; I298-Q302 PolarHBondContact O-N 3.11Å |
| 299 | C | 92.3 | Very high | 89.4 | Confident | 60 Ų | 60 | 60 Ų | 60 | 41% | 0.405 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -59.3 | -44.7 | 178.8 | -73.4 | 0 | 0 | 0 | 0 | 111.5 | I295 L296 A301 Q302 N303 | I295-C299 WeakPolarHBondContact O-CB 3.35Å; I295-C299 PolarHBondContact O-N 2.98Å; I295-C299 PolarHBondContact O-SG 3.32Å; L296-C299 PolarHBondContact O-N 3.48Å; C299-A301 VanDerWaalsContact C-N 3.34Å; C299-A301 PolarHBondContact O-N 2.71Å; C299-Q302 PolarHBondContact O-N 3.5Å; C299-N303 WeakPolarHBondContact O-CB 3.27Å; C299-N303 PolarHBondContact O-N 3.11Å; C299-N303 PolarHBondContact O-ND2 3.12Å |
| 300 | F | 89 | Confident | 89.8 | Confident | 114 Ų | 114 | 59.6 Ų | 59.6 | 50% | 0.5 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -60.1 | -45.1 | 176.3 | -177 | -100.2 | 0 | 0 | 0 | 111.5 | L296 G297 I298 N303 L304 | L296-F300 VanDerWaalsContact O-CB 3.31Å; L296-F300 WeakPolarHBondContact O-CB 3.32Å; L296-F300 PolarHBondContact O-N 3.38Å; G297-F300 PolarHBondContact O-N 3.43Å; I298-F300 VanDerWaalsContact C-N 3.33Å; I298-F300 PolarHBondContact O-N 2.87Å; F300-N303 PolarHBondContact O-N 3.39Å; F300-L304 HydrophobicContact CE1-CD2 4.5Å; F300-L304 WeakPolarHBondContact O-CB 3.36Å; F300-L304 PolarHBondContact O-N 2.85Å |
| 301 | A | 89.8 | Confident | 90.1 | Very high | 1 Ų | 1 | 59.5 Ų | 59.5 | 1% | 0.008 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -62.6 | -42.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | L99 Y102 G297 I298 C299 R305 | L99-A301 HydrophobicContact CD1-CB 3.56Å; L99-A301 WeakPolarHBondContact CD2-O 3.37Å; L99-A301 HydrophobicContact CG-CB 3.85Å; L99-A301 WeakPolarHBondContact CG-O 3.06Å; Y102-A301 HydrophobicContact CD1-CB 3.6Å; Y102-A301 HydrophobicContact CE1-CB 3.85Å; G297-A301 WeakPolarHBondContact O-CB 3.41Å; G297-A301 PolarHBondContact O-N 3.36Å; I298-A301 PolarHBondContact O-N 3.2Å; C299-A301 VanDerWaalsContact C-N 3.34Å; C299-A301 PolarHBondContact O-N 2.71Å; A301-R305 VanDerWaalsContact O-CB 3.28Å; A301-R305 WeakPolarHBondContact O-CB 3.36Å; A301-R305 PolarHBondContact O-N 2.83Å |
| 302 | Q | 92.5 | Very high | 90 | Very high | 68 Ų | 68 | 63.9 Ų | 63.9 | 32% | 0.318 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -69.8 | -36.7 | 177.6 | -62.9 | -52.1 | -24 | 0 | 0 | 112.9 | S103 I298 C299 R305 S306 | S103-Q302 PolarHBondContact OG-NE2 2.71Å; I298-Q302 HydrophobicContact CG2-CG 4.36Å; I298-Q302 WeakPolarHBondContact O-CG 3.35Å; I298-Q302 PolarHBondContact O-N 3.11Å; C299-Q302 PolarHBondContact O-N 3.5Å; Q302-R305 PolarHBondContact O-N 3.33Å; Q302-S306 WeakPolarHBondContact O-CB 3.39Å; Q302-S306 PolarHBondContact O-N 2.88Å; Q302-S306 PolarHBondContact O-OG 3.22Å |
| 303 | N | 91.7 | Very high | 90.1 | Very high | 99 Ų | 99 | 63.7 Ų | 63.7 | 53% | 0.529 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -62.9 | -52.4 | 175.3 | -73.5 | -16.9 | 0 | 0 | 0 | 110.2 | C299 F300 R305 S306 D307 | C299-N303 WeakPolarHBondContact O-CB 3.27Å; C299-N303 PolarHBondContact O-N 3.11Å; C299-N303 PolarHBondContact O-ND2 3.12Å; F300-N303 PolarHBondContact O-N 3.39Å; N303-R305 VanDerWaalsContact C-N 3.26Å; N303-R305 PolarHBondContact O-N 3.11Å; N303-S306 WeakPolarHBondContact O-CB 3.4Å; N303-S306 PolarHBondContact O-N 2.54Å; N303-D307 PolarHBondContact O-N 2.98Å |
| 304 | L | 89.9 | Confident | 90.2 | Very high | 27 Ų | 27 | 65.4 Ų | 65.4 | 14% | 0.141 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -60.4 | -37.4 | 178.2 | 178.9 | 70.4 | 0 | 0 | 0 | 111.6 | A91 L99 F300 D307 V308 | A91-L304 HydrophobicContact CB-CD2 3.93Å; L99-L304 HydrophobicContact CD1-CD2 4.39Å; L99-L304 HydrophobicContact CD2-CB 3.81Å; L99-L304 HydrophobicContact CD2-CD2 3.74Å; L99-L304 HydrophobicContact CD2-CG 3.77Å; F300-L304 HydrophobicContact CE1-CD2 4.5Å; F300-L304 WeakPolarHBondContact O-CB 3.36Å; F300-L304 PolarHBondContact O-N 2.85Å; L304-D307 PolarHBondContact O-N 2.71Å; L304-V308 VanDerWaalsContact O-CG2 3.29Å; L304-V308 WeakPolarHBondContact O-CG2 3.06Å; L304-V308 PolarHBondContact O-N 3.31Å |
| 305 | R | 92.1 | Very high | 89.9 | Confident | 77 Ų | 77 | 74.4 Ų | 74.4 | 29% | 0.291 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -61.8 | -45.1 | 173.2 | -175.2 | 176.8 | -178.6 | -177.3 | -1.4 | 112.1 | T96 L99 A301 Q302 N303 D307 V308 F309 | T96-R305 HydrophobicContact CG2-CG 4.13Å; L99-R305 HydrophobicContact CD2-CB 3.95Å; A301-R305 VanDerWaalsContact O-CB 3.28Å; A301-R305 WeakPolarHBondContact O-CB 3.36Å; A301-R305 PolarHBondContact O-N 2.83Å; Q302-R305 PolarHBondContact O-N 3.33Å; N303-R305 VanDerWaalsContact C-N 3.26Å; N303-R305 PolarHBondContact O-N 3.11Å; R305-D307 VanDerWaalsContact C-N 3.33Å; R305-V308 PolarHBondContact O-N 3.35Å; R305-F309 HydrophobicContact CG-CD2 3.92Å; R305-F309 HydrophobicContact CG-CE2 3.53Å; R305-F309 HydrophobicContact CG-CZ 4.41Å; R305-F309 VanDerWaalsContact NE-CE2 3.35Å; R305-F309 WeakPolarHBondContact O-CD2 3.35Å; R305-F309 PolarHBondContact O-N 3.46Å; R305-F309 VanDerWaalsContact O-N 3.09Å |
| 306 | S | 92.5 | Very high | 89.4 | Confident | 69 Ų | 69 | 78 Ų | 78 | 48% | 0.483 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -64.6 | -39.3 | 179.3 | -58.6 | 0 | 0 | 0 | 0 | 111.4 | Q302 N303 F309 A310 | Q302-S306 WeakPolarHBondContact O-CB 3.39Å; Q302-S306 PolarHBondContact O-N 2.88Å; Q302-S306 PolarHBondContact O-OG 3.22Å; N303-S306 WeakPolarHBondContact O-CB 3.4Å; N303-S306 PolarHBondContact O-N 2.54Å; S306-F309 PolarHBondContact O-N 2.84Å; S306-A310 WeakPolarHBondContact O-CB 3.24Å; S306-A310 PolarHBondContact O-N 2.72Å |
| 307 | D | 91.9 | Very high | 88.9 | Confident | 45 Ų | 45 | 81 Ų | 81 | 24% | 0.241 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -64.6 | -43 | 176 | -67.8 | -33.7 | 0 | 0 | 0 | 112.3 | M14 N303 L304 R305 F309 A310 Q311 | M14-D307 WeakPolarHBondContact CE-OD2 3.25Å; N303-D307 PolarHBondContact O-N 2.98Å; L304-D307 PolarHBondContact O-N 2.71Å; R305-D307 VanDerWaalsContact C-N 3.33Å; D307-F309 VanDerWaalsContact C-N 3.32Å; D307-F309 PolarHBondContact O-N 3.01Å; D307-A310 PolarHBondContact O-N 3.43Å; D307-Q311 WeakPolarHBondContact O-CB 3.38Å; D307-Q311 WeakPolarHBondContact O-CG 3.5Å; D307-Q311 PolarHBondContact O-N 3.04Å |
| 308 | V | 89.9 | Confident | 87.6 | Confident | 6 Ų | 6 | 83.4 Ų | 83.4 | 4% | 0.036 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -62.7 | -41 | 176.5 | 172.7 | 0 | 0 | 0 | 0 | 110.8 | E94 T96 L304 R305 Q311 R312 | E94-V308 HydrophobicContact CB-CG2 3.89Å; E94-V308 HydrophobicContact CG-CG2 4.31Å; T96-V308 HydrophobicContact CG2-CB 3.88Å; T96-V308 HydrophobicContact CG2-CG1 3.53Å; L304-V308 VanDerWaalsContact O-CG2 3.29Å; L304-V308 WeakPolarHBondContact O-CG2 3.06Å; L304-V308 PolarHBondContact O-N 3.31Å; R305-V308 PolarHBondContact O-N 3.35Å; V308-Q311 PolarHBondContact O-N 3.23Å; V308-R312 WeakPolarHBondContact O-CG 3.49Å; V308-R312 PolarHBondContact O-N 3.31Å |
| 309 | F | 91.5 | Very high | 85.5 | Confident | 96 Ų | 96 | 93.3 Ų | 93.3 | 42% | 0.421 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -65.1 | -42.2 | 174.4 | -74 | -52.8 | 0 | 0 | 0 | 112.5 | T96 R305 S306 D307 Q311 R312 A313 | T96-F309 HydrophobicContact CG2-CD1 4.49Å; T96-F309 HydrophobicContact CG2-CE1 4.15Å; T96-F309 HydrophobicContact CG2-CE2 4.35Å; T96-F309 HydrophobicContact CG2-CZ 4.08Å; R305-F309 HydrophobicContact CG-CD2 3.92Å; R305-F309 HydrophobicContact CG-CE2 3.53Å; R305-F309 HydrophobicContact CG-CZ 4.41Å; R305-F309 VanDerWaalsContact NE-CE2 3.35Å; R305-F309 WeakPolarHBondContact O-CD2 3.35Å; R305-F309 PolarHBondContact O-N 3.46Å; R305-F309 VanDerWaalsContact O-N 3.09Å; S306-F309 PolarHBondContact O-N 2.84Å; D307-F309 VanDerWaalsContact C-N 3.32Å; D307-F309 PolarHBondContact O-N 3.01Å; F309-Q311 VanDerWaalsContact C-N 3.32Å; F309-Q311 PolarHBondContact O-N 3.01Å; F309-R312 PolarHBondContact O-N 2.76Å; F309-A313 WeakPolarHBondContact O-CB 3.48Å; F309-A313 PolarHBondContact O-N 3.38Å |
| 310 | A | 90.2 | Very high | 85.1 | Confident | 44 Ų | 44 | 95 Ų | 95 | 36% | 0.364 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -62.6 | -39.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | S306 D307 R314 | S306-A310 WeakPolarHBondContact O-CB 3.24Å; S306-A310 PolarHBondContact O-N 2.72Å; D307-A310 PolarHBondContact O-N 3.43Å; A310-R314 WeakPolarHBondContact O-CG 3.28Å; A310-R314 PolarHBondContact O-N 3.21Å |
| 311 | Q | 89.5 | Confident | 84.9 | Confident | 77 Ų | 77 | 94 Ų | 94 | 36% | 0.36 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -62.8 | -51 | 173.5 | -78.6 | -177.7 | -1.2 | 0 | 0 | 111.5 | D307 V308 F309 A313 R314 W315 | D307-Q311 WeakPolarHBondContact O-CB 3.38Å; D307-Q311 WeakPolarHBondContact O-CG 3.5Å; D307-Q311 PolarHBondContact O-N 3.04Å; V308-Q311 PolarHBondContact O-N 3.23Å; F309-Q311 VanDerWaalsContact C-N 3.32Å; F309-Q311 PolarHBondContact O-N 3.01Å; Q311-A313 VanDerWaalsContact C-N 3.29Å; Q311-A313 PolarHBondContact O-N 2.99Å; Q311-R314 WeakPolarHBondContact O-CB 3.22Å; Q311-R314 PolarHBondContact O-N 3.44Å; Q311-R314 VanDerWaalsContact O-N 3.13Å; Q311-W315 PolarHBondContact O-N 2.94Å |
| 312 | R | 88.3 | Confident | 84.7 | Confident | 124 Ų | 124 | 99.2 Ų | 99.2 | 47% | 0.468 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -58.6 | -39.1 | 177.5 | -72.6 | -177.3 | -169.9 | -163.9 | 4.1 | 112.5 | V308 F309 R314 W315 H316 | V308-R312 WeakPolarHBondContact O-CG 3.49Å; V308-R312 PolarHBondContact O-N 3.31Å; F309-R312 PolarHBondContact O-N 2.76Å; R312-R314 VanDerWaalsContact C-N 3.35Å; R312-R314 PolarHBondContact O-N 3.3Å; R312-W315 PolarHBondContact O-N 3.28Å; R312-H316 PolarHBondContact O-CD2 3.15Å; R312-H316 PolarHBondContact O-N 3.47Å |
| 313 | A | 88.3 | Confident | 84.2 | Confident | 42 Ų | 42 | 101 Ų | 101 | 35% | 0.347 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.5 | -39.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | F309 Q311 W315 H316 F317 | F309-A313 WeakPolarHBondContact O-CB 3.48Å; F309-A313 PolarHBondContact O-N 3.38Å; Q311-A313 VanDerWaalsContact C-N 3.29Å; Q311-A313 PolarHBondContact O-N 2.99Å; A313-W315 VanDerWaalsContact C-N 3.32Å; A313-W315 PolarHBondContact O-N 2.78Å; A313-H316 PolarHBondContact O-N 3.38Å; A313-F317 VanDerWaalsContact O-CD2 3.31Å; A313-F317 WeakPolarHBondContact O-CD2 3.44Å; A313-F317 PolarHBondContact O-N 2.98Å; A313-F317 VanDerWaalsContact O-N 3.1Å |
| 314 | R | 88.1 | Confident | 83.7 | Confident | 146 Ų | 146 | 101.1 Ų | 101.1 | 55% | 0.551 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -58.7 | -43.2 | 174.9 | -72.5 | -169.3 | -70.5 | -95.8 | 12.5 | 112.1 | A310 Q311 R312 H316 F317 G318 | A310-R314 WeakPolarHBondContact O-CG 3.28Å; A310-R314 PolarHBondContact O-N 3.21Å; Q311-R314 WeakPolarHBondContact O-CB 3.22Å; Q311-R314 PolarHBondContact O-N 3.44Å; Q311-R314 VanDerWaalsContact O-N 3.13Å; R312-R314 VanDerWaalsContact C-N 3.35Å; R312-R314 PolarHBondContact O-N 3.3Å; R314-H316 VanDerWaalsContact C-N 3.33Å; R314-H316 PolarHBondContact O-N 2.85Å; R314-F317 PolarHBondContact O-N 3.24Å; R314-G318 PolarHBondContact O-N 3.07Å |
| 315 | W | 82.8 | Confident | 83.3 | Confident | 221 Ų | 221 | 106.1 Ų | 106.1 | 84% | 0.837 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -66.5 | -30.8 | 177.8 | -62.3 | 105.7 | 0 | 0 | 0 | 113.8 | Q311 R312 A313 | Q311-W315 PolarHBondContact O-N 2.94Å; R312-W315 PolarHBondContact O-N 3.28Å; A313-W315 VanDerWaalsContact C-N 3.32Å; A313-W315 PolarHBondContact O-N 2.78Å |
| 316 | H | 81.7 | Confident | 82.7 | Confident | 155 Ų | 155 | 108.1 Ų | 108.1 | 72% | 0.718 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -80.3 | -29.8 | 178.9 | -77.9 | -65.1 | 0 | 0 | 0 | 114 | R312 A313 R314 | R312-H316 PolarHBondContact O-CD2 3.15Å; R312-H316 PolarHBondContact O-N 3.47Å; A313-H316 PolarHBondContact O-N 3.38Å; R314-H316 VanDerWaalsContact C-N 3.33Å; R314-H316 PolarHBondContact O-N 2.85Å |
| 317 | F | 77.1 | Confident | 81.9 | Confident | 180 Ų | 180 | 111.2 Ų | 111.2 | 79% | 0.789 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -107.6 | -1 | -175.3 | -64.4 | -68.7 | 0 | 0 | 0 | 114.9 | A313 R314 M319 | A313-F317 VanDerWaalsContact O-CD2 3.31Å; A313-F317 WeakPolarHBondContact O-CD2 3.44Å; A313-F317 PolarHBondContact O-N 2.98Å; A313-F317 VanDerWaalsContact O-N 3.1Å; R314-F317 PolarHBondContact O-N 3.24Å; F317-M319 PolarHBondContact O-N 3.16Å; F317-M319 VanDerWaalsContact O-N 3.15Å |
| 318 | G | 59.7 | Low | 81.1 | Confident | 65 Ų | 65 | 116.7 Ų | 116.7 | 67% | 0.67 | 56% | 0.564 | S | S | * | * | trans | 54.9 | 41.2 | 150.7 | 0 | 0 | 0 | 0 | 0 | 117.9 | R314 | R314-G318 PolarHBondContact O-N 3.07Š| ||
| 319 | M | 46 | Very low | 80.3 | Confident | 244 Ų | 244 | 126.7 Ų | 126.7 | 100% | 1.202 | 61% | 0.612 | S | S | * | * | trans | -84.6 | 0 | 141.1 | -70.5 | -170.5 | -67.9 | 0 | 0 | 108.6 | F317 | F317-M319 PolarHBondContact O-N 3.16Å; F317-M319 VanDerWaalsContact O-N 3.15Å |
Retrieved 319 of 319 residues in 90.3 ms
(Link to these results)