| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 41.8 | Very low | 40.7 | Very low | 205 Ų | 205 | 100.5 Ų | 100.5 | 100% | 1.01 | 58% | 0.581 | S | S | * | * | 0 | -37.7 | 0 | -81.6 | 179 | 170.2 | 0 | 0 | 113.6 | T3 | M1-T3 PolarHBondContact O-N 3.1Š| |||
| 2 | G | 37.2 | Very low | 41.8 | Very low | 62 Ų | 62 | 99.2 Ų | 99.2 | 64% | 0.639 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -62.5 | -34.2 | -178.5 | 0 | 0 | 0 | 0 | 0 | 116.3 | G6 | G2-G6 PolarHBondContact O-N 3.16Å; G2-G6 VanDerWaalsContact O-N 3.08Å |
| 3 | T | 42 | Very low | 42.8 | Very low | 122 Ų | 122 | 104.1 Ų | 104.1 | 75% | 0.748 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -72 | -34.5 | -176.3 | -16.8 | 0 | 0 | 0 | 0 | 113.5 | M1 L7 | M1-T3 PolarHBondContact O-N 3.1Å; T3-L7 PolarHBondContact O-N 3.25Å; T3-L7 VanDerWaalsContact O-N 3.11Å |
| 4 | L | 36.1 | Very low | 43.2 | Very low | 128 Ų | 128 | 100.2 Ų | 100.2 | 67% | 0.67 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -72.5 | -36.7 | 177 | -85.7 | 155.3 | 0 | 0 | 0 | 112.1 | G8 | L4-G8 PolarHBondContact O-N 3.36Å |
| 5 | I | 44.1 | Very low | 43.4 | Very low | 110 Ų | 110 | 99.9 Ų | 99.9 | 56% | 0.564 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -68 | -39.9 | 174.8 | -61.5 | 170.5 | 0 | 0 | 0 | 110.1 | G8 L9 | I5-G8 PolarHBondContact O-N 3.43Å; I5-L9 HydrophobicContact CG2-CD1 3.97Å; I5-L9 WeakPolarHBondContact O-CB 3.45Å; I5-L9 PolarHBondContact O-N 3.14Å |
| 6 | G | 34.5 | Very low | 44.4 | Very low | 33 Ų | 33 | 97.7 Ų | 97.7 | 34% | 0.34 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -62.3 | -42.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | G2 M10 | G2-G6 PolarHBondContact O-N 3.16Å; G2-G6 VanDerWaalsContact O-N 3.08Å; G6-M10 PolarHBondContact O-N 2.93Å |
| 7 | L | 41.8 | Very low | 45.2 | Very low | 112 Ų | 112 | 98.2 Ų | 98.2 | 59% | 0.586 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -66.4 | -44.1 | 175.6 | -130.5 | 91.1 | 0 | 0 | 0 | 111.3 | T3 L9 M10 F11 | T3-L7 PolarHBondContact O-N 3.25Å; T3-L7 VanDerWaalsContact O-N 3.11Å; L7-L9 PolarHBondContact O-N 3.38Å; L7-M10 PolarHBondContact O-N 3.33Å; L7-F11 WeakPolarHBondContact O-CB 3.49Å; L7-F11 PolarHBondContact O-N 3.45Å |
| 8 | G | 35.2 | Very low | 45.3 | Very low | 36 Ų | 36 | 96.6 Ų | 96.6 | 37% | 0.371 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -56.6 | -48.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | L4 I5 F11 T12 | L4-G8 PolarHBondContact O-N 3.36Å; I5-G8 PolarHBondContact O-N 3.43Å; G8-F11 WeakPolarHBondContact O-CB 3.46Å; G8-F11 PolarHBondContact O-N 3.46Å; G8-F11 VanDerWaalsContact O-N 3.15Å; G8-T12 PolarHBondContact O-N 3.42Å; G8-T12 PolarHBondContact O-OG1 2.83Å |
| 9 | L | 44.2 | Very low | 45.4 | Very low | 95 Ų | 95 | 98.3 Ų | 98.3 | 50% | 0.497 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -66.7 | -38.5 | 179.2 | -109.8 | 129.5 | 0 | 0 | 0 | 113.7 | I5 L7 F11 R13 | I5-L9 HydrophobicContact CG2-CD1 3.97Å; I5-L9 WeakPolarHBondContact O-CB 3.45Å; I5-L9 PolarHBondContact O-N 3.14Å; L7-L9 PolarHBondContact O-N 3.38Å; L9-F11 PolarHBondContact O-N 3.5Å; L9-R13 WeakPolarHBondContact O-CB 3.25Å; L9-R13 WeakPolarHBondContact O-CG 3.49Å; L9-R13 PolarHBondContact O-N 3.08Å; L9-R13 VanDerWaalsContact O-N 3.12Å |
| 10 | M | 46.7 | Very low | 45.8 | Very low | 138 Ų | 138 | 100.4 Ų | 100.4 | 68% | 0.68 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -63 | -36.3 | 172 | -76.8 | -149 | -99.6 | 0 | 0 | 111.2 | G6 L7 A14 | G6-M10 PolarHBondContact O-N 2.93Å; L7-M10 PolarHBondContact O-N 3.33Å; M10-A14 WeakPolarHBondContact O-CB 3.48Å; M10-A14 PolarHBondContact O-N 2.95Å |
| 11 | F | 44 | Very low | 45.7 | Very low | 65 Ų | 65 | 100.8 Ų | 100.8 | 29% | 0.285 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -72.4 | -43.7 | -180 | -143.1 | -97.1 | 0 | 0 | 0 | 113.1 | L7 G8 L9 R13 A14 L15 M204 | L7-F11 WeakPolarHBondContact O-CB 3.49Å; L7-F11 PolarHBondContact O-N 3.45Å; G8-F11 WeakPolarHBondContact O-CB 3.46Å; G8-F11 PolarHBondContact O-N 3.46Å; G8-F11 VanDerWaalsContact O-N 3.15Å; L9-F11 PolarHBondContact O-N 3.5Å; F11-R13 VanDerWaalsContact C-N 3.28Å; F11-R13 PolarHBondContact O-N 2.95Å; F11-A14 PolarHBondContact O-N 3.34Å; F11-L15 HydrophobicContact CD1-CD1 3.96Å; F11-L15 HydrophobicContact CD1-CG 4.48Å; F11-L15 HydrophobicContact CE1-CD1 4.33Å; F11-L15 PolarHBondContact O-N 3.39Å; F11-M204 HydrophobicContact CE1-CE 3.7Å; F11-M204 HydrophobicContact CE1-SD 4.21Å; F11-M204 HydrophobicContact CE2-CE 4.02Å; F11-M204 HydrophobicContact CE2-SD 4.35Å; F11-M204 HydrophobicContact CZ-CE 3.25Å; F11-M204 HydrophobicContact CZ-SD 3.47Å; F11-M204 WeakPolarHBondContact CZ-SD 3.47Å |
| 12 | T | 53.6 | Low | 45.7 | Very low | 84 Ų | 84 | 94.8 Ų | 94.8 | 52% | 0.515 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.6 | -39.9 | 175.2 | -23.2 | 0 | 0 | 0 | 0 | 110.6 | G8 L15 T16 | G8-T12 PolarHBondContact O-N 3.42Å; G8-T12 PolarHBondContact O-OG1 2.83Å; T12-L15 PolarHBondContact O-N 3.17Å; T12-T16 WeakPolarHBondContact O-CG2 3.45Å; T12-T16 PolarHBondContact O-N 3.38Å; T12-T16 PolarHBondContact O-OG1 3.4Å; T12-T16 VanDerWaalsContact O-OG1 3.1Å |
| 13 | R | 55.4 | Low | 46.1 | Very low | 163 Ų | 163 | 99 Ų | 99 | 62% | 0.615 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -60.6 | -47.8 | 174.1 | -78.5 | -177.2 | 179.4 | 179 | 0.6 | 111.8 | L9 F11 L15 T16 E17 | L9-R13 WeakPolarHBondContact O-CB 3.25Å; L9-R13 WeakPolarHBondContact O-CG 3.49Å; L9-R13 PolarHBondContact O-N 3.08Å; L9-R13 VanDerWaalsContact O-N 3.12Å; F11-R13 VanDerWaalsContact C-N 3.28Å; F11-R13 PolarHBondContact O-N 2.95Å; R13-L15 VanDerWaalsContact C-N 3.31Å; R13-L15 PolarHBondContact O-N 3.46Å; R13-T16 WeakPolarHBondContact CA-OG1 3.42Å; R13-T16 PolarHBondContact O-N 2.72Å; R13-T16 PolarHBondContact O-OG1 2.99Å; R13-E17 WeakPolarHBondContact O-CB 3.45Å; R13-E17 WeakPolarHBondContact O-CG 3.38Å; R13-E17 PolarHBondContact O-N 3.48Å |
| 14 | A | 48.4 | Very low | 46.4 | Very low | 50 Ų | 50 | 97.8 Ų | 97.8 | 41% | 0.413 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -58.8 | -42 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | M10 F11 V18 | M10-A14 WeakPolarHBondContact O-CB 3.48Å; M10-A14 PolarHBondContact O-N 2.95Å; F11-A14 PolarHBondContact O-N 3.34Å; A14-V18 WeakPolarHBondContact O-CB 3.26Å; A14-V18 WeakPolarHBondContact O-CG2 3.47Å; A14-V18 PolarHBondContact O-N 3.23Å |
| 15 | L | 46.4 | Very low | 46.7 | Very low | 96 Ų | 96 | 95.1 Ų | 95.1 | 50% | 0.503 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.7 | -47 | 175.5 | -78 | 165.9 | 0 | 0 | 0 | 112.1 | F11 T12 R13 E17 V18 E19 | F11-L15 HydrophobicContact CD1-CD1 3.96Å; F11-L15 HydrophobicContact CD1-CG 4.48Å; F11-L15 HydrophobicContact CE1-CD1 4.33Å; F11-L15 PolarHBondContact O-N 3.39Å; T12-L15 PolarHBondContact O-N 3.17Å; R13-L15 VanDerWaalsContact C-N 3.31Å; R13-L15 PolarHBondContact O-N 3.46Å; L15-E17 PolarHBondContact O-N 3.31Å; L15-V18 PolarHBondContact O-N 3.1Å; L15-E19 WeakPolarHBondContact O-CB 3.41Å; L15-E19 PolarHBondContact O-N 3.39Å |
| 16 | T | 59.8 | Low | 46.5 | Very low | 64 Ų | 64 | 99.9 Ų | 99.9 | 39% | 0.393 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.9 | -35.4 | 179.4 | 54.3 | 0 | 0 | 0 | 0 | 112.9 | T12 R13 E19 Q20 | T12-T16 WeakPolarHBondContact O-CG2 3.45Å; T12-T16 PolarHBondContact O-N 3.38Å; T12-T16 PolarHBondContact O-OG1 3.4Å; T12-T16 VanDerWaalsContact O-OG1 3.1Å; R13-T16 WeakPolarHBondContact CA-OG1 3.42Å; R13-T16 PolarHBondContact O-N 2.72Å; R13-T16 PolarHBondContact O-OG1 2.99Å; T16-E19 PolarHBondContact O-N 3.46Å; T16-Q20 WeakPolarHBondContact O-CB 3.13Å; T16-Q20 WeakPolarHBondContact O-CG 3.45Å; T16-Q20 PolarHBondContact O-N 3.44Å |
| 17 | E | 56.8 | Low | 46.8 | Very low | 107 Ų | 107 | 105 Ų | 105 | 50% | 0.5 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -68.6 | -38 | 175.8 | -77.8 | -175.2 | -166.2 | 0 | 0 | 111.7 | R13 L15 K21 | R13-E17 WeakPolarHBondContact O-CB 3.45Å; R13-E17 WeakPolarHBondContact O-CG 3.38Å; R13-E17 PolarHBondContact O-N 3.48Å; L15-E17 PolarHBondContact O-N 3.31Å; E17-K21 WeakPolarHBondContact O-CB 3.38Å; E17-K21 WeakPolarHBondContact O-CG 3.37Å; E17-K21 PolarHBondContact O-N 3.38Å |
| 18 | V | 46.7 | Very low | 46.6 | Very low | 69 Ų | 69 | 101.7 Ų | 101.7 | 42% | 0.418 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.4 | -42 | 173.7 | 171.2 | 0 | 0 | 0 | 0 | 110.2 | A14 L15 M22 | A14-V18 WeakPolarHBondContact O-CB 3.26Å; A14-V18 WeakPolarHBondContact O-CG2 3.47Å; A14-V18 PolarHBondContact O-N 3.23Å; L15-V18 PolarHBondContact O-N 3.1Å; V18-M22 HydrophobicContact CG1-CE 4.15Å; V18-M22 VanDerWaalsContact O-CG 3.3Å; V18-M22 WeakPolarHBondContact O-CG 3.4Å; V18-M22 PolarHBondContact O-N 3.21Å |
| 19 | E | 48.5 | Very low | 46.6 | Very low | 128 Ų | 128 | 105 Ų | 105 | 60% | 0.598 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -67.7 | -44 | 179.1 | -161.1 | 173.2 | -170.3 | 0 | 0 | 113 | L15 T16 M22 Q23 | L15-E19 WeakPolarHBondContact O-CB 3.41Å; L15-E19 PolarHBondContact O-N 3.39Å; T16-E19 PolarHBondContact O-N 3.46Å; E19-M22 HydrophobicContact CB-CE 4.49Å; E19-M22 WeakPolarHBondContact O-CB 3.46Å; E19-M22 PolarHBondContact O-N 3.4Å; E19-Q23 PolarHBondContact O-N 2.93Å |
| 20 | Q | 51.9 | Low | 46.2 | Very low | 140 Ų | 140 | 105.4 Ų | 105.4 | 65% | 0.654 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -64.2 | -41.6 | 175.5 | -76.8 | -173.7 | -19.6 | 0 | 0 | 112.1 | T16 M22 Q23 V24 | T16-Q20 WeakPolarHBondContact O-CB 3.13Å; T16-Q20 WeakPolarHBondContact O-CG 3.45Å; T16-Q20 PolarHBondContact O-N 3.44Å; Q20-M22 VanDerWaalsContact C-N 3.27Å; Q20-M22 PolarHBondContact O-N 3.21Å; Q20-Q23 PolarHBondContact O-N 3.16Å; Q20-V24 PolarHBondContact O-N 2.98Å |
| 21 | K | 44.1 | Very low | 45.3 | Very low | 110 Ų | 110 | 105.6 Ų | 105.6 | 48% | 0.478 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -67.4 | -27.8 | 175.2 | -74.9 | 177.6 | 178.2 | 171.7 | 0 | 112.3 | E17 N25 | E17-K21 WeakPolarHBondContact O-CB 3.38Å; E17-K21 WeakPolarHBondContact O-CG 3.37Å; E17-K21 PolarHBondContact O-N 3.38Å; K21-N25 WeakPolarHBondContact O-CB 3.29Å; K21-N25 PolarHBondContact O-N 3.11Å |
| 22 | M | 41.6 | Very low | 44.6 | Very low | 79 Ų | 79 | 111 Ų | 111 | 39% | 0.389 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -66.6 | -38.4 | 172.9 | -81.4 | -164.8 | -72.5 | 0 | 0 | 112.9 | V18 E19 Q20 N25 R26 Y197 | V18-M22 HydrophobicContact CG1-CE 4.15Å; V18-M22 VanDerWaalsContact O-CG 3.3Å; V18-M22 WeakPolarHBondContact O-CG 3.4Å; V18-M22 PolarHBondContact O-N 3.21Å; E19-M22 HydrophobicContact CB-CE 4.49Å; E19-M22 WeakPolarHBondContact O-CB 3.46Å; E19-M22 PolarHBondContact O-N 3.4Å; Q20-M22 VanDerWaalsContact C-N 3.27Å; Q20-M22 PolarHBondContact O-N 3.21Å; M22-N25 PolarHBondContact O-N 2.75Å; M22-R26 PolarHBondContact O-N 3.32Å; M22-Y197 HydrophobicContact CE-CE1 4.19Å; M22-Y197 HydrophobicContact SD-CE1 3.64Å; M22-Y197 HydrophobicContact SD-CE2 4.48Å; M22-Y197 VanDerWaalsContact SD-CZ 3.54Å; M22-Y197 PolarHBondContact SD-OH 3.16Å |
| 23 | Q | 45.8 | Very low | 43.5 | Very low | 149 Ų | 149 | 115.3 Ų | 115.3 | 70% | 0.696 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -65.1 | -45.1 | 175.8 | -74.2 | -155.4 | -32.8 | 0 | 0 | 111.7 | E19 Q20 N25 R26 E27 | E19-Q23 PolarHBondContact O-N 2.93Å; Q20-Q23 PolarHBondContact O-N 3.16Å; Q23-N25 VanDerWaalsContact C-N 3.33Å; Q23-N25 PolarHBondContact O-N 2.85Å; Q23-R26 PolarHBondContact O-N 3.03Å; Q23-E27 PolarHBondContact O-N 3.38Å |
| 24 | V | 49.2 | Very low | 42.2 | Very low | 97 Ų | 97 | 111.5 Ų | 111.5 | 59% | 0.588 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -64.7 | -36.9 | 177.6 | -179.7 | 0 | 0 | 0 | 0 | 111.6 | Q20 E27 S28 | Q20-V24 PolarHBondContact O-N 2.98Å; V24-E27 PolarHBondContact O-N 3.47Å; V24-S28 PolarHBondContact O-N 3.01Å |
| 25 | N | 41.8 | Very low | 41.1 | Very low | 72 Ų | 72 | 117.3 Ų | 117.3 | 39% | 0.385 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -74.6 | -29.9 | 179.5 | -156.2 | 18.9 | 0 | 0 | 0 | 113.1 | K21 M22 Q23 E27 S28 Q29 | K21-N25 WeakPolarHBondContact O-CB 3.29Å; K21-N25 PolarHBondContact O-N 3.11Å; M22-N25 PolarHBondContact O-N 2.75Å; Q23-N25 VanDerWaalsContact C-N 3.33Å; Q23-N25 PolarHBondContact O-N 2.85Å; N25-E27 VanDerWaalsContact C-N 3.33Å; N25-S28 PolarHBondContact O-N 2.85Å; N25-S28 PolarHBondContact O-OG 2.87Å; N25-S28 PolarHBondContact OD1-OG 3.43Å; N25-Q29 PolarHBondContact O-N 3.29Å |
| 26 | R | 41.2 | Very low | 40.1 | Very low | 210 Ų | 210 | 118.5 Ų | 118.5 | 79% | 0.792 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -60.6 | -43.8 | 169.8 | -113.9 | -174.6 | -160.9 | -178.9 | 7.2 | 111.5 | M22 Q23 Q29 T30 | M22-R26 PolarHBondContact O-N 3.32Å; Q23-R26 PolarHBondContact O-N 3.03Å; R26-Q29 PolarHBondContact O-N 2.89Å; R26-T30 PolarHBondContact O-N 3.38Å |
| 27 | E | 39.3 | Very low | 38.6 | Very low | 141 Ų | 141 | 123.3 Ų | 123.3 | 66% | 0.659 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -69.5 | -32.3 | 176.9 | -68.1 | -177.6 | 167.5 | 0 | 0 | 112.7 | Q23 V24 N25 T30 | Q23-E27 PolarHBondContact O-N 3.38Å; V24-E27 PolarHBondContact O-N 3.47Å; N25-E27 VanDerWaalsContact C-N 3.33Å; E27-T30 PolarHBondContact O-OG1 3.1Å |
| 28 | S | 38.6 | Very low | 37.3 | Very low | 42 Ų | 42 | 123.5 Ų | 123.5 | 29% | 0.294 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -68.6 | -40.3 | 176.1 | 99.3 | 0 | 0 | 0 | 0 | 111.7 | V24 N25 K31 W32 | V24-S28 PolarHBondContact O-N 3.01Å; N25-S28 PolarHBondContact O-N 2.85Å; N25-S28 PolarHBondContact O-OG 2.87Å; N25-S28 PolarHBondContact OD1-OG 3.43Å; S28-K31 VanDerWaalsContact O-CB 3.32Å; S28-K31 WeakPolarHBondContact O-CB 3.45Å; S28-K31 PolarHBondContact O-N 2.83Å; S28-W32 PolarHBondContact O-N 2.98Å |
| 29 | Q | 34.9 | Very low | 36.1 | Very low | 106 Ų | 106 | 130.6 Ų | 130.6 | 50% | 0.495 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -77.5 | -29.2 | -176.5 | -72.9 | -146.7 | -19.7 | 0 | 0 | 114.5 | N25 R26 K31 W32 H33 | N25-Q29 PolarHBondContact O-N 3.29Å; R26-Q29 PolarHBondContact O-N 2.89Å; Q29-K31 PolarHBondContact O-N 3.23Å; Q29-W32 PolarHBondContact O-N 3.03Å; Q29-W32 VanDerWaalsContact O-N 3.07Å; Q29-H33 PolarHBondContact O-N 3.36Å; Q29-H33 VanDerWaalsContact O-N 3.11Å |
| 30 | T | 35.1 | Very low | 35.1 | Very low | 104 Ų | 104 | 133.1 Ų | 133.1 | 64% | 0.638 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -61.7 | -28 | 168.8 | 53.9 | 0 | 0 | 0 | 0 | 111.6 | R26 E27 S34 | R26-T30 PolarHBondContact O-N 3.38Å; E27-T30 PolarHBondContact O-OG1 3.1Å; T30-S34 PolarHBondContact O-OG 3.45Å |
| 31 | K | 29.2 | Very low | 33.9 | Very low | 141 Ų | 141 | 131.7 Ų | 131.7 | 61% | 0.613 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -80.1 | -22.8 | 174.3 | -147.8 | 173.7 | -172.5 | 173.9 | 0 | 113.9 | S28 Q29 S34 | S28-K31 VanDerWaalsContact O-CB 3.32Å; S28-K31 WeakPolarHBondContact O-CB 3.45Å; S28-K31 PolarHBondContact O-N 2.83Å; Q29-K31 PolarHBondContact O-N 3.23Å; K31-S34 PolarHBondContact O-OG 2.95Å |
| 32 | W | 28 | Very low | 32.9 | Very low | 178 Ų | 178 | 134.8 Ų | 134.8 | 67% | 0.674 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -81.5 | -35 | 175.7 | -83.8 | 101.2 | 0 | 0 | 0 | 112.7 | S28 Q29 S34 R35 | S28-W32 PolarHBondContact O-N 2.98Å; Q29-W32 PolarHBondContact O-N 3.03Å; Q29-W32 VanDerWaalsContact O-N 3.07Å; W32-S34 PolarHBondContact O-N 3.03Å; W32-S34 VanDerWaalsContact O-N 3.17Å; W32-R35 PolarHBondContact O-N 2.83Å |
| 33 | H | 30.5 | Very low | 32.3 | Very low | 175 Ų | 175 | 136.7 Ų | 136.7 | 81% | 0.81 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.9 | -7.4 | 175 | -77.9 | 1.2 | 0 | 0 | 0 | 114.4 | Q29 | Q29-H33 PolarHBondContact O-N 3.36Å; Q29-H33 VanDerWaalsContact O-N 3.11Å |
| 34 | S | 28.1 | Very low | 31.6 | Very low | 84 Ų | 84 | 138.1 Ų | 138.1 | 59% | 0.587 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.2 | 4.5 | 179.5 | 38.4 | 0 | 0 | 0 | 0 | 114.5 | T30 K31 W32 P36 | T30-S34 PolarHBondContact O-OG 3.45Å; K31-S34 PolarHBondContact O-OG 2.95Å; W32-S34 PolarHBondContact O-N 3.03Å; W32-S34 VanDerWaalsContact O-N 3.17Å; S34-P36 VanDerWaalsContact O-CD 3.31Å; S34-P36 WeakPolarHBondContact O-CD 3.39Å |
| 35 | R | 24.8 | Very low | 30.4 | Very low | 172 Ų | 172 | 140.8 Ų | 140.8 | 65% | 0.649 | 70% | 0.697 | S | S | * | * | trans | -93.1 | 112 | 172.1 | -68 | -163.9 | -165.7 | -146.2 | 7.9 | 111 | W32 L37 | W32-R35 PolarHBondContact O-N 2.83Å; R35-L37 PolarHBondContact O-N 3.15Å | ||
| 36 | P | 26.8 | Very low | 29.9 | Very low | 121 Ų | 121 | 146.1 Ų | 146.1 | 79% | 0.786 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 133.7 | 169.8 | 24.3 | -30.2 | 0 | 0 | 0 | 109.9 | S34 | S34-P36 VanDerWaalsContact O-CD 3.31Å; S34-P36 WeakPolarHBondContact O-CD 3.39Å |
| 37 | L | 28.8 | Very low | 29.1 | Very low | 164 Ų | 164 | 140.2 Ų | 140.2 | 86% | 0.859 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -51.9 | 129.3 | 177.7 | -80.6 | 152 | 0 | 0 | 0 | 110.4 | R35 Y39 | R35-L37 PolarHBondContact O-N 3.15Å; L37-Y39 PolarHBondContact O-N 2.89Å; L37-Y39 VanDerWaalsContact O-N 3.16Å |
| 38 | P | 27.5 | Very low | 28.7 | Very low | 111 Ų | 111 | 140.1 Ų | 140.1 | 72% | 0.721 | 72% | 0.721 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 118.6 | 176.9 | 25.7 | -30.6 | 0 | 0 | 0 | 109.7 | M40 | P38-M40 VanDerWaalsContact C-N 3.3Å; P38-M40 PolarHBondContact O-N 3.37Å |
| 39 | Y | 21.9 | Very low | 28.2 | Very low | 218 Ų | 218 | 142.8 Ų | 142.8 | 86% | 0.855 | 75% | 0.745 | S | S | * | * | trans | -62.2 | 88.7 | 165.8 | -134.1 | -98.2 | 0 | 0 | 0 | 107.9 | L37 T41 | L37-Y39 PolarHBondContact O-N 2.89Å; L37-Y39 VanDerWaalsContact O-N 3.16Å; Y39-T41 HydrophobicContact CD1-CG2 4.42Å; Y39-T41 PolarHBondContact O-N 3.11Å | ||
| 40 | M | 28.4 | Very low | 28.2 | Very low | 182 Ų | 182 | 144.8 Ų | 144.8 | 90% | 0.897 | 76% | 0.764 | S | S | * | * | trans | -83.8 | 89.4 | 167.8 | -86.5 | -148.2 | 177.8 | 0 | 0 | 109.6 | P38 Q42 | P38-M40 VanDerWaalsContact C-N 3.3Å; P38-M40 PolarHBondContact O-N 3.37Å; M40-Q42 PolarHBondContact O-N 3.08Å | ||
| 41 | T | 25.8 | Very low | 27.9 | Very low | 109 Ų | 109 | 145.5 Ų | 145.5 | 67% | 0.669 | 77% | 0.769 | S | S | * | * | trans | -53.4 | 115.1 | 147.4 | 41.3 | 0 | 0 | 0 | 0 | 110.7 | Y39 | Y39-T41 HydrophobicContact CD1-CG2 4.42Å; Y39-T41 PolarHBondContact O-N 3.11Å | ||
| 42 | Q | 24.2 | Very low | 27.8 | Very low | 175 Ų | 175 | 145.9 Ų | 145.9 | 82% | 0.818 | 78% | 0.777 | S | S | * | * | 159.6 | 125.8 | 117.8 | -93.9 | 178.9 | -31 | 0 | 0 | 110.6 | M40 L44 | M40-Q42 PolarHBondContact O-N 3.08Å; Q42-L44 PolarHBondContact O-N 3.21Å | |||
| 43 | P | 28.6 | Very low | 28.1 | Very low | 120 Ų | 120 | 143 Ų | 143 | 78% | 0.779 | 78% | 0.781 | S | S | * | * | trans | -70.3 | 127.5 | 170.4 | 28.7 | -30.9 | 0 | 0 | 0 | 109.5 | Q45 | P43-Q45 PolarHBondContact O-N 3.39Å; P43-Q45 VanDerWaalsContact O-N 3.12Å | ||
| 44 | L | 30.2 | Very low | 28.1 | Very low | 178 Ų | 178 | 141.9 Ų | 141.9 | 93% | 0.932 | 78% | 0.78 | S | S | * | * | trans | -56.6 | 117 | 175.4 | -138.5 | 87.2 | 0 | 0 | 0 | 108.9 | Q42 L46 | Q42-L44 PolarHBondContact O-N 3.21Å; L44-L46 PolarHBondContact O-N 3.41Å | ||
| 45 | Q | 24.8 | Very low | 28.3 | Very low | 154 Ų | 154 | 145.7 Ų | 145.7 | 72% | 0.72 | 79% | 0.793 | S | S | * | * | trans | -58.4 | 112.3 | 178.2 | -69.4 | -108.7 | -53.4 | 0 | 0 | 110.8 | P43 T47 | P43-Q45 PolarHBondContact O-N 3.39Å; P43-Q45 VanDerWaalsContact O-N 3.12Å; Q45-T47 PolarHBondContact O-N 3.27Å | ||
| 46 | L | 30.6 | Very low | 28.7 | Very low | 183 Ų | 183 | 145.3 Ų | 145.3 | 96% | 0.958 | 80% | 0.803 | S | S | * | * | trans | -85.9 | 66.2 | 160 | -163.6 | 77.9 | 0 | 0 | 0 | 108.3 | L44 | L44-L46 PolarHBondContact O-N 3.41Š| ||
| 47 | T | 25.9 | Very low | 29 | Very low | 87 Ų | 87 | 150 Ų | 150 | 53% | 0.534 | 81% | 0.805 | S | S | . | * | trans | -99.3 | 143.7 | 168.9 | 37.2 | 0 | 0 | 0 | 0 | 109.2 | Q45 | Q45-T47 PolarHBondContact O-N 3.27Š| ||
| 48 | T | 30.5 | Very low | 28.9 | Very low | 139 Ų | 139 | 146.4 Ų | 146.4 | 85% | 0.853 | 80% | 0.799 | S | S | * | * | S | Bend | trans | 70.9 | 85 | 168.8 | 45.9 | 0 | 0 | 0 | 0 | 117.4 | ||
| 49 | A | 28.5 | Very low | 28.8 | Very low | 97 Ų | 97 | 149.7 Ų | 149.7 | 80% | 0.802 | 81% | 0.807 | S | S | * | * | 174 | 63.2 | 121.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 50 | V | 34.6 | Very low | 29.2 | Very low | 148 Ų | 148 | 144 Ų | 144 | 90% | 0.897 | 80% | 0.799 | S | S | * | * | trans | -147 | 106.7 | 144.1 | -170.8 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 51 | T | 28.2 | Very low | 29 | Very low | 120 Ų | 120 | 142 Ų | 142 | 74% | 0.736 | 80% | 0.798 | S | S | * | * | trans | -65.3 | 141.4 | 176.4 | -20.9 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 52 | L | 26.6 | Very low | 29 | Very low | 148 Ų | 148 | 141.1 Ų | 141.1 | 78% | 0.775 | 80% | 0.795 | S | S | * | * | trans | 53.7 | 96.1 | 155 | -104.9 | 66 | 0 | 0 | 0 | 116.4 | ||||
| 53 | P | 34.3 | Very low | 29 | Very low | 118 Ų | 118 | 144.1 Ų | 144.1 | 77% | 0.766 | 80% | 0.799 | S | S | * | * | S | Bend | -156.2 | 92 | 84.8 | 36.4 | -14.1 | 0 | 0 | 0 | 113.1 | |||
| 54 | L | 31.7 | Very low | 29.1 | Very low | 151 Ų | 151 | 146.9 Ų | 146.9 | 79% | 0.791 | 81% | 0.807 | S | S | * | * | S | Bend | trans | -139.6 | 0.4 | 168.6 | -112.1 | 148 | 0 | 0 | 0 | 114.1 | L56 | L54-L56 PolarHBondContact O-N 3.44Š|
| 55 | L | 31.8 | Very low | 28.9 | Very low | 164 Ų | 164 | 143.7 Ų | 143.7 | 86% | 0.859 | 80% | 0.799 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.4 | 2.3 | 167.4 | -120 | 153.3 | 0 | 0 | 0 | 113.1 | ||
| 56 | L | 33.6 | Very low | 28.9 | Very low | 165 Ų | 165 | 140.9 Ų | 140.9 | 86% | 0.864 | 80% | 0.796 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114.5 | 17.6 | -176.2 | -111.8 | 150.7 | 0 | 0 | 0 | 115 | L54 | L54-L56 PolarHBondContact O-N 3.44Š|
| 57 | R | 31.7 | Very low | 28.8 | Very low | 219 Ų | 219 | 137.7 Ų | 137.7 | 83% | 0.826 | 79% | 0.785 | S | S | * | * | S | Bend | trans | -127.1 | 0.6 | 170.1 | -139.9 | 170.2 | -170.5 | 152.7 | 2.2 | 115.9 | M59 | R57-M59 PolarHBondContact O-N 3Š|
| 58 | A | 27.3 | Very low | 28.9 | Very low | 88 Ų | 88 | 139.2 Ų | 139.2 | 73% | 0.727 | 79% | 0.794 | S | S | * | * | S | Bend | trans | -78.6 | 4.6 | 169.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||
| 59 | M | 25.6 | Very low | 28.7 | Very low | 180 Ų | 180 | 141.4 Ų | 141.4 | 89% | 0.887 | 80% | 0.797 | S | S | * | * | trans | -113.3 | 71.6 | 171.3 | -72.5 | -174.7 | 57.5 | 0 | 0 | 110.9 | R57 | R57-M59 PolarHBondContact O-N 3Š| ||
| 60 | S | 29.8 | Very low | 29.1 | Very low | 100 Ų | 100 | 142.6 Ų | 142.6 | 70% | 0.699 | 79% | 0.794 | S | S | * | * | trans | -157.6 | 60.1 | 156.4 | -166.4 | 0 | 0 | 0 | 0 | 109.8 | S62 | S60-S62 PolarHBondContact O-N 3.34Š| ||
| 61 | T | 25.7 | Very low | 29 | Very low | 140 Ų | 140 | 142.3 Ų | 142.3 | 86% | 0.859 | 79% | 0.788 | S | S | * | * | trans | -85.9 | 86.1 | 160.5 | 49.1 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 62 | S | 26 | Very low | 29.5 | Very low | 89 Ų | 89 | 143 Ų | 143 | 62% | 0.622 | 79% | 0.786 | S | S | * | * | trans | -150.7 | 105.3 | 162.1 | 55 | 0 | 0 | 0 | 0 | 110.9 | S60 | S60-S62 PolarHBondContact O-N 3.34Š| ||
| 63 | R | 23.4 | Very low | 29.9 | Very low | 238 Ų | 238 | 142.8 Ų | 142.8 | 90% | 0.898 | 78% | 0.781 | S | S | * | * | trans | 44.9 | 110.6 | 140.1 | -61.6 | -178.3 | -169.4 | -161.5 | 2.3 | 117.1 | ||||
| 64 | L | 31.4 | Very low | 30 | Very low | 179 Ų | 179 | 144.3 Ų | 144.3 | 94% | 0.937 | 78% | 0.781 | S | S | * | * | -139 | 113.5 | 127.9 | -134.4 | 80.7 | 0 | 0 | 0 | 109.2 | |||||
| 65 | S | 25.2 | Very low | 30.1 | Very low | 110 Ų | 110 | 140.1 Ų | 140.1 | 77% | 0.769 | 77% | 0.769 | S | S | * | * | trans | -83.1 | 162.5 | 169.6 | -173.2 | 0 | 0 | 0 | 0 | 109 | ||||
| 66 | S | 25.6 | Very low | 30.4 | Very low | 95 Ų | 95 | 140 Ų | 140 | 66% | 0.664 | 76% | 0.761 | S | S | * | * | trans | 77.2 | 127.9 | 165.8 | -160.9 | 0 | 0 | 0 | 0 | 114 | ||||
| 67 | T | 28 | Very low | 30.4 | Very low | 116 Ų | 116 | 140.3 Ų | 140.3 | 71% | 0.712 | 76% | 0.756 | S | S | * | * | cis | -171.9 | 157.8 | 32.5 | -10 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 68 | T | 26.8 | Very low | 30.3 | Very low | 119 Ų | 119 | 132 Ų | 132 | 73% | 0.73 | 74% | 0.738 | S | S | * | * | trans | 72.2 | 100.6 | 153.7 | 50.1 | 0 | 0 | 0 | 0 | 121.9 | T70 | T68-T70 PolarHBondContact O-N 3.38Š| ||
| 69 | M | 26.4 | Very low | 30.5 | Very low | 185 Ų | 185 | 131.6 Ų | 131.6 | 91% | 0.911 | 73% | 0.729 | S | S | * | * | S | Bend | trans | -53.2 | 115.9 | 139.6 | -78 | 179.1 | 124.7 | 0 | 0 | 110.2 | ||
| 70 | T | 37.1 | Very low | 30.7 | Very low | 122 Ų | 122 | 129.4 Ų | 129.4 | 75% | 0.748 | 72% | 0.72 | S | S | * | * | S | Bend | trans | -178.6 | -7 | 133.2 | 26 | 0 | 0 | 0 | 0 | 113.6 | T68 | T68-T70 PolarHBondContact O-N 3.38Š|
| 71 | D | 32.9 | Very low | 30.6 | Very low | 143 Ų | 143 | 135.2 Ų | 135.2 | 77% | 0.765 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -98.4 | -0.3 | 178.6 | -83 | -41.6 | 0 | 0 | 0 | 116.4 | ||
| 72 | I | 38.9 | Very low | 30.7 | Very low | 135 Ų | 135 | 138.9 Ų | 138.9 | 69% | 0.692 | 73% | 0.725 | S | S | * | * | S | Bend | trans | -89.5 | -17.6 | -177.8 | -58.9 | 178.3 | 0 | 0 | 0 | 112.9 | ||
| 73 | E | 34.5 | Very low | 31 | Very low | 143 Ų | 143 | 141.4 Ų | 141.4 | 67% | 0.668 | 73% | 0.731 | S | S | * | * | H | α-helix | trans | -76.2 | -29.7 | -177.7 | -112.8 | -91.1 | 137.5 | 0 | 0 | 113.1 | ||
| 74 | L | 36.1 | Very low | 31.5 | Very low | 149 Ų | 149 | 136.2 Ų | 136.2 | 78% | 0.78 | 72% | 0.719 | S | S | * | * | H | α-helix | trans | -76.6 | -24.6 | 177.1 | -109.5 | 146.7 | 0 | 0 | 0 | 113 | ||
| 75 | A | 33.6 | Very low | 31.7 | Very low | 64 Ų | 64 | 134.9 Ų | 134.9 | 53% | 0.529 | 71% | 0.712 | S | S | . | * | H | α-helix | trans | -74.9 | -27.3 | 178 | 0 | 0 | 0 | 0 | 0 | 113.3 | C79 | A75-C79 WeakPolarHBondContact O-CB 3.49Å; A75-C79 PolarHBondContact O-N 3.38Å |
| 76 | K | 38.1 | Very low | 32.1 | Very low | 161 Ų | 161 | 134.7 Ų | 134.7 | 70% | 0.7 | 71% | 0.707 | S | S | * | * | H | α-helix | trans | -75.3 | -31.6 | -178.4 | -93.4 | -174.4 | 175 | -178.8 | 0 | 114 | ||
| 77 | K | 34.9 | Very low | 32.7 | Very low | 172 Ų | 172 | 136.6 Ų | 136.6 | 75% | 0.748 | 71% | 0.714 | S | S | * | * | H | α-helix | trans | -80.4 | -24.1 | 177.5 | -76.7 | 179.4 | 179.7 | 169.2 | 0 | 113.4 | ||
| 78 | G | 29 | Very low | 33 | Very low | 43 Ų | 43 | 137.2 Ų | 137.2 | 44% | 0.443 | 71% | 0.71 | S | S | . | * | H | α-helix | trans | -76.5 | -29.7 | 172.7 | 0 | 0 | 0 | 0 | 0 | 114 | R81 | G78-R81 PolarHBondContact O-N 3.02Å |
| 79 | C | 31 | Very low | 33.5 | Very low | 81 Ų | 81 | 135.3 Ų | 135.3 | 55% | 0.547 | 71% | 0.707 | S | S | . | * | H | α-helix | trans | -75.1 | -25.8 | -174.9 | -159.7 | 0 | 0 | 0 | 0 | 113.5 | A75 R81 W82 | A75-C79 WeakPolarHBondContact O-CB 3.49Å; A75-C79 PolarHBondContact O-N 3.38Å; C79-R81 PolarHBondContact O-N 3.49Å; C79-W82 PolarHBondContact O-N 2.97Å |
| 80 | L | 30.2 | Very low | 34 | Very low | 134 Ų | 134 | 131.5 Ų | 131.5 | 70% | 0.702 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.3 | -20.2 | 177.1 | -133.9 | 85.5 | 0 | 0 | 0 | 113.2 | ||
| 81 | R | 27.9 | Very low | 33.7 | Very low | 222 Ų | 222 | 131.8 Ų | 131.8 | 84% | 0.838 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.8 | -17.8 | -178.4 | -160.9 | 172.2 | 179.2 | -164 | -1.1 | 113.4 | G78 C79 | G78-R81 PolarHBondContact O-N 3.02Å; C79-R81 PolarHBondContact O-N 3.49Å |
| 82 | W | 28.5 | Very low | 33.6 | Very low | 217 Ų | 217 | 129.1 Ų | 129.1 | 82% | 0.822 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.3 | -11.8 | 177.3 | -84.4 | 96 | 0 | 0 | 0 | 114.3 | C79 I84 | C79-W82 PolarHBondContact O-N 2.97Å; W82-I84 VanDerWaalsContact C-N 3.29Å; W82-I84 PolarHBondContact O-N 3.15Å |
| 83 | L | 31.6 | Very low | 33 | Very low | 141 Ų | 141 | 126.2 Ų | 126.2 | 74% | 0.738 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.2 | -5.4 | 179.1 | -107 | 155 | 0 | 0 | 0 | 114.5 | ||
| 84 | I | 34.1 | Very low | 32.9 | Very low | 129 Ų | 129 | 124.4 Ų | 124.4 | 66% | 0.662 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97 | -11.5 | -175 | -69.4 | 176.8 | 0 | 0 | 0 | 113.9 | W82 | W82-I84 VanDerWaalsContact C-N 3.29Å; W82-I84 PolarHBondContact O-N 3.15Å |
| 85 | L | 35 | Very low | 32.6 | Very low | 151 Ų | 151 | 121.3 Ų | 121.3 | 79% | 0.791 | 62% | 0.623 | S | S | * | * | S | Bend | trans | -141.6 | 40.8 | -166.3 | -105.4 | 151.7 | 0 | 0 | 0 | 116.5 | ||
| 86 | T | 33.2 | Very low | 32.6 | Very low | 106 Ų | 106 | 122.1 Ų | 122.1 | 65% | 0.65 | 62% | 0.615 | S | S | * | * | trans | -130.7 | 65.5 | 143.4 | 54.2 | 0 | 0 | 0 | 0 | 109 | M88 | T86-M88 PolarHBondContact O-N 3Š| ||
| 87 | V | 39.9 | Very low | 32 | Very low | 135 Ų | 135 | 124.1 Ų | 124.1 | 82% | 0.818 | 62% | 0.619 | S | S | * | * | trans | -57.7 | 88.1 | 142.7 | 177.7 | 0 | 0 | 0 | 0 | 104.2 | A89 | V87-A89 PolarHBondContact O-N 3.1Š| ||
| 88 | M | 33 | Very low | 31.8 | Very low | 129 Ų | 129 | 119.7 Ų | 119.7 | 64% | 0.635 | 61% | 0.609 | S | S | * | * | trans | -62.8 | 92.3 | 172.5 | -78 | -158.5 | -98.8 | 0 | 0 | 104.6 | T86 K90 N170 | T86-M88 PolarHBondContact O-N 3Å; M88-K90 PolarHBondContact O-N 3.37Å; M88-N170 WeakPolarHBondContact CE-ND2 3.36Å | ||
| 89 | A | 38 | Very low | 31.8 | Very low | 79 Ų | 79 | 124.3 Ų | 124.3 | 65% | 0.653 | 63% | 0.633 | S | S | * | * | trans | -51.3 | 111.6 | 169.2 | 0 | 0 | 0 | 0 | 0 | 105.1 | V87 L91 | V87-A89 PolarHBondContact O-N 3.1Å; A89-L91 VanDerWaalsContact C-N 3.3Å; A89-L91 PolarHBondContact O-N 3.08Å | ||
| 90 | K | 35.6 | Very low | 31.7 | Very low | 106 Ų | 106 | 125.7 Ų | 125.7 | 46% | 0.461 | 64% | 0.642 | S | S | . | * | trans | -51.5 | 100.7 | 174.4 | -175.3 | -172.3 | -177.5 | -160.2 | 0 | 106.8 | M88 E92 | M88-K90 PolarHBondContact O-N 3.37Å; K90-E92 VanDerWaalsContact C-N 3.33Å; K90-E92 HydrophobicContact CD-CG 4.12Å; K90-E92 VanDerWaalsContact CE-OE1 3.23Å; K90-E92 WeakPolarHBondContact CE-OE1 3.41Å; K90-E92 HydrophobicContact CG-CG 4.07Å; K90-E92 IonicContact NZ-OE1 2.71Å; K90-E92 PolarHBondContact NZ-OE1 2.96Å; K90-E92 PolarHBondContact O-N 3.19Å | ||
| 91 | L | 32 | Very low | 31.9 | Very low | 128 Ų | 128 | 124.1 Ų | 124.1 | 67% | 0.67 | 64% | 0.642 | S | S | * | * | trans | -80.5 | 89.2 | -178.3 | -159 | 91.9 | 0 | 0 | 0 | 106.2 | A89 V93 | A89-L91 VanDerWaalsContact C-N 3.3Å; A89-L91 PolarHBondContact O-N 3.08Å; L91-V93 VanDerWaalsContact C-N 3.33Å; L91-V93 HydrophobicContact CD2-CG2 3.65Å; L91-V93 HydrophobicContact CG-CG2 4.16Å; L91-V93 PolarHBondContact O-N 3.4Å | ||
| 92 | E | 29.6 | Very low | 32.2 | Very low | 86 Ų | 86 | 117 Ų | 117 | 40% | 0.402 | 64% | 0.638 | S | S | . | * | trans | -74.4 | 87.6 | 175.5 | -67.3 | -168.5 | 171.1 | 0 | 0 | 109.4 | K90 R94 | K90-E92 VanDerWaalsContact C-N 3.33Å; K90-E92 HydrophobicContact CD-CG 4.12Å; K90-E92 VanDerWaalsContact CE-OE1 3.23Å; K90-E92 WeakPolarHBondContact CE-OE1 3.41Å; K90-E92 HydrophobicContact CG-CG 4.07Å; K90-E92 IonicContact NZ-OE1 2.71Å; K90-E92 PolarHBondContact NZ-OE1 2.96Å; K90-E92 PolarHBondContact O-N 3.19Å; E92-R94 PolarHBondContact O-N 3.48Å | ||
| 93 | V | 27.8 | Very low | 32.1 | Very low | 75 Ų | 75 | 111.3 Ų | 111.3 | 46% | 0.455 | 62% | 0.623 | S | S | . | * | trans | -79.3 | 97.5 | 171.7 | -171.5 | 0 | 0 | 0 | 0 | 108.3 | L91 I95 | L91-V93 VanDerWaalsContact C-N 3.33Å; L91-V93 HydrophobicContact CD2-CG2 3.65Å; L91-V93 HydrophobicContact CG-CG2 4.16Å; L91-V93 PolarHBondContact O-N 3.4Å; V93-I95 HydrophobicContact CG1-CD1 4.15Å; V93-I95 HydrophobicContact CG1-CG1 3.68Å; V93-I95 PolarHBondContact O-N 3.46Å | ||
| 94 | R | 31.8 | Very low | 32.8 | Very low | 105 Ų | 105 | 106 Ų | 106 | 40% | 0.396 | 60% | 0.595 | S | S | . | * | trans | -80.8 | 91.1 | 173.7 | -61.9 | -131.6 | -155.2 | -172 | 13.3 | 110.4 | E92 K96 D176 | E92-R94 PolarHBondContact O-N 3.48Å; R94-K96 PolarHBondContact O-N 2.94Å; R94-D176 IonicContact CZ-OD2 3.86Å; R94-D176 IonicContact NH1-OD2 2.87Å; R94-D176 PolarHBondContact NH1-OD2 3.08Å | ||
| 95 | I | 29 | Very low | 33.2 | Very low | 83 Ų | 83 | 106 Ų | 106 | 43% | 0.426 | 60% | 0.595 | S | S | . | * | trans | -84.7 | 102.3 | 172.9 | -47.6 | 179.6 | 0 | 0 | 0 | 108.5 | V93 Y97 | V93-I95 HydrophobicContact CG1-CD1 4.15Å; V93-I95 HydrophobicContact CG1-CG1 3.68Å; V93-I95 PolarHBondContact O-N 3.46Å; I95-Y97 HydrophobicContact CB-CD2 4.42Å; I95-Y97 HydrophobicContact CB-CE2 3.95Å; I95-Y97 HydrophobicContact CG2-CD2 3.79Å; I95-Y97 HydrophobicContact CG2-CE1 4.25Å; I95-Y97 HydrophobicContact CG2-CE2 3.21Å; I95-Y97 VanDerWaalsContact CG2-CZ 3.47Å; I95-Y97 PolarHBondContact O-N 3.37Å | ||
| 96 | K | 34.8 | Very low | 33.5 | Very low | 81 Ų | 81 | 99.1 Ų | 99.1 | 35% | 0.352 | 56% | 0.56 | S | S | . | * | trans | -81.4 | 101.4 | 177.6 | -64.2 | 179.2 | -179 | 175.8 | 0 | 109.2 | R94 | R94-K96 PolarHBondContact O-N 2.94Š| ||
| 97 | Y | 26 | Very low | 34.1 | Very low | 204 Ų | 204 | 94.4 Ų | 94.4 | 80% | 0.8 | 53% | 0.531 | S | S | * | . | trans | -95.9 | 121.2 | 168.6 | -68.6 | -77.8 | 0 | 0 | 0 | 110.3 | I95 | I95-Y97 HydrophobicContact CB-CD2 4.42Å; I95-Y97 HydrophobicContact CB-CE2 3.95Å; I95-Y97 HydrophobicContact CG2-CD2 3.79Å; I95-Y97 HydrophobicContact CG2-CE1 4.25Å; I95-Y97 HydrophobicContact CG2-CE2 3.21Å; I95-Y97 VanDerWaalsContact CG2-CZ 3.47Å; I95-Y97 PolarHBondContact O-N 3.37Å | ||
| 98 | C | 31 | Very low | 34.4 | Very low | 78 Ų | 78 | 92 Ų | 92 | 53% | 0.527 | 51% | 0.513 | S | S | . | . | trans | -145.2 | 123.4 | 152.1 | 178.3 | 0 | 0 | 0 | 0 | 107.8 | C100 C101 | C98-C100 PolarHBondContact O-N 3.2Å; C98-C100 VanDerWaalsContact O-N 3.1Å; C98-C101 PolarHBondContact O-N 3.36Å; C98-C101 PolarHBondContact O-SG 2.95Å | ||
| 99 | C | 28.5 | Very low | 35.1 | Very low | 140 Ų | 140 | 90.3 Ų | 90.3 | 95% | 0.946 | 51% | 0.506 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.8 | 0.9 | -174.2 | -160.1 | 0 | 0 | 0 | 0 | 113.8 | ||
| 100 | C | 29.4 | Very low | 35.8 | Very low | 110 Ų | 110 | 87.8 Ų | 87.8 | 74% | 0.743 | 48% | 0.481 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -120.1 | 23.9 | -180 | -44.6 | 0 | 0 | 0 | 0 | 112.8 | C98 G102 | C98-C100 PolarHBondContact O-N 3.2Å; C98-C100 VanDerWaalsContact O-N 3.1Å; C100-G102 PolarHBondContact O-N 3.18Å |
| 101 | C | 33.9 | Very low | 36.4 | Very low | 102 Ų | 102 | 84.8 Ų | 84.8 | 69% | 0.689 | 48% | 0.476 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -50.8 | 115.6 | 173.9 | -78.4 | 0 | 0 | 0 | 0 | 113 | C98 | C98-C101 PolarHBondContact O-N 3.36Å; C98-C101 PolarHBondContact O-SG 2.95Å |
| 102 | G | 34 | Very low | 37.3 | Very low | 73 Ų | 73 | 82.8 Ų | 82.8 | 75% | 0.753 | 47% | 0.466 | S | S | * | . | T | Hydrogen-bonded Turn | cis | -160.5 | 48.4 | 15.8 | 0 | 0 | 0 | 0 | 0 | 112 | C100 | C100-G102 PolarHBondContact O-N 3.18Š|
| 103 | L | 26.5 | Very low | 38.5 | Very low | 97 Ų | 97 | 80.1 Ų | 80.1 | 51% | 0.508 | 45% | 0.452 | S | S | . | . | trans | -106.5 | 86.9 | 170.5 | -151.3 | 71.2 | 0 | 0 | 0 | 107.9 | T107 F266 | L103-T107 WeakPolarHBondContact CA-OG1 3.45Å; L103-T107 WeakPolarHBondContact CG-OG1 3.47Å; L103-F266 HydrophobicContact CD1-CZ 4.28Å | ||
| 104 | N | 45.2 | Very low | 39.8 | Very low | 30 Ų | 30 | 78.7 Ų | 78.7 | 16% | 0.16 | 45% | 0.445 | C | S | . | . | trans | -41.5 | 145.7 | 171.4 | 163.1 | 22.3 | 0 | 0 | 0 | 112.3 | A106 T107 L108 D180 T181 | N104-A106 WeakPolarHBondContact ND2-CB 3.48Å; N104-A106 PolarHBondContact O-N 3.04Å; N104-A106 VanDerWaalsContact O-N 3.12Å; N104-A106 PolarHBondContact OD1-N 2.97Å; N104-T107 WeakPolarHBondContact CA-OG1 3.36Å; N104-T107 HydrophobicContact CB-CG2 4.13Å; N104-T107 PolarHBondContact N-OG1 3.33Å; N104-T107 CarbonylContact O-C 3.5Å; N104-T107 WeakPolarHBondContact O-CA 3.47Å; N104-T107 WeakPolarHBondContact O-CB 3.36Å; N104-T107 PolarHBondContact O-N 2.94Å; N104-T107 PolarHBondContact O-OG1 2.94Å; N104-L108 PolarHBondContact O-N 3.38Å; N104-D180 PolarHBondContact ND2-O 3.01Å; N104-T181 WeakPolarHBondContact ND2-CA 2.9Å; N104-T181 PolarHBondContact ND2-O 2.71Å; N104-T181 WeakPolarHBondContact OD1-CA 3.37Å; N104-T181 WeakPolarHBondContact OD1-CG2 3.48Å | ||
| 105 | I | 42.5 | Very low | 40.7 | Very low | 127 Ų | 127 | 78.9 Ų | 78.9 | 65% | 0.651 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -48.4 | -39.7 | 173.3 | -68.8 | 161.8 | 0 | 0 | 0 | 111.5 | L108 L109 | I105-L108 PolarHBondContact O-N 3.25Å; I105-L109 HydrophobicContact CG2-CD1 3.93Å; I105-L109 HydrophobicContact CG2-CG 4.27Å; I105-L109 WeakPolarHBondContact O-CB 3.47Å; I105-L109 VanDerWaalsContact O-CG 3.24Å; I105-L109 WeakPolarHBondContact O-CG 3.39Å; I105-L109 PolarHBondContact O-N 3Å |
| 106 | A | 42.9 | Very low | 42 | Very low | 7 Ų | 7 | 78 Ų | 78 | 6% | 0.058 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -65.9 | -40.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | N104 L108 L109 I110 F137 T181 | N104-A106 WeakPolarHBondContact ND2-CB 3.48Å; N104-A106 PolarHBondContact O-N 3.04Å; N104-A106 VanDerWaalsContact O-N 3.12Å; N104-A106 PolarHBondContact OD1-N 2.97Å; A106-L108 VanDerWaalsContact C-N 3.34Å; A106-L109 PolarHBondContact O-N 3.23Å; A106-I110 WeakPolarHBondContact O-CB 3.47Å; A106-I110 VanDerWaalsContact O-CD1 3.3Å; A106-I110 WeakPolarHBondContact O-CD1 3.49Å; A106-I110 WeakPolarHBondContact O-CG1 3.37Å; A106-I110 PolarHBondContact O-N 2.91Å; A106-F137 HydrophobicContact CB-CE1 3.81Å; A106-F137 HydrophobicContact CB-CZ 4.38Å; A106-T181 WeakPolarHBondContact CB-O 3.36Å |
| 107 | T | 45.6 | Very low | 42.9 | Very low | 7 Ų | 7 | 75.6 Ų | 75.6 | 4% | 0.043 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -67.8 | -33.1 | 173.8 | 58.1 | 0 | 0 | 0 | 0 | 112.5 | L103 N104 I110 A111 F266 F267 | L103-T107 WeakPolarHBondContact CA-OG1 3.45Å; L103-T107 WeakPolarHBondContact CG-OG1 3.47Å; N104-T107 WeakPolarHBondContact CA-OG1 3.36Å; N104-T107 HydrophobicContact CB-CG2 4.13Å; N104-T107 PolarHBondContact N-OG1 3.33Å; N104-T107 CarbonylContact O-C 3.5Å; N104-T107 WeakPolarHBondContact O-CA 3.47Å; N104-T107 WeakPolarHBondContact O-CB 3.36Å; N104-T107 PolarHBondContact O-N 2.94Å; N104-T107 PolarHBondContact O-OG1 2.94Å; T107-I110 PolarHBondContact O-N 3.31Å; T107-A111 WeakPolarHBondContact O-CB 3.37Å; T107-A111 PolarHBondContact O-N 3.48Å; T107-F266 HydrophobicContact CG2-CD1 3.79Å; T107-F266 HydrophobicContact CG2-CE1 3.33Å; T107-F266 HydrophobicContact CG2-CZ 4.24Å; T107-F267 HydrophobicContact CG2-CE1 4.18Å; T107-F267 HydrophobicContact CG2-CZ 3.79Å |
| 108 | L | 46.1 | Very low | 44.2 | Very low | 85 Ų | 85 | 72.4 Ų | 72.4 | 45% | 0.445 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -68.7 | -40.2 | 172.4 | -178.3 | 141.9 | 0 | 0 | 0 | 111.1 | N104 I105 A106 A111 L112 | N104-L108 PolarHBondContact O-N 3.38Å; I105-L108 PolarHBondContact O-N 3.25Å; A106-L108 VanDerWaalsContact C-N 3.34Å; L108-A111 PolarHBondContact O-N 3.43Å; L108-L112 HydrophobicContact CD2-CD1 3.56Å; L108-L112 HydrophobicContact CD2-CG 4.49Å; L108-L112 HydrophobicContact CG-CD1 4.33Å; L108-L112 WeakPolarHBondContact O-CB 3.33Å; L108-L112 WeakPolarHBondContact O-CG 3.39Å; L108-L112 PolarHBondContact O-N 3.35Å |
| 109 | L | 47.6 | Very low | 45.4 | Very low | 94 Ų | 94 | 76.8 Ų | 76.8 | 49% | 0.492 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -66.8 | -39.1 | 174 | -73.6 | 171.4 | 0 | 0 | 0 | 111.7 | I105 A106 Y113 | I105-L109 HydrophobicContact CG2-CD1 3.93Å; I105-L109 HydrophobicContact CG2-CG 4.27Å; I105-L109 WeakPolarHBondContact O-CB 3.47Å; I105-L109 VanDerWaalsContact O-CG 3.24Å; I105-L109 WeakPolarHBondContact O-CG 3.39Å; I105-L109 PolarHBondContact O-N 3Å; A106-L109 PolarHBondContact O-N 3.23Å; L109-Y113 WeakPolarHBondContact O-CB 3.43Å; L109-Y113 PolarHBondContact O-N 3.07Å |
| 110 | I | 53.1 | Low | 46.5 | Very low | 25 Ų | 25 | 76 Ų | 76 | 13% | 0.128 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -72.6 | -37.8 | 176.5 | -65.4 | 157.8 | 0 | 0 | 0 | 111.2 | A106 T107 Y113 S114 F137 F267 L270 | A106-I110 WeakPolarHBondContact O-CB 3.47Å; A106-I110 VanDerWaalsContact O-CD1 3.3Å; A106-I110 WeakPolarHBondContact O-CD1 3.49Å; A106-I110 WeakPolarHBondContact O-CG1 3.37Å; A106-I110 PolarHBondContact O-N 2.91Å; T107-I110 PolarHBondContact O-N 3.31Å; I110-Y113 WeakPolarHBondContact O-CB 3.39Å; I110-Y113 PolarHBondContact O-N 3.1Å; I110-S114 WeakPolarHBondContact O-CB 3.43Å; I110-S114 PolarHBondContact O-N 2.88Å; I110-S114 PolarHBondContact O-OG 3.12Å; I110-F137 HydrophobicContact CD1-CE2 3.95Å; I110-F137 HydrophobicContact CD1-CZ 3.82Å; I110-F137 HydrophobicContact CG1-CE2 3.75Å; I110-F137 HydrophobicContact CG1-CZ 3.7Å; I110-F267 HydrophobicContact CD1-CE1 3.84Å; I110-L270 HydrophobicContact CB-CD1 4.42Å; I110-L270 HydrophobicContact CD1-CD1 4.39Å; I110-L270 HydrophobicContact CG2-CD1 3.63Å; I110-L270 HydrophobicContact CG2-CD2 3.86Å; I110-L270 HydrophobicContact CG2-CG 4.3Å |
| 111 | A | 48.6 | Very low | 47.5 | Very low | 43 Ų | 43 | 77.3 Ų | 77.3 | 36% | 0.355 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -66.7 | -46.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | T107 L108 Y113 S114 L115 | T107-A111 WeakPolarHBondContact O-CB 3.37Å; T107-A111 PolarHBondContact O-N 3.48Å; L108-A111 PolarHBondContact O-N 3.43Å; A111-Y113 VanDerWaalsContact C-N 3.28Å; A111-Y113 PolarHBondContact O-N 2.97Å; A111-S114 PolarHBondContact O-N 2.85Å; A111-L115 WeakPolarHBondContact O-CB 3.41Å; A111-L115 PolarHBondContact O-N 3.46Å |
| 112 | L | 50.1 | Low | 48.3 | Very low | 87 Ų | 87 | 76.8 Ų | 76.8 | 46% | 0.455 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -58.2 | -42.4 | 170.5 | -88 | 166.8 | 0 | 0 | 0 | 110.8 | L108 L115 V116 | L108-L112 HydrophobicContact CD2-CD1 3.56Å; L108-L112 HydrophobicContact CD2-CG 4.49Å; L108-L112 HydrophobicContact CG-CD1 4.33Å; L108-L112 WeakPolarHBondContact O-CB 3.33Å; L108-L112 WeakPolarHBondContact O-CG 3.39Å; L108-L112 PolarHBondContact O-N 3.35Å; L112-L115 PolarHBondContact O-N 3.42Å; L112-V116 VanDerWaalsContact O-CB 3.31Å; L112-V116 WeakPolarHBondContact O-CB 3.46Å; L112-V116 WeakPolarHBondContact O-CG2 3.44Å; L112-V116 PolarHBondContact O-N 2.83Å |
| 113 | Y | 54.9 | Low | 48.8 | Very low | 30 Ų | 30 | 81.1 Ų | 81.1 | 12% | 0.118 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -62.6 | -43.4 | 176.1 | 172.6 | -92.1 | 0 | 0 | 0 | 111.7 | L109 I110 A111 L115 V116 D117 L129 F130 M133 | L109-Y113 WeakPolarHBondContact O-CB 3.43Å; L109-Y113 PolarHBondContact O-N 3.07Å; I110-Y113 WeakPolarHBondContact O-CB 3.39Å; I110-Y113 PolarHBondContact O-N 3.1Å; A111-Y113 VanDerWaalsContact C-N 3.28Å; A111-Y113 PolarHBondContact O-N 2.97Å; Y113-L115 VanDerWaalsContact C-N 3.28Å; Y113-L115 PolarHBondContact O-N 2.88Å; Y113-V116 CarbonylContact O-C 3.47Å; Y113-V116 PolarHBondContact O-N 3.22Å; Y113-D117 HydrophobicContact CE1-CB 4.41Å; Y113-D117 VanDerWaalsContact O-CB 3.25Å; Y113-D117 WeakPolarHBondContact O-CB 3.19Å; Y113-D117 PolarHBondContact O-N 3.12Å; Y113-L129 HydrophobicContact CD2-CD2 4.41Å; Y113-L129 HydrophobicContact CE2-CB 4.39Å; Y113-L129 HydrophobicContact CE2-CD2 3.86Å; Y113-L129 HydrophobicContact CE2-CG 3.93Å; Y113-F130 HydrophobicContact CD1-CD2 4.25Å; Y113-F130 AromaticContact CE1-CD2 3.38Å; Y113-F130 HydrophobicContact CE1-CD2 3.38Å; Y113-F130 AromaticContact CE1-CE2 3.96Å; Y113-F130 HydrophobicContact CE1-CE2 3.96Å; Y113-F130 HydrophobicContact CE1-CG 4.43Å; Y113-F130 AromaticContact CZ-CD2 3.67Å; Y113-F130 WeakPolarHBondContact OH-CA 3.38Å; Y113-F130 VanDerWaalsContact OH-CB 3.26Å; Y113-F130 WeakPolarHBondContact OH-CB 3.41Å; Y113-F130 PolarHBondContact OH-N 3.37Å; Y113-M133 HydrophobicContact CD2-CG 4.33Å |
| 114 | S | 54.9 | Low | 50.2 | Low | 44 Ų | 44 | 85.4 Ų | 85.4 | 31% | 0.308 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -64.1 | -35.3 | 177.1 | -56.6 | 0 | 0 | 0 | 0 | 111.9 | I110 A111 E118 | I110-S114 WeakPolarHBondContact O-CB 3.43Å; I110-S114 PolarHBondContact O-N 2.88Å; I110-S114 PolarHBondContact O-OG 3.12Å; A111-S114 PolarHBondContact O-N 2.85Å; S114-E118 PolarHBondContact O-N 3.42Å; S114-E118 VanDerWaalsContact O-N 3.09Å |
| 115 | L | 51.3 | Low | 50.4 | Low | 110 Ų | 110 | 92.4 Ų | 92.4 | 58% | 0.576 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -74.5 | -39.9 | 176.4 | -164.5 | 151.6 | 0 | 0 | 0 | 111.5 | A111 L112 Y113 E118 F119 | A111-L115 WeakPolarHBondContact O-CB 3.41Å; A111-L115 PolarHBondContact O-N 3.46Å; L112-L115 PolarHBondContact O-N 3.42Å; Y113-L115 VanDerWaalsContact C-N 3.28Å; Y113-L115 PolarHBondContact O-N 2.88Å; L115-E118 PolarHBondContact O-N 2.9Å; L115-F119 WeakPolarHBondContact O-CB 3.38Å; L115-F119 PolarHBondContact O-N 2.69Å |
| 116 | V | 54.6 | Low | 50.8 | Low | 64 Ų | 64 | 88 Ų | 88 | 39% | 0.388 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -66 | -41 | 172.8 | 170.6 | 0 | 0 | 0 | 0 | 110.2 | L112 Y113 E118 F119 F120 | L112-V116 VanDerWaalsContact O-CB 3.31Å; L112-V116 WeakPolarHBondContact O-CB 3.46Å; L112-V116 WeakPolarHBondContact O-CG2 3.44Å; L112-V116 PolarHBondContact O-N 2.83Å; Y113-V116 CarbonylContact O-C 3.47Å; Y113-V116 PolarHBondContact O-N 3.22Å; V116-E118 VanDerWaalsContact C-N 3.33Å; V116-E118 PolarHBondContact O-N 3.43Å; V116-F119 CarbonylContact O-C 3.55Å; V116-F119 PolarHBondContact O-N 3.4Å; V116-F119 VanDerWaalsContact O-N 3.17Å; V116-F120 HydrophobicContact CG1-CD2 4.42Å; V116-F120 VanDerWaalsContact O-CB 3.29Å; V116-F120 WeakPolarHBondContact O-CB 3.37Å; V116-F120 PolarHBondContact O-N 3.38Å |
| 117 | D | 53.6 | Low | 51.3 | Low | 30 Ų | 30 | 95.8 Ų | 95.8 | 16% | 0.16 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -60.2 | -42.6 | 174.7 | -177.4 | 62.5 | 0 | 0 | 0 | 111 | Y113 F120 R121 T126 | Y113-D117 HydrophobicContact CE1-CB 4.41Å; Y113-D117 VanDerWaalsContact O-CB 3.25Å; Y113-D117 WeakPolarHBondContact O-CB 3.19Å; Y113-D117 PolarHBondContact O-N 3.12Å; D117-F120 PolarHBondContact O-N 3.39Å; D117-R121 VanDerWaalsContact O-CB 3.31Å; D117-R121 WeakPolarHBondContact O-CB 3.31Å; D117-R121 PolarHBondContact O-N 3Å; D117-T126 WeakPolarHBondContact OD1-CG2 3.17Å |
| 118 | E | 55.2 | Low | 51.5 | Low | 137 Ų | 137 | 101 Ų | 101 | 64% | 0.64 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.8 | -40.4 | 173.1 | -166.8 | 169.4 | -160.8 | 0 | 0 | 112.5 | S114 L115 V116 | S114-E118 PolarHBondContact O-N 3.42Å; S114-E118 VanDerWaalsContact O-N 3.09Å; L115-E118 PolarHBondContact O-N 2.9Å; V116-E118 VanDerWaalsContact C-N 3.33Å; V116-E118 PolarHBondContact O-N 3.43Å |
| 119 | F | 55.7 | Low | 51.8 | Low | 170 Ų | 170 | 101 Ų | 101 | 75% | 0.746 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -72.3 | -36.9 | 177.7 | -168.2 | -97.3 | 0 | 0 | 0 | 113.2 | L115 V116 | L115-F119 WeakPolarHBondContact O-CB 3.38Å; L115-F119 PolarHBondContact O-N 2.69Å; V116-F119 CarbonylContact O-C 3.55Å; V116-F119 PolarHBondContact O-N 3.4Å; V116-F119 VanDerWaalsContact O-N 3.17Å |
| 120 | F | 50.2 | Low | 52 | Low | 125 Ų | 125 | 99.7 Ų | 99.7 | 55% | 0.548 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -88.2 | -9.2 | -179.1 | -118.4 | -91.7 | 0 | 0 | 0 | 113.3 | V116 D117 A122 K123 | V116-F120 HydrophobicContact CG1-CD2 4.42Å; V116-F120 VanDerWaalsContact O-CB 3.29Å; V116-F120 WeakPolarHBondContact O-CB 3.37Å; V116-F120 PolarHBondContact O-N 3.38Å; D117-F120 PolarHBondContact O-N 3.39Å; F120-A122 PolarHBondContact O-N 3.33Å; F120-K123 PolarHBondContact O-N 2.91Å |
| 121 | R | 50.5 | Low | 52.1 | Low | 136 Ų | 136 | 102.4 Ų | 102.4 | 51% | 0.513 | 51% | 0.505 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.4 | -9.9 | 172.6 | -141 | 174.9 | -169.6 | -171.6 | 0.3 | 114 | D117 K123 | D117-R121 VanDerWaalsContact O-CB 3.31Å; D117-R121 WeakPolarHBondContact O-CB 3.31Å; D117-R121 PolarHBondContact O-N 3Å; R121-K123 VanDerWaalsContact C-N 3.29Å |
| 122 | A | 51.4 | Low | 52.3 | Low | 92 Ų | 92 | 103.6 Ų | 103.6 | 76% | 0.76 | 51% | 0.51 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.6 | -9.6 | 169.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | F120 | F120-A122 PolarHBondContact O-N 3.33Š|
| 123 | K | 45.4 | Very low | 52.5 | Low | 164 Ų | 164 | 102.7 Ų | 102.7 | 71% | 0.713 | 50% | 0.504 | S | S | * | . | S | Bend | trans | -138.1 | 116.2 | 174.2 | -75.8 | -170.5 | 176.2 | 179.7 | 0 | 111.7 | F120 R121 H125 | F120-K123 PolarHBondContact O-N 2.91Å; R121-K123 VanDerWaalsContact C-N 3.29Å; K123-H125 PolarHBondContact O-N 3Å |
| 124 | E | 54.3 | Low | 52.4 | Low | 187 Ų | 187 | 103.3 Ų | 103.3 | 87% | 0.874 | 51% | 0.507 | S | S | * | . | S | Bend | trans | -50.1 | 91.7 | 178.3 | -65.5 | 171.6 | 141.6 | 0 | 0 | 112.9 | ||
| 125 | H | 51.1 | Low | 52.4 | Low | 176 Ų | 176 | 105.2 Ų | 105.2 | 82% | 0.815 | 51% | 0.512 | S | S | * | . | trans | -166 | 23.6 | 160.8 | -93.5 | -61.5 | 0 | 0 | 0 | 113.2 | K123 Y127 | K123-H125 PolarHBondContact O-N 3Å; H125-Y127 PolarHBondContact O-N 3.05Å | ||
| 126 | T | 49.6 | Very low | 52.5 | Low | 36 Ų | 36 | 104.4 Ų | 104.4 | 22% | 0.221 | 51% | 0.508 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.6 | -14.9 | -167.2 | 23 | 0 | 0 | 0 | 0 | 116.5 | D117 D128 | D117-T126 WeakPolarHBondContact OD1-CG2 3.17Å; T126-D128 VanDerWaalsContact C-N 3.34Å; T126-D128 PolarHBondContact O-N 3.48Å |
| 127 | Y | 53 | Low | 52.5 | Low | 169 Ų | 169 | 103.4 Ų | 103.4 | 66% | 0.663 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -67.7 | -27.9 | -176.5 | -55.1 | -77.4 | 0 | 0 | 0 | 114.3 | H125 | H125-Y127 PolarHBondContact O-N 3.05Å |
| 128 | D | 51.2 | Low | 52.5 | Low | 116 Ų | 116 | 103.5 Ų | 103.5 | 62% | 0.62 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -84.5 | -33.9 | -172.5 | -132.7 | 2.3 | 0 | 0 | 0 | 112.8 | T126 F130 Q131 C132 | T126-D128 VanDerWaalsContact C-N 3.34Å; T126-D128 PolarHBondContact O-N 3.48Å; D128-F130 VanDerWaalsContact C-N 3.35Å; D128-F130 PolarHBondContact O-N 3.4Å; D128-Q131 PolarHBondContact O-N 3.44Å; D128-C132 PolarHBondContact O-N 2.89Å; D128-C132 PolarHBondContact O-SG 2.97Å; D128-C132 VanDerWaalsContact O-SG 3.33Å |
| 129 | L | 51.6 | Low | 52.3 | Low | 86 Ų | 86 | 99 Ų | 99 | 45% | 0.45 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -70.1 | -32.1 | -178 | -169.3 | 65.4 | 0 | 0 | 0 | 111.9 | Y113 C132 M133 | Y113-L129 HydrophobicContact CD2-CD2 4.41Å; Y113-L129 HydrophobicContact CE2-CB 4.39Å; Y113-L129 HydrophobicContact CE2-CD2 3.86Å; Y113-L129 HydrophobicContact CE2-CG 3.93Å; L129-C132 WeakPolarHBondContact O-CB 3.05Å; L129-C132 PolarHBondContact O-N 3.4Å; L129-M133 WeakPolarHBondContact O-CG 3.06Å; L129-M133 PolarHBondContact O-N 3.35Å |
| 130 | F | 51.8 | Low | 52.2 | Low | 66 Ų | 66 | 94.4 Ų | 94.4 | 29% | 0.289 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -69 | -42.9 | 177.4 | -166.6 | -110.9 | 0 | 0 | 0 | 112.4 | Y113 D128 C132 M133 Y134 H274 | Y113-F130 HydrophobicContact CD1-CD2 4.25Å; Y113-F130 AromaticContact CE1-CD2 3.38Å; Y113-F130 HydrophobicContact CE1-CD2 3.38Å; Y113-F130 AromaticContact CE1-CE2 3.96Å; Y113-F130 HydrophobicContact CE1-CE2 3.96Å; Y113-F130 HydrophobicContact CE1-CG 4.43Å; Y113-F130 AromaticContact CZ-CD2 3.67Å; Y113-F130 WeakPolarHBondContact OH-CA 3.38Å; Y113-F130 VanDerWaalsContact OH-CB 3.26Å; Y113-F130 WeakPolarHBondContact OH-CB 3.41Å; Y113-F130 PolarHBondContact OH-N 3.37Å; D128-F130 VanDerWaalsContact C-N 3.35Å; D128-F130 PolarHBondContact O-N 3.4Å; F130-C132 VanDerWaalsContact C-N 3.27Å; F130-C132 PolarHBondContact O-N 2.93Å; F130-M133 PolarHBondContact O-N 2.94Å; F130-M133 VanDerWaalsContact O-N 3.08Å; F130-Y134 PolarHBondContact O-N 2.91Å; F130-H274 AromaticContact CD1-CD2 3.53Å; F130-H274 AromaticContact CD1-NE2 3.38Å; F130-H274 WeakPolarHBondContact CD1-NE2 3.46Å; F130-H274 AromaticContact CE1-CD2 3.11Å; F130-H274 WeakPolarHBondContact CE1-CD2 3.49Å; F130-H274 AromaticContact CE1-CG 3.96Å; F130-H274 AromaticContact CE1-NE2 3.23Å; F130-H274 WeakPolarHBondContact CE1-NE2 3.4Å; F130-H274 HydrophobicContact CZ-CB 4.5Å; F130-H274 AromaticContact CZ-CD2 3.48Å; F130-H274 VanDerWaalsContact CZ-CD2 3.48Å; F130-H274 WeakPolarHBondContact CZ-CD2 3.37Å |
| 131 | Q | 54.1 | Low | 52.2 | Low | 82 Ų | 82 | 88.9 Ų | 88.9 | 38% | 0.383 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -57.7 | -43 | 175.1 | -97.1 | -168.2 | -4.3 | 0 | 0 | 111 | D128 M133 Y134 I135 | D128-Q131 PolarHBondContact O-N 3.44Å; Q131-M133 VanDerWaalsContact C-N 3.29Å; Q131-M133 PolarHBondContact O-N 3.42Å; Q131-Y134 PolarHBondContact O-N 3.44Å; Q131-I135 WeakPolarHBondContact O-CB 3.49Å; Q131-I135 WeakPolarHBondContact O-CD1 3.23Å; Q131-I135 VanDerWaalsContact O-CG1 3.23Å; Q131-I135 WeakPolarHBondContact O-CG1 3.46Å; Q131-I135 PolarHBondContact O-N 3.47Å |
| 132 | C | 53 | Low | 52.2 | Low | 69 Ų | 69 | 84.9 Ų | 84.9 | 47% | 0.466 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -56.8 | -43.6 | 175.3 | -67.3 | 0 | 0 | 0 | 0 | 112 | D128 L129 F130 L136 | D128-C132 PolarHBondContact O-N 2.89Å; D128-C132 PolarHBondContact O-SG 2.97Å; D128-C132 VanDerWaalsContact O-SG 3.33Å; L129-C132 WeakPolarHBondContact O-CB 3.05Å; L129-C132 PolarHBondContact O-N 3.4Å; F130-C132 VanDerWaalsContact C-N 3.27Å; F130-C132 PolarHBondContact O-N 2.93Å; C132-L136 VanDerWaalsContact O-CB 3.22Å; C132-L136 WeakPolarHBondContact O-CB 3.38Å; C132-L136 PolarHBondContact O-N 3.46Å |
| 133 | M | 54.8 | Low | 52.3 | Low | 67 Ų | 67 | 88.1 Ų | 88.1 | 33% | 0.33 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -68 | -43.2 | 178.6 | -67.4 | -62.3 | 163.1 | 0 | 0 | 112.1 | Y113 L129 F130 Q131 L136 F137 | Y113-M133 HydrophobicContact CD2-CG 4.33Å; L129-M133 WeakPolarHBondContact O-CG 3.06Å; L129-M133 PolarHBondContact O-N 3.35Å; F130-M133 PolarHBondContact O-N 2.94Å; F130-M133 VanDerWaalsContact O-N 3.08Å; Q131-M133 VanDerWaalsContact C-N 3.29Å; Q131-M133 PolarHBondContact O-N 3.42Å; M133-L136 PolarHBondContact O-N 3.33Å; M133-F137 HydrophobicContact CB-CE2 4.33Å; M133-F137 WeakPolarHBondContact O-CD2 3.39Å; M133-F137 PolarHBondContact O-N 3.23Å |
| 134 | Y | 53.9 | Low | 52.6 | Low | 44 Ų | 44 | 81.7 Ų | 81.7 | 17% | 0.173 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -60.5 | -46.9 | 176 | -174.8 | -79.4 | 0 | 0 | 0 | 111.6 | F130 Q131 L136 F137 L138 Y185 Y207 | F130-Y134 PolarHBondContact O-N 2.91Å; Q131-Y134 PolarHBondContact O-N 3.44Å; Y134-L136 VanDerWaalsContact C-N 3.28Å; Y134-L136 PolarHBondContact O-N 3.3Å; Y134-F137 PolarHBondContact O-N 3.47Å; Y134-L138 HydrophobicContact CE1-CD1 4.03Å; Y134-L138 WeakPolarHBondContact O-CB 3.44Å; Y134-L138 PolarHBondContact O-N 2.97Å; Y134-Y185 HydrophobicContact CE2-CE2 4.37Å; Y134-Y185 PolarHBondContact OH-OH 2.91Å; Y134-Y207 AromaticContact CD1-CD2 3.93Å; Y134-Y207 HydrophobicContact CD1-CD2 3.93Å; Y134-Y207 AromaticContact CD1-CE2 3.43Å; Y134-Y207 HydrophobicContact CD1-CE2 3.43Å; Y134-Y207 VanDerWaalsContact CD1-CE2 3.43Å; Y134-Y207 AromaticContact CE1-CD2 3.17Å; Y134-Y207 HydrophobicContact CE1-CD2 3.17Å; Y134-Y207 AromaticContact CE1-CE2 3.19Å; Y134-Y207 HydrophobicContact CE1-CE2 3.19Å; Y134-Y207 HydrophobicContact CE1-CG 4.19Å; Y134-Y207 AromaticContact CZ-CD2 3.94Å |
| 135 | I | 54.2 | Low | 52.5 | Low | 84 Ų | 84 | 73.3 Ų | 73.3 | 43% | 0.431 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -57.3 | -44.2 | 174.6 | -71.2 | 161.1 | 0 | 0 | 0 | 110.6 | Q131 L138 G139 Y207 | Q131-I135 WeakPolarHBondContact O-CB 3.49Å; Q131-I135 WeakPolarHBondContact O-CD1 3.23Å; Q131-I135 VanDerWaalsContact O-CG1 3.23Å; Q131-I135 WeakPolarHBondContact O-CG1 3.46Å; Q131-I135 PolarHBondContact O-N 3.47Å; I135-L138 PolarHBondContact O-N 3.25Å; I135-G139 PolarHBondContact O-N 3.49Å; I135-Y207 WeakPolarHBondContact CG1-OH 3.19Å |
| 136 | L | 53.5 | Low | 52.7 | Low | 92 Ų | 92 | 70.5 Ų | 70.5 | 48% | 0.482 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -64.5 | -43.7 | -179.3 | -171.8 | 141.9 | 0 | 0 | 0 | 111.3 | C132 M133 Y134 G139 L140 | C132-L136 VanDerWaalsContact O-CB 3.22Å; C132-L136 WeakPolarHBondContact O-CB 3.38Å; C132-L136 PolarHBondContact O-N 3.46Å; M133-L136 PolarHBondContact O-N 3.33Å; Y134-L136 VanDerWaalsContact C-N 3.28Å; Y134-L136 PolarHBondContact O-N 3.3Å; L136-G139 PolarHBondContact O-N 2.92Å; L136-L140 HydrophobicContact CD2-CD1 3.6Å; L136-L140 HydrophobicContact CD2-CG 4.41Å; L136-L140 HydrophobicContact CG-CD1 4.4Å; L136-L140 WeakPolarHBondContact O-CB 3.48Å; L136-L140 WeakPolarHBondContact O-CG 3.22Å; L136-L140 PolarHBondContact O-N 3.37Å |
| 137 | F | 53.4 | Low | 52.8 | Low | 44 Ų | 44 | 70.8 Ų | 70.8 | 19% | 0.193 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -65.3 | -41.9 | 175.8 | -73.4 | -58.5 | 0 | 0 | 0 | 112.8 | A106 I110 M133 Y134 L140 A141 | A106-F137 HydrophobicContact CB-CE1 3.81Å; A106-F137 HydrophobicContact CB-CZ 4.38Å; I110-F137 HydrophobicContact CD1-CE2 3.95Å; I110-F137 HydrophobicContact CD1-CZ 3.82Å; I110-F137 HydrophobicContact CG1-CE2 3.75Å; I110-F137 HydrophobicContact CG1-CZ 3.7Å; M133-F137 HydrophobicContact CB-CE2 4.33Å; M133-F137 WeakPolarHBondContact O-CD2 3.39Å; M133-F137 PolarHBondContact O-N 3.23Å; Y134-F137 PolarHBondContact O-N 3.47Å; F137-L140 PolarHBondContact O-N 3.39Å; F137-A141 WeakPolarHBondContact O-CB 3.32Å; F137-A141 PolarHBondContact O-N 3.29Å |
| 138 | L | 54.8 | Low | 52.8 | Low | 31 Ų | 31 | 67 Ų | 67 | 16% | 0.162 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -67.2 | -41.5 | 177.2 | -153.6 | 96.2 | 0 | 0 | 0 | 111.5 | Y134 I135 L140 A141 A142 Y185 Y207 | Y134-L138 HydrophobicContact CE1-CD1 4.03Å; Y134-L138 WeakPolarHBondContact O-CB 3.44Å; Y134-L138 PolarHBondContact O-N 2.97Å; I135-L138 PolarHBondContact O-N 3.25Å; L138-L140 VanDerWaalsContact C-N 3.34Å; L138-A141 PolarHBondContact O-N 2.97Å; L138-A142 WeakPolarHBondContact O-CB 3.47Å; L138-A142 PolarHBondContact O-N 2.89Å; L138-Y185 HydrophobicContact CD1-CD1 4.34Å; L138-Y185 HydrophobicContact CD1-CE1 4.28Å; L138-Y207 HydrophobicContact CD2-CD1 3.92Å; L138-Y207 HydrophobicContact CD2-CE1 4.16Å; L138-Y207 HydrophobicContact CD2-CG 4.19Å |
| 139 | G | 50.4 | Low | 52.8 | Low | 42 Ų | 42 | 64.8 Ų | 64.8 | 43% | 0.433 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -62.2 | -40.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | I135 L136 A142 W143 | I135-G139 PolarHBondContact O-N 3.49Å; L136-G139 PolarHBondContact O-N 2.92Å; G139-A142 PolarHBondContact O-N 3.37Å; G139-W143 VanDerWaalsContact O-CB 3.26Å; G139-W143 WeakPolarHBondContact O-CB 3.24Å; G139-W143 PolarHBondContact O-N 3.04Å |
| 140 | L | 53.6 | Low | 52.9 | Low | 74 Ų | 74 | 64.2 Ų | 64.2 | 39% | 0.387 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -67 | -36.5 | 173.2 | -71.7 | 173.3 | 0 | 0 | 0 | 112.4 | L136 F137 L138 W143 S144 L182 | L136-L140 HydrophobicContact CD2-CD1 3.6Å; L136-L140 HydrophobicContact CD2-CG 4.41Å; L136-L140 HydrophobicContact CG-CD1 4.4Å; L136-L140 WeakPolarHBondContact O-CB 3.48Å; L136-L140 WeakPolarHBondContact O-CG 3.22Å; L136-L140 PolarHBondContact O-N 3.37Å; F137-L140 PolarHBondContact O-N 3.39Å; L138-L140 VanDerWaalsContact C-N 3.34Å; L140-W143 PolarHBondContact O-N 3.29Å; L140-S144 WeakPolarHBondContact O-CB 3.49Å; L140-S144 PolarHBondContact O-N 3.22Å; L140-S144 PolarHBondContact O-OG 2.98Å; L140-L182 HydrophobicContact CB-CD1 4.15Å; L140-L182 HydrophobicContact CB-CD2 3.78Å; L140-L182 HydrophobicContact CD1-CD2 3.88Å; L140-L182 HydrophobicContact CG-CD2 4.46Å |
| 141 | A | 51.5 | Low | 52.9 | Low | 9 Ų | 9 | 64 Ų | 64 | 7% | 0.074 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -67.8 | -39.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | F137 L138 S144 M145 T186 | F137-A141 WeakPolarHBondContact O-CB 3.32Å; F137-A141 PolarHBondContact O-N 3.29Å; L138-A141 PolarHBondContact O-N 2.97Å; A141-S144 PolarHBondContact O-OG 3.04Å; A141-M145 PolarHBondContact O-N 3.34Å; A141-M145 VanDerWaalsContact O-N 3.15Å; A141-T186 HydrophobicContact CB-CG2 3.7Å |
| 142 | A | 48.6 | Very low | 52.7 | Low | 53 Ų | 53 | 63 Ų | 63 | 44% | 0.438 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -67.2 | -39.9 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | L138 G139 M145 W146 | L138-A142 WeakPolarHBondContact O-CB 3.47Å; L138-A142 PolarHBondContact O-N 2.89Å; G139-A142 PolarHBondContact O-N 3.37Å; A142-M145 PolarHBondContact O-N 2.71Å; A142-W146 PolarHBondContact O-N 3.21Å |
| 143 | W | 54.2 | Low | 52.4 | Low | 159 Ų | 159 | 64.9 Ų | 64.9 | 60% | 0.602 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -62.4 | -46.9 | 175.4 | -177.5 | -71.9 | 0 | 0 | 0 | 111.8 | G139 L140 M145 W146 R147 | G139-W143 VanDerWaalsContact O-CB 3.26Å; G139-W143 WeakPolarHBondContact O-CB 3.24Å; G139-W143 PolarHBondContact O-N 3.04Å; L140-W143 PolarHBondContact O-N 3.29Å; W143-M145 VanDerWaalsContact C-N 3.25Å; W143-M145 PolarHBondContact O-N 2.88Å; W143-W146 PolarHBondContact O-N 3.23Å; W143-R147 WeakPolarHBondContact O-CG 3.49Å; W143-R147 PolarHBondContact O-N 2.95Å |
| 144 | S | 52.3 | Low | 52 | Low | 29 Ų | 29 | 64.2 Ų | 64.2 | 20% | 0.203 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -60.8 | -38 | 177.6 | 66.8 | 0 | 0 | 0 | 0 | 111 | L140 A141 R147 I148 | L140-S144 WeakPolarHBondContact O-CB 3.49Å; L140-S144 PolarHBondContact O-N 3.22Å; L140-S144 PolarHBondContact O-OG 2.98Å; A141-S144 PolarHBondContact O-OG 3.04Å; S144-R147 WeakPolarHBondContact O-CB 3.09Å; S144-R147 PolarHBondContact O-N 3.4Å; S144-I148 VanDerWaalsContact O-CG1 3.3Å; S144-I148 WeakPolarHBondContact O-CG1 3.41Å; S144-I148 PolarHBondContact O-N 3.18Å; S144-I148 VanDerWaalsContact O-N 3.09Å |
| 145 | M | 51.7 | Low | 51.3 | Low | 12 Ų | 12 | 67.2 Ų | 67.2 | 6% | 0.059 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -66.7 | -42.1 | 174.3 | -169.4 | 58.6 | -175.2 | 0 | 0 | 113.3 | A141 A142 W143 R147 I148 N149 L189 R196 | A141-M145 PolarHBondContact O-N 3.34Å; A141-M145 VanDerWaalsContact O-N 3.15Å; A142-M145 PolarHBondContact O-N 2.71Å; W143-M145 VanDerWaalsContact C-N 3.25Å; W143-M145 PolarHBondContact O-N 2.88Å; M145-R147 VanDerWaalsContact C-N 3.27Å; M145-R147 PolarHBondContact O-N 3.29Å; M145-I148 PolarHBondContact O-N 3.49Å; M145-N149 WeakPolarHBondContact CE-OD1 3.4Å; M145-N149 WeakPolarHBondContact O-CB 3.3Å; M145-N149 PolarHBondContact O-N 3.11Å; M145-L189 HydrophobicContact CB-CD2 4.24Å; M145-L189 HydrophobicContact CE-CD2 4.46Å; M145-L189 HydrophobicContact CG-CD2 3.9Å; M145-L189 HydrophobicContact SD-CD2 3.7Å; M145-R196 HydrophobicContact CE-CB 4.43Å |
| 146 | W | 54.6 | Low | 50.5 | Low | 117 Ų | 117 | 69.3 Ų | 69.3 | 44% | 0.443 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -60.1 | -38.4 | 175 | 178.5 | 87.4 | 0 | 0 | 0 | 111.8 | A142 W143 N150 I152 | A142-W146 PolarHBondContact O-N 3.21Å; W143-W146 PolarHBondContact O-N 3.23Å; W146-N150 VanDerWaalsContact CD1-ND2 3.32Å; W146-N150 VanDerWaalsContact CD2-ND2 3.28Å; W146-N150 PolarHBondContact NE1-ND2 3.3Å; W146-N150 WeakPolarHBondContact O-CB 3.23Å; W146-N150 PolarHBondContact O-N 2.99Å; W146-N150 VanDerWaalsContact O-N 3.08Å; W146-N150 PolarHBondContact O-ND2 3.11Å; W146-I152 HydrophobicContact CE3-CD1 4.32Å; W146-I152 HydrophobicContact CH2-CD1 3.7Å; W146-I152 HydrophobicContact CZ3-CD1 3.57Å |
| 147 | R | 51.7 | Low | 49.7 | Very low | 41 Ų | 41 | 70.6 Ų | 70.6 | 16% | 0.155 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -63.1 | -49.3 | 175.2 | -69.5 | -76.9 | -68.3 | -128.7 | 1.4 | 111.9 | W143 S144 M145 N149 N150 G151 I152 P153 P155 | W143-R147 WeakPolarHBondContact O-CG 3.49Å; W143-R147 PolarHBondContact O-N 2.95Å; S144-R147 WeakPolarHBondContact O-CB 3.09Å; S144-R147 PolarHBondContact O-N 3.4Å; M145-R147 VanDerWaalsContact C-N 3.27Å; M145-R147 PolarHBondContact O-N 3.29Å; R147-N149 VanDerWaalsContact C-N 3.35Å; R147-N149 PolarHBondContact O-N 3.4Å; R147-N150 PolarHBondContact O-N 3.36Å; R147-G151 PolarHBondContact O-N 3.13Å; R147-I152 VanDerWaalsContact NE-CG2 3.28Å; R147-I152 PolarHBondContact O-N 2.9Å; R147-P153 PolarHBondContact NH2-O 3.25Å; R147-P155 VanDerWaalsContact NH2-CD 3.28Å |
| 148 | I | 53.9 | Low | 48.9 | Very low | 91 Ų | 91 | 71.6 Ų | 71.6 | 47% | 0.467 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -58.1 | -47 | 178 | -66.8 | 164.8 | 0 | 0 | 0 | 110.5 | S144 M145 N150 G151 | S144-I148 VanDerWaalsContact O-CG1 3.3Å; S144-I148 WeakPolarHBondContact O-CG1 3.41Å; S144-I148 PolarHBondContact O-N 3.18Å; S144-I148 VanDerWaalsContact O-N 3.09Å; M145-I148 PolarHBondContact O-N 3.49Å; I148-N150 VanDerWaalsContact C-N 3.32Å; I148-N150 PolarHBondContact O-N 3.22Å; I148-G151 PolarHBondContact O-N 3.29Å |
| 149 | N | 50.4 | Low | 48 | Very low | 68 Ų | 68 | 71.9 Ų | 71.9 | 36% | 0.364 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -66.5 | -30.6 | -179.4 | -83.4 | -5.6 | 0 | 0 | 0 | 113.6 | M145 R147 G151 | M145-N149 WeakPolarHBondContact CE-OD1 3.4Å; M145-N149 WeakPolarHBondContact O-CB 3.3Å; M145-N149 PolarHBondContact O-N 3.11Å; R147-N149 VanDerWaalsContact C-N 3.35Å; R147-N149 PolarHBondContact O-N 3.4Å; N149-G151 VanDerWaalsContact C-N 3.31Å |
| 150 | N | 53.7 | Low | 47.5 | Very low | 74 Ų | 74 | 75.5 Ų | 75.5 | 40% | 0.396 | 43% | 0.428 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90 | 7 | 177.3 | -68.6 | -56.9 | 0 | 0 | 0 | 113.3 | W146 R147 I148 I152 | W146-N150 VanDerWaalsContact CD1-ND2 3.32Å; W146-N150 VanDerWaalsContact CD2-ND2 3.28Å; W146-N150 PolarHBondContact NE1-ND2 3.3Å; W146-N150 WeakPolarHBondContact O-CB 3.23Å; W146-N150 PolarHBondContact O-N 2.99Å; W146-N150 VanDerWaalsContact O-N 3.08Å; W146-N150 PolarHBondContact O-ND2 3.11Å; R147-N150 PolarHBondContact O-N 3.36Å; I148-N150 VanDerWaalsContact C-N 3.32Å; I148-N150 PolarHBondContact O-N 3.22Å; N150-I152 HydrophobicContact CB-CD1 3.84Å; N150-I152 HydrophobicContact CB-CG1 3.79Å; N150-I152 PolarHBondContact O-N 2.88Å |
| 151 | G | 52 | Low | 46.8 | Very low | 63 Ų | 63 | 76.2 Ų | 76.2 | 65% | 0.649 | 45% | 0.445 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.8 | 20.8 | -177.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | R147 I148 N149 P153 | R147-G151 PolarHBondContact O-N 3.13Å; I148-G151 PolarHBondContact O-N 3.29Å; N149-G151 VanDerWaalsContact C-N 3.31Å; G151-P153 VanDerWaalsContact O-CD 3.23Å; G151-P153 WeakPolarHBondContact O-CD 3.39Å |
| 152 | I | 50.4 | Low | 46.2 | Very low | 61 Ų | 61 | 81.7 Ų | 81.7 | 31% | 0.313 | 47% | 0.472 | S | S | . | . | trans | -78.5 | 111.4 | 179.9 | -56.5 | 170.6 | 0 | 0 | 0 | 106.3 | W146 R147 N150 D154 | W146-I152 HydrophobicContact CE3-CD1 4.32Å; W146-I152 HydrophobicContact CH2-CD1 3.7Å; W146-I152 HydrophobicContact CZ3-CD1 3.57Å; R147-I152 VanDerWaalsContact NE-CG2 3.28Å; R147-I152 PolarHBondContact O-N 2.9Å; N150-I152 HydrophobicContact CB-CD1 3.84Å; N150-I152 HydrophobicContact CB-CG1 3.79Å; N150-I152 PolarHBondContact O-N 2.88Å; I152-D154 PolarHBondContact O-N 2.87Å | ||
| 153 | P | 46.3 | Very low | 45.8 | Very low | 108 Ų | 108 | 79.8 Ų | 79.8 | 70% | 0.701 | 46% | 0.456 | S | S | * | . | trans | -58.9 | 139.4 | -180 | 24.8 | -32.9 | 0 | 0 | 0 | 109.5 | R147 G151 | R147-P153 PolarHBondContact NH2-O 3.25Å; G151-P153 VanDerWaalsContact O-CD 3.23Å; G151-P153 WeakPolarHBondContact O-CD 3.39Å | ||
| 154 | D | 46.3 | Very low | 45.3 | Very low | 53 Ų | 53 | 79.5 Ų | 79.5 | 28% | 0.283 | 46% | 0.462 | S | S | . | . | trans | -55.4 | 146.4 | -178.1 | -69.1 | -54.7 | 0 | 0 | 0 | 111.6 | I152 Q156 F179 | I152-D154 PolarHBondContact O-N 2.87Å; D154-Q156 CarbonylContact O-C 3.59Å; D154-Q156 PolarHBondContact O-N 3.32Å; D154-F179 HydrophobicContact CB-CZ 3.93Å; D154-F179 VanDerWaalsContact OD2-CZ 3.24Å; D154-F179 WeakPolarHBondContact OD2-CZ 3.29Å | ||
| 155 | P | 39.8 | Very low | 44.9 | Very low | 107 Ų | 107 | 81.9 Ų | 81.9 | 70% | 0.695 | 48% | 0.475 | S | S | * | . | S | Bend | trans | -70.5 | 6.5 | 179.1 | 30.1 | -27.9 | 0 | 0 | 0 | 113 | R147 P157 | R147-P155 VanDerWaalsContact NH2-CD 3.28Å; P155-P157 WeakPolarHBondContact O-CD 3.19Å |
| 156 | Q | 36.6 | Very low | 44.7 | Very low | 128 Ų | 128 | 86.4 Ų | 86.4 | 60% | 0.598 | 50% | 0.5 | S | S | * | . | trans | -96.4 | 91 | 157.9 | -84.2 | -169.7 | -2.2 | 0 | 0 | 110 | D154 S158 | D154-Q156 CarbonylContact O-C 3.59Å; D154-Q156 PolarHBondContact O-N 3.32Å; Q156-S158 PolarHBondContact O-N 2.66Å; Q156-S158 VanDerWaalsContact O-N 3.12Å | ||
| 157 | P | 37.1 | Very low | 44.7 | Very low | 118 Ų | 118 | 84.7 Ų | 84.7 | 77% | 0.766 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.4 | 10.4 | 179.8 | 29.4 | -35.7 | 0 | 0 | 0 | 115.1 | P155 | P155-P157 WeakPolarHBondContact O-CD 3.19Š|
| 158 | S | 38.1 | Very low | 44.4 | Very low | 65 Ų | 65 | 88.1 Ų | 88.1 | 46% | 0.455 | 52% | 0.523 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -112.5 | 7.9 | -165.3 | 59.2 | 0 | 0 | 0 | 0 | 117.5 | Q156 L162 | Q156-S158 PolarHBondContact O-N 2.66Å; Q156-S158 VanDerWaalsContact O-N 3.12Å; S158-L162 VanDerWaalsContact O-CB 3.31Å; S158-L162 WeakPolarHBondContact O-CB 3.45Å; S158-L162 WeakPolarHBondContact O-CD1 3.33Å |
| 159 | T | 35.8 | Very low | 45 | Very low | 37 Ų | 37 | 89.3 Ų | 89.3 | 23% | 0.227 | 54% | 0.539 | C | S | . | . | S | Bend | trans | -136.3 | -28.6 | -174.7 | 52.2 | 0 | 0 | 0 | 0 | 117.5 | A161 L162 P177 | T159-A161 VanDerWaalsContact C-N 3.26Å; T159-A161 PolarHBondContact O-N 2.86Å; T159-L162 PolarHBondContact O-N 2.8Å; T159-P177 VanDerWaalsContact CB-CB 3.4Å; T159-P177 HydrophobicContact CG2-CB 4.16Å; T159-P177 WeakPolarHBondContact OG1-CB 3.34Å; T159-P177 VanDerWaalsContact OG1-CG 3.3Å; T159-P177 WeakPolarHBondContact OG1-CG 3.42Å |
| 160 | V | 39.6 | Very low | 45.2 | Very low | 119 Ų | 119 | 90.3 Ų | 90.3 | 72% | 0.721 | 55% | 0.545 | S | S | * | . | S | Bend | trans | -71.1 | -28.2 | 172.7 | -172.4 | 0 | 0 | 0 | 0 | 111.1 | P177 | V160-P177 HydrophobicContact CG2-CG 4.06Š|
| 161 | A | 38.6 | Very low | 44.7 | Very low | 89 Ų | 89 | 89 Ų | 89 | 74% | 0.736 | 54% | 0.54 | S | S | * | . | S | Bend | trans | -89.3 | -13.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | T159 | T159-A161 VanDerWaalsContact C-N 3.26Å; T159-A161 PolarHBondContact O-N 2.86Å |
| 162 | L | 37.9 | Very low | 44.7 | Very low | 123 Ų | 123 | 89 Ų | 89 | 64% | 0.644 | 52% | 0.524 | S | S | * | . | S | Bend | trans | -107.8 | 8.6 | -160.5 | -119.2 | 157.4 | 0 | 0 | 0 | 116.6 | S158 T159 | S158-L162 VanDerWaalsContact O-CB 3.31Å; S158-L162 WeakPolarHBondContact O-CB 3.45Å; S158-L162 WeakPolarHBondContact O-CD1 3.33Å; T159-L162 PolarHBondContact O-N 2.8Å |
| 163 | A | 40.5 | Very low | 44.5 | Very low | 13 Ų | 13 | 88.1 Ų | 88.1 | 11% | 0.107 | 52% | 0.52 | C | S | . | . | trans | -153.1 | 84.2 | 151.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | V165 I173 V175 | A163-V165 HydrophobicContact CB-CG2 4.01Å; A163-I173 CarbonylContact C-O 3.55Å; A163-V175 HydrophobicContact CB-CB 3.24Å; A163-V175 HydrophobicContact CB-CG1 4.29Å; A163-V175 HydrophobicContact CB-CG2 3.1Å; A163-V175 PolarHBondContact O-N 3.41Å | ||
| 164 | Q | 43.9 | Very low | 44.5 | Very low | 153 Ų | 153 | 85.9 Ų | 85.9 | 72% | 0.715 | 50% | 0.502 | S | S | * | . | E | Extended strand (participates in β ladder) | -91.7 | 75.2 | 122.6 | -68.2 | -176.9 | -14.9 | 0 | 0 | 106.7 | N166 I172 | Q164-N166 PolarHBondContact O-N 2.93Å; Q164-N166 VanDerWaalsContact O-N 3.14Å; Q164-I172 HydrophobicContact CB-CG2 4.45Å; Q164-I172 HydrophobicContact CG-CG2 4.12Å | |
| 165 | V | 44.7 | Very low | 44.2 | Very low | 80 Ų | 80 | 86.4 Ų | 86.4 | 49% | 0.485 | 51% | 0.506 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.6 | 102.7 | 165 | 176.9 | 0 | 0 | 0 | 0 | 104.9 | A163 V167 | A163-V165 HydrophobicContact CB-CG2 4.01Å; V165-V167 HydrophobicContact CG1-CG2 3.95Å; V165-V167 PolarHBondContact O-N 3.48Å |
| 166 | N | 46 | Very low | 44.4 | Very low | 107 Ų | 107 | 86 Ų | 86 | 57% | 0.572 | 50% | 0.498 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -68.1 | 97.8 | 169.1 | -172.5 | -1.8 | 0 | 0 | 0 | 106.8 | Q164 D168 | Q164-N166 PolarHBondContact O-N 2.93Å; Q164-N166 VanDerWaalsContact O-N 3.14Å; N166-D168 VanDerWaalsContact C-N 3.35Å; N166-D168 PolarHBondContact OD1-N 2.88Å; N166-D168 PolarHBondContact OD1-O 2.87Å |
| 167 | V | 55.6 | Low | 44.6 | Very low | 80 Ų | 80 | 80.8 Ų | 80.8 | 49% | 0.485 | 48% | 0.475 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.9 | -30.9 | 177.6 | 179 | 0 | 0 | 0 | 0 | 110.1 | V165 I173 | V165-V167 HydrophobicContact CG1-CG2 3.95Å; V165-V167 PolarHBondContact O-N 3.48Å; V167-I173 HydrophobicContact CB-CD1 4.35Å; V167-I173 HydrophobicContact CG2-CD1 3.38Å; V167-I173 HydrophobicContact CG2-CG1 4.09Å |
| 168 | D | 46.4 | Very low | 44.7 | Very low | 113 Ų | 113 | 80.5 Ų | 80.5 | 60% | 0.604 | 46% | 0.46 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -161.8 | 157.8 | 176.3 | -82.4 | -45.1 | 0 | 0 | 0 | 110.8 | N166 N170 T171 | N166-D168 VanDerWaalsContact C-N 3.35Å; N166-D168 PolarHBondContact OD1-N 2.88Å; N166-D168 PolarHBondContact OD1-O 2.87Å; D168-N170 PolarHBondContact O-N 3.5Å; D168-T171 PolarHBondContact N-OG1 2.75Å; D168-T171 PolarHBondContact O-N 3.47Å; D168-T171 PolarHBondContact O-OG1 3.39Å |
| 169 | S | 64.6 | Low | 44.7 | Very low | 116 Ų | 116 | 81 Ų | 81 | 81% | 0.811 | 45% | 0.454 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -47.9 | -19.2 | -172.4 | -46.7 | 0 | 0 | 0 | 0 | 116.5 | ||
| 170 | N | 55.1 | Low | 45 | Very low | 89 Ų | 89 | 79.7 Ų | 79.7 | 48% | 0.476 | 45% | 0.446 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -116.2 | -1.1 | 179.9 | -71.8 | 2.1 | 0 | 0 | 0 | 115 | M88 D168 | M88-N170 WeakPolarHBondContact CE-ND2 3.36Å; D168-N170 PolarHBondContact O-N 3.5Å |
| 171 | T | 44.5 | Very low | 45.1 | Very low | 47 Ų | 47 | 77 Ų | 77 | 29% | 0.288 | 43% | 0.43 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.2 | 103.4 | -176.7 | 56.4 | 0 | 0 | 0 | 0 | 111.2 | D168 | D168-T171 PolarHBondContact N-OG1 2.75Å; D168-T171 PolarHBondContact O-N 3.47Å; D168-T171 PolarHBondContact O-OG1 3.39Å |
| 172 | I | 52 | Low | 45.1 | Very low | 62 Ų | 62 | 74.6 Ų | 74.6 | 32% | 0.318 | 40% | 0.404 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.2 | 108.8 | 169.9 | -56.3 | 176.6 | 0 | 0 | 0 | 107 | Q164 L174 | Q164-I172 HydrophobicContact CB-CG2 4.45Å; Q164-I172 HydrophobicContact CG-CG2 4.12Å; I172-L174 HydrophobicContact CG2-CD1 3.77Å; I172-L174 PolarHBondContact O-N 2.63Å |
| 173 | I | 44.7 | Very low | 45.6 | Very low | 44 Ų | 44 | 69.1 Ų | 69.1 | 23% | 0.226 | 38% | 0.378 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.8 | 105.9 | 168.4 | -57.4 | -175.4 | 0 | 0 | 0 | 106.5 | A163 V167 V175 | A163-I173 CarbonylContact C-O 3.55Å; V167-I173 HydrophobicContact CB-CD1 4.35Å; V167-I173 HydrophobicContact CG2-CD1 3.38Å; V167-I173 HydrophobicContact CG2-CG1 4.09Å; I173-V175 HydrophobicContact CG2-CG2 4.38Å; I173-V175 PolarHBondContact O-N 3.29Å |
| 174 | L | 46 | Very low | 45.9 | Very low | 61 Ų | 61 | 68.7 Ų | 68.7 | 32% | 0.319 | 37% | 0.373 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.1 | 108.3 | 166.7 | -116.5 | 79.6 | 0 | 0 | 0 | 108.3 | I172 D176 | I172-L174 HydrophobicContact CG2-CD1 3.77Å; I172-L174 PolarHBondContact O-N 2.63Å; L174-D176 PolarHBondContact O-N 3.32Å |
| 175 | V | 40.5 | Very low | 46.1 | Very low | 64 Ų | 64 | 62.7 Ų | 62.7 | 39% | 0.388 | 35% | 0.345 | S | S | . | . | trans | -80.5 | 107.6 | 162.9 | 170 | 0 | 0 | 0 | 0 | 107.4 | A163 I173 P177 | A163-V175 HydrophobicContact CB-CB 3.24Å; A163-V175 HydrophobicContact CB-CG1 4.29Å; A163-V175 HydrophobicContact CB-CG2 3.1Å; A163-V175 PolarHBondContact O-N 3.41Å; I173-V175 HydrophobicContact CG2-CG2 4.38Å; I173-V175 PolarHBondContact O-N 3.29Å; V175-P177 WeakPolarHBondContact O-CD 3.32Å | ||
| 176 | D | 44.2 | Very low | 46.3 | Very low | 97 Ų | 97 | 59.7 Ų | 59.7 | 52% | 0.519 | 33% | 0.327 | S | S | . | . | trans | -86.4 | 106 | 171.5 | -143.1 | -34.2 | 0 | 0 | 0 | 107 | R94 L174 Y178 | R94-D176 IonicContact CZ-OD2 3.86Å; R94-D176 IonicContact NH1-OD2 2.87Å; R94-D176 PolarHBondContact NH1-OD2 3.08Å; L174-D176 PolarHBondContact O-N 3.32Å; D176-Y178 PolarHBondContact O-N 2.93Å; D176-Y178 VanDerWaalsContact O-N 3.1Å | ||
| 177 | P | 41.2 | Very low | 46.5 | Very low | 19 Ų | 19 | 54.7 Ų | 54.7 | 12% | 0.123 | 30% | 0.3 | C | S | . | . | trans | -57.3 | 121.3 | 168.2 | 16.9 | -25.8 | 0 | 0 | 0 | 109.7 | T159 V160 V175 F179 | T159-P177 VanDerWaalsContact CB-CB 3.4Å; T159-P177 HydrophobicContact CG2-CB 4.16Å; T159-P177 WeakPolarHBondContact OG1-CB 3.34Å; T159-P177 VanDerWaalsContact OG1-CG 3.3Å; T159-P177 WeakPolarHBondContact OG1-CG 3.42Å; V160-P177 HydrophobicContact CG2-CG 4.06Å; V175-P177 WeakPolarHBondContact O-CD 3.32Å; P177-F179 VanDerWaalsContact C-N 3.28Å; P177-F179 PolarHBondContact O-N 3.23Å | ||
| 178 | Y | 38.8 | Very low | 46.2 | Very low | 113 Ų | 113 | 51.4 Ų | 51.4 | 44% | 0.443 | 28% | 0.279 | S | S | . | . | trans | -60.5 | 85.1 | 178.6 | -159.8 | -103.9 | 0 | 0 | 0 | 110.7 | D176 D180 | D176-Y178 PolarHBondContact O-N 2.93Å; D176-Y178 VanDerWaalsContact O-N 3.1Å; Y178-D180 HydrophobicContact CD1-CB 3.8Å; Y178-D180 HydrophobicContact CE1-CB 3.43Å; Y178-D180 VanDerWaalsContact CE1-CB 3.43Å; Y178-D180 WeakPolarHBondContact CE1-OD2 3.48Å; Y178-D180 PolarHBondContact O-N 3.26Å; Y178-D180 PolarHBondContact OH-OD2 3.37Å | ||
| 179 | F | 38.7 | Very low | 46.4 | Very low | 76 Ų | 76 | 46.9 Ų | 46.9 | 33% | 0.333 | 26% | 0.255 | S | S | . | . | trans | -79.3 | 46.6 | 176 | -107.9 | -80.3 | 0 | 0 | 0 | 112 | D154 P177 T181 K190 | D154-F179 HydrophobicContact CB-CZ 3.93Å; D154-F179 VanDerWaalsContact OD2-CZ 3.24Å; D154-F179 WeakPolarHBondContact OD2-CZ 3.29Å; P177-F179 VanDerWaalsContact C-N 3.28Å; P177-F179 PolarHBondContact O-N 3.23Å; F179-T181 VanDerWaalsContact C-N 3.26Å; F179-T181 PolarHBondContact O-N 3.47Å; F179-K190 WeakPolarHBondContact O-CE 3.11Å; F179-K190 PolarHBondContact O-NZ 3.32Å | ||
| 180 | D | 40.5 | Very low | 45.8 | Very low | 9 Ų | 9 | 45 Ų | 45 | 5% | 0.048 | 23% | 0.232 | C | C | . | . | trans | -93.3 | 24 | 179.2 | -75.8 | 13.4 | 0 | 0 | 0 | 112.1 | N104 Y178 L182 K190 | N104-D180 PolarHBondContact ND2-O 3.01Å; Y178-D180 HydrophobicContact CD1-CB 3.8Å; Y178-D180 HydrophobicContact CE1-CB 3.43Å; Y178-D180 VanDerWaalsContact CE1-CB 3.43Å; Y178-D180 WeakPolarHBondContact CE1-OD2 3.48Å; Y178-D180 PolarHBondContact O-N 3.26Å; Y178-D180 PolarHBondContact OH-OD2 3.37Å; D180-L182 PolarHBondContact O-N 3.41Å; D180-K190 IonicContact OD1-NZ 2.84Å; D180-K190 PolarHBondContact OD1-NZ 2.96Å | ||
| 181 | T | 42.9 | Very low | 45.5 | Very low | 63 Ų | 63 | 41.9 Ų | 41.9 | 39% | 0.387 | 21% | 0.214 | S | C | . | . | trans | -76 | -19 | -169.8 | 51.6 | 0 | 0 | 0 | 0 | 114.7 | N104 A106 F179 | N104-T181 WeakPolarHBondContact ND2-CA 2.9Å; N104-T181 PolarHBondContact ND2-O 2.71Å; N104-T181 WeakPolarHBondContact OD1-CA 3.37Å; N104-T181 WeakPolarHBondContact OD1-CG2 3.48Å; A106-T181 WeakPolarHBondContact CB-O 3.36Å; F179-T181 VanDerWaalsContact C-N 3.26Å; F179-T181 PolarHBondContact O-N 3.47Å | ||
| 182 | L | 39.1 | Very low | 45.7 | Very low | 37 Ų | 37 | 44 Ų | 44 | 19% | 0.194 | 23% | 0.231 | C | C | . | . | S | Bend | trans | -125.9 | 56.1 | -166.7 | -68.7 | 173.2 | 0 | 0 | 0 | 113.6 | L140 D180 T186 | L140-L182 HydrophobicContact CB-CD1 4.15Å; L140-L182 HydrophobicContact CB-CD2 3.78Å; L140-L182 HydrophobicContact CD1-CD2 3.88Å; L140-L182 HydrophobicContact CG-CD2 4.46Å; D180-L182 PolarHBondContact O-N 3.41Å; L182-T186 WeakPolarHBondContact CA-OG1 3.46Å; L182-T186 HydrophobicContact CB-CG2 3.38Å; L182-T186 WeakPolarHBondContact CB-OG1 3.32Å; L182-T186 HydrophobicContact CD1-CG2 4.27Å; L182-T186 HydrophobicContact CG-CG2 4.48Å; L182-T186 WeakPolarHBondContact O-CB 3.32Å; L182-T186 VanDerWaalsContact O-CG2 3.24Å; L182-T186 WeakPolarHBondContact O-CG2 3.47Å; L182-T186 PolarHBondContact O-N 2.8Å; L182-T186 PolarHBondContact O-OG1 3.39Å |
| 183 | G | 47.3 | Very low | 46 | Very low | 9 Ų | 9 | 47.4 Ų | 47.4 | 9% | 0.093 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | 71.9 | 169.1 | 163.1 | 0 | 0 | 0 | 0 | 0 | 116.4 | Y185 T186 E187 F267 | G183-Y185 PolarHBondContact O-N 2.93Å; G183-T186 PolarHBondContact O-N 3.3Å; G183-T186 PolarHBondContact O-OG1 3.21Å; G183-E187 PolarHBondContact O-N 2.9Å; G183-F267 VanDerWaalsContact CA-CE2 3.46Å; G183-F267 VanDerWaalsContact CA-CZ 3.46Å |
| 184 | L | 46.3 | Very low | 46.9 | Very low | 3 Ų | 3 | 48 Ų | 48 | 2% | 0.016 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -46.1 | -33.3 | 170.9 | -169.4 | 73.5 | 0 | 0 | 0 | 112.3 | E188 I250 F267 | L184-E188 PolarHBondContact O-N 3.49Å; L184-I250 HydrophobicContact CD1-CD1 3.7Å; L184-F267 HydrophobicContact CB-CB 4.01Å; L184-F267 HydrophobicContact CB-CG 4.47Å |
| 185 | Y | 48.3 | Very low | 47.6 | Very low | 28 Ų | 28 | 47.5 Ų | 47.5 | 11% | 0.11 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -69 | -28.3 | -178.5 | -61.3 | -82 | 0 | 0 | 0 | 115.1 | Y134 L138 G183 E188 L189 R242 | Y134-Y185 HydrophobicContact CE2-CE2 4.37Å; Y134-Y185 PolarHBondContact OH-OH 2.91Å; L138-Y185 HydrophobicContact CD1-CD1 4.34Å; L138-Y185 HydrophobicContact CD1-CE1 4.28Å; G183-Y185 PolarHBondContact O-N 2.93Å; Y185-E188 WeakPolarHBondContact CA-OE1 3.11Å; Y185-E188 WeakPolarHBondContact O-CG 3.48Å; Y185-L189 WeakPolarHBondContact O-CD1 3.49Å; Y185-R242 PolarHBondContact OH-NH2 3.43Å |
| 186 | T | 50.2 | Low | 48.8 | Very low | 17 Ų | 17 | 46.9 Ų | 46.9 | 10% | 0.104 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -92.3 | -28.6 | 177.1 | 55.9 | 0 | 0 | 0 | 0 | 113.2 | A141 L182 G183 L189 K190 | A141-T186 HydrophobicContact CB-CG2 3.7Å; L182-T186 WeakPolarHBondContact CA-OG1 3.46Å; L182-T186 HydrophobicContact CB-CG2 3.38Å; L182-T186 WeakPolarHBondContact CB-OG1 3.32Å; L182-T186 HydrophobicContact CD1-CG2 4.27Å; L182-T186 HydrophobicContact CG-CG2 4.48Å; L182-T186 WeakPolarHBondContact O-CB 3.32Å; L182-T186 VanDerWaalsContact O-CG2 3.24Å; L182-T186 WeakPolarHBondContact O-CG2 3.47Å; L182-T186 PolarHBondContact O-N 2.8Å; L182-T186 PolarHBondContact O-OG1 3.39Å; G183-T186 PolarHBondContact O-N 3.3Å; G183-T186 PolarHBondContact O-OG1 3.21Å; T186-L189 PolarHBondContact O-N 3.4Å; T186-K190 PolarHBondContact O-N 3.03Å |
| 187 | E | 50.2 | Low | 49.7 | Very low | 2 Ų | 2 | 46.1 Ų | 46.1 | 1% | 0.009 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -60.9 | -42.4 | 173.6 | -85.6 | -85.4 | 102 | 0 | 0 | 111.8 | G183 L189 K190 Y191 I250 | G183-E187 PolarHBondContact O-N 2.9Å; E187-L189 VanDerWaalsContact C-N 3.32Å; E187-L189 PolarHBondContact O-N 3.21Å; E187-K190 PolarHBondContact O-N 2.84Å; E187-K190 IonicContact OE1-NZ 2.76Å; E187-K190 PolarHBondContact OE1-NZ 3.29Å; E187-Y191 VanDerWaalsContact O-CE2 3.3Å; E187-Y191 WeakPolarHBondContact O-CE2 3.19Å; E187-I250 HydrophobicContact CB-CD1 3.74Å; E187-I250 HydrophobicContact CB-CG1 4.23Å |
| 188 | E | 48.8 | Very low | 51.1 | Low | 11 Ų | 11 | 48.2 Ų | 48.2 | 5% | 0.051 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -68.5 | -29.1 | 178.8 | 68.3 | -168.6 | 168.5 | 0 | 0 | 113.2 | L184 Y185 K190 Y191 V199 N203 R242 S246 | L184-E188 PolarHBondContact O-N 3.49Å; Y185-E188 WeakPolarHBondContact CA-OE1 3.11Å; Y185-E188 WeakPolarHBondContact O-CG 3.48Å; E188-K190 VanDerWaalsContact C-N 3.29Å; E188-K190 PolarHBondContact O-N 3.28Å; E188-Y191 WeakPolarHBondContact O-CD2 3.31Å; E188-V199 HydrophobicContact CB-CG1 4.29Å; E188-V199 VanDerWaalsContact CD-CG1 3.49Å; E188-V199 HydrophobicContact CG-CG1 3.75Å; E188-N203 PolarHBondContact OE1-ND2 3.19Å; E188-R242 IonicContact OE1-NH1 3.59Å; E188-R242 IonicContact OE2-NH1 3.73Å; E188-S246 WeakPolarHBondContact OE2-CB 3.48Å; E188-S246 PolarHBondContact OE2-OG 3.36Å |
| 189 | L | 50.2 | Low | 52.6 | Low | 18 Ų | 18 | 44.4 Ų | 44.4 | 9% | 0.094 | 25% | 0.248 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -78.7 | -6.3 | 177.2 | -89.1 | 97 | 0 | 0 | 0 | 113.8 | M145 Y185 T186 E187 Y191 R196 L200 | M145-L189 HydrophobicContact CB-CD2 4.24Å; M145-L189 HydrophobicContact CE-CD2 4.46Å; M145-L189 HydrophobicContact CG-CD2 3.9Å; M145-L189 HydrophobicContact SD-CD2 3.7Å; Y185-L189 WeakPolarHBondContact O-CD1 3.49Å; T186-L189 PolarHBondContact O-N 3.4Å; E187-L189 VanDerWaalsContact C-N 3.32Å; E187-L189 PolarHBondContact O-N 3.21Å; L189-Y191 VanDerWaalsContact C-N 3.28Å; L189-Y191 PolarHBondContact O-N 3.33Å; L189-R196 WeakPolarHBondContact O-CD 3.26Å; L189-R196 WeakPolarHBondContact O-CG 3.2Å; L189-R196 VanDerWaalsContact O-CZ 3.3Å; L189-R196 PolarHBondContact O-NE 3.06Å; L189-L200 HydrophobicContact CD1-CD1 4.38Å; L189-L200 HydrophobicContact CD2-CB 4.44Å; L189-L200 HydrophobicContact CD2-CD1 4.22Å |
| 190 | K | 51.4 | Low | 54 | Low | 75 Ų | 75 | 43.2 Ų | 43.2 | 33% | 0.326 | 24% | 0.244 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -71.4 | -21.4 | 175.8 | -72.2 | 176.8 | -174.8 | 165.1 | 0 | 113 | F179 D180 T186 E187 E188 R196 | F179-K190 WeakPolarHBondContact O-CE 3.11Å; F179-K190 PolarHBondContact O-NZ 3.32Å; D180-K190 IonicContact OD1-NZ 2.84Å; D180-K190 PolarHBondContact OD1-NZ 2.96Å; T186-K190 PolarHBondContact O-N 3.03Å; E187-K190 PolarHBondContact O-N 2.84Å; E187-K190 IonicContact OE1-NZ 2.76Å; E187-K190 PolarHBondContact OE1-NZ 3.29Å; E188-K190 VanDerWaalsContact C-N 3.29Å; E188-K190 PolarHBondContact O-N 3.28Å; K190-R196 PolarHBondContact O-NH2 3.19Å |
| 191 | Y | 50.3 | Low | 55.5 | Low | 25 Ų | 25 | 46.4 Ų | 46.4 | 10% | 0.098 | 26% | 0.264 | C | S | . | . | S | Bend | trans | -79.7 | 173.8 | -172.4 | -59.1 | -65 | 0 | 0 | 0 | 114.2 | E187 E188 L189 R196 I250 L253 | E187-Y191 VanDerWaalsContact O-CE2 3.3Å; E187-Y191 WeakPolarHBondContact O-CE2 3.19Å; E188-Y191 WeakPolarHBondContact O-CD2 3.31Å; L189-Y191 VanDerWaalsContact C-N 3.28Å; L189-Y191 PolarHBondContact O-N 3.33Å; Y191-R196 WeakPolarHBondContact O-CD 3.29Å; Y191-R196 WeakPolarHBondContact O-CG 3.42Å; Y191-R196 PolarHBondContact O-NE 3.02Å; Y191-I250 HydrophobicContact CE2-CB 4.42Å; Y191-I250 HydrophobicContact CE2-CG1 4.04Å; Y191-I250 PolarHBondContact OH-O 2.99Å; Y191-I250 VanDerWaalsContact OH-O 3.07Å; Y191-L253 HydrophobicContact CD1-CB 3.27Å; Y191-L253 HydrophobicContact CD1-CD1 4.07Å; Y191-L253 HydrophobicContact CD1-CG 4.21Å; Y191-L253 HydrophobicContact CD2-CB 3.97Å; Y191-L253 HydrophobicContact CD2-CD1 3.54Å; Y191-L253 HydrophobicContact CD2-CG 4.41Å; Y191-L253 VanDerWaalsContact CE1-C 3.43Å; Y191-L253 HydrophobicContact CE1-CB 3.27Å; Y191-L253 WeakPolarHBondContact CE1-O 3.37Å; Y191-L253 HydrophobicContact CE2-CB 4Å; Y191-L253 HydrophobicContact CE2-CD1 4.18Å; Y191-L253 HydrophobicContact CG-CB 3.63Å; Y191-L253 HydrophobicContact CG-CD1 3.47Å; Y191-L253 VanDerWaalsContact CG-CD1 3.47Å; Y191-L253 HydrophobicContact CG-CG 4.12Å |
| 192 | S | 49.2 | Very low | 57 | Low | 92 Ų | 92 | 47.7 Ų | 47.7 | 64% | 0.643 | 27% | 0.267 | S | S | * | . | trans | -40.5 | 141.9 | -169 | -178.1 | 0 | 0 | 0 | 0 | 114.9 | G194 V195 R196 | S192-G194 PolarHBondContact O-N 3.42Å; S192-V195 WeakPolarHBondContact O-CG2 3.48Å; S192-V195 PolarHBondContact O-N 3.45Å; S192-R196 PolarHBondContact O-N 3.04Å | ||
| 193 | I | 57.4 | Low | 58.5 | Low | 132 Ų | 132 | 46.3 Ų | 46.3 | 68% | 0.677 | 26% | 0.26 | S | S | * | . | H | α-helix | trans | -51.8 | -30.1 | -172.7 | -132.5 | 157.4 | 0 | 0 | 0 | 113.3 | ||
| 194 | G | 62.5 | Low | 59.7 | Low | 56 Ų | 56 | 48.7 Ų | 48.7 | 58% | 0.577 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -69.8 | -29.5 | 178 | 0 | 0 | 0 | 0 | 0 | 114.6 | S192 P198 | S192-G194 PolarHBondContact O-N 3.42Å; G194-P198 WeakPolarHBondContact O-CD 3.35Å; G194-P198 WeakPolarHBondContact O-CG 3.44Å |
| 195 | V | 61.9 | Low | 61.2 | Low | 52 Ų | 52 | 52.9 Ų | 52.9 | 32% | 0.315 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -93.9 | -19.5 | -179.6 | -64.1 | 0 | 0 | 0 | 0 | 113.3 | S192 P198 V199 | S192-V195 WeakPolarHBondContact O-CG2 3.48Å; S192-V195 PolarHBondContact O-N 3.45Å; V195-P198 WeakPolarHBondContact O-CD 3.36Å; V195-P198 WeakPolarHBondContact O-CG 3.33Å; V195-V199 WeakPolarHBondContact O-CB 3.35Å; V195-V199 WeakPolarHBondContact O-CG2 3.5Å; V195-V199 PolarHBondContact O-N 3.46Å |
| 196 | R | 64.7 | Low | 62.5 | Low | 50 Ų | 50 | 53 Ų | 53 | 19% | 0.189 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -61.3 | -48.7 | -178.8 | -62.3 | -174.5 | -178.1 | -170.1 | -9.6 | 112.8 | M145 L189 K190 Y191 S192 L200 | M145-R196 HydrophobicContact CE-CB 4.43Å; L189-R196 WeakPolarHBondContact O-CD 3.26Å; L189-R196 WeakPolarHBondContact O-CG 3.2Å; L189-R196 VanDerWaalsContact O-CZ 3.3Å; L189-R196 PolarHBondContact O-NE 3.06Å; K190-R196 PolarHBondContact O-NH2 3.19Å; Y191-R196 WeakPolarHBondContact O-CD 3.29Å; Y191-R196 WeakPolarHBondContact O-CG 3.42Å; Y191-R196 PolarHBondContact O-NE 3.02Å; S192-R196 PolarHBondContact O-N 3.04Å; R196-L200 WeakPolarHBondContact O-CB 3.47Å; R196-L200 PolarHBondContact O-N 2.97Å |
| 197 | Y | 64.9 | Low | 63.5 | Low | 81 Ų | 81 | 53.6 Ų | 53.6 | 32% | 0.318 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -63.1 | -52.7 | -178.1 | -102 | -86.1 | 0 | 0 | 0 | 113.5 | M22 V199 L200 V201 | M22-Y197 HydrophobicContact CE-CE1 4.19Å; M22-Y197 HydrophobicContact SD-CE1 3.64Å; M22-Y197 HydrophobicContact SD-CE2 4.48Å; M22-Y197 VanDerWaalsContact SD-CZ 3.54Å; M22-Y197 PolarHBondContact SD-OH 3.16Å; Y197-V199 VanDerWaalsContact C-N 3.31Å; Y197-V199 PolarHBondContact O-N 3Å; Y197-L200 PolarHBondContact O-N 2.93Å; Y197-V201 VanDerWaalsContact O-CG2 3.32Å; Y197-V201 WeakPolarHBondContact O-CG2 3.35Å; Y197-V201 PolarHBondContact O-N 3.17Å |
| 198 | P | 69.2 | Low | 64.8 | Low | 63 Ų | 63 | 57.1 Ų | 57.1 | 41% | 0.409 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -63 | -38.5 | -179.4 | 22.7 | -32.8 | 0 | 0 | 0 | 112.1 | G194 V195 V201 I202 | G194-P198 WeakPolarHBondContact O-CD 3.35Å; G194-P198 WeakPolarHBondContact O-CG 3.44Å; V195-P198 WeakPolarHBondContact O-CD 3.36Å; V195-P198 WeakPolarHBondContact O-CG 3.33Å; P198-V201 PolarHBondContact O-N 3.46Å; P198-I202 WeakPolarHBondContact O-CB 3.08Å; P198-I202 WeakPolarHBondContact O-CD1 3.47Å; P198-I202 VanDerWaalsContact O-CG1 3.22Å; P198-I202 WeakPolarHBondContact O-CG1 3.38Å; P198-I202 PolarHBondContact O-N 3.05Å |
| 199 | V | 70.4 | Confident | 66.1 | Low | 34 Ų | 34 | 59.8 Ų | 59.8 | 21% | 0.206 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -62.9 | -46.4 | 176.6 | 173.4 | 0 | 0 | 0 | 0 | 111 | E188 V195 Y197 V201 I202 N203 | E188-V199 HydrophobicContact CB-CG1 4.29Å; E188-V199 VanDerWaalsContact CD-CG1 3.49Å; E188-V199 HydrophobicContact CG-CG1 3.75Å; V195-V199 WeakPolarHBondContact O-CB 3.35Å; V195-V199 WeakPolarHBondContact O-CG2 3.5Å; V195-V199 PolarHBondContact O-N 3.46Å; Y197-V199 VanDerWaalsContact C-N 3.31Å; Y197-V199 PolarHBondContact O-N 3Å; V199-V201 VanDerWaalsContact C-N 3.34Å; V199-V201 PolarHBondContact O-N 3.24Å; V199-I202 PolarHBondContact O-N 3.23Å; V199-N203 WeakPolarHBondContact O-CB 3.39Å; V199-N203 PolarHBondContact O-N 2.89Å; V199-N203 PolarHBondContact O-ND2 3.05Å; V199-N203 PolarHBondContact O-OD1 3.45Å |
| 200 | L | 67.7 | Low | 67.4 | Low | 51 Ų | 51 | 60.4 Ų | 60.4 | 27% | 0.267 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -61.1 | -41.8 | 177.3 | -176 | 68.1 | 0 | 0 | 0 | 112.3 | L189 R196 Y197 N203 M204 | L189-L200 HydrophobicContact CD1-CD1 4.38Å; L189-L200 HydrophobicContact CD2-CB 4.44Å; L189-L200 HydrophobicContact CD2-CD1 4.22Å; R196-L200 WeakPolarHBondContact O-CB 3.47Å; R196-L200 PolarHBondContact O-N 2.97Å; Y197-L200 PolarHBondContact O-N 2.93Å; L200-N203 PolarHBondContact O-N 3.16Å; L200-M204 WeakPolarHBondContact O-CG 3.22Å; L200-M204 PolarHBondContact O-N 3.46Å |
| 201 | V | 72.5 | Confident | 68.5 | Low | 75 Ų | 75 | 59 Ų | 59 | 46% | 0.455 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -66.2 | -44 | 178.1 | 172.3 | 0 | 0 | 0 | 0 | 111.1 | Y197 P198 V199 N203 M204 I205 | Y197-V201 VanDerWaalsContact O-CG2 3.32Å; Y197-V201 WeakPolarHBondContact O-CG2 3.35Å; Y197-V201 PolarHBondContact O-N 3.17Å; P198-V201 PolarHBondContact O-N 3.46Å; V199-V201 VanDerWaalsContact C-N 3.34Å; V199-V201 PolarHBondContact O-N 3.24Å; V201-N203 VanDerWaalsContact C-N 3.32Å; V201-N203 PolarHBondContact O-N 2.98Å; V201-M204 WeakPolarHBondContact O-CB 3.48Å; V201-M204 PolarHBondContact O-N 3.35Å; V201-I205 HydrophobicContact CG1-CD1 3.9Å; V201-I205 WeakPolarHBondContact O-CG1 3.46Å; V201-I205 PolarHBondContact O-N 3.31Å |
| 202 | I | 74 | Confident | 69.9 | Low | 90 Ų | 90 | 62.8 Ų | 62.8 | 46% | 0.462 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -60.1 | -44 | 176 | -70.8 | 165.5 | 0 | 0 | 0 | 110.5 | P198 V199 M204 I205 I206 | P198-I202 WeakPolarHBondContact O-CB 3.08Å; P198-I202 WeakPolarHBondContact O-CD1 3.47Å; P198-I202 VanDerWaalsContact O-CG1 3.22Å; P198-I202 WeakPolarHBondContact O-CG1 3.38Å; P198-I202 PolarHBondContact O-N 3.05Å; V199-I202 PolarHBondContact O-N 3.23Å; I202-M204 PolarHBondContact O-N 3.4Å; I202-I205 PolarHBondContact O-N 3.27Å; I202-I206 HydrophobicContact CG2-CD1 3.69Å; I202-I206 HydrophobicContact CG2-CG1 4.44Å; I202-I206 WeakPolarHBondContact O-CG1 3.45Å; I202-I206 PolarHBondContact O-N 3.5Å |
| 203 | N | 71.8 | Confident | 71.1 | Confident | 9 Ų | 9 | 58.8 Ų | 58.8 | 5% | 0.048 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -61.7 | -42.9 | 176.6 | -68.9 | -15.5 | 0 | 0 | 0 | 112.4 | E188 V199 L200 V201 I205 I206 Y207 R242 | E188-N203 PolarHBondContact OE1-ND2 3.19Å; V199-N203 WeakPolarHBondContact O-CB 3.39Å; V199-N203 PolarHBondContact O-N 2.89Å; V199-N203 PolarHBondContact O-ND2 3.05Å; V199-N203 PolarHBondContact O-OD1 3.45Å; L200-N203 PolarHBondContact O-N 3.16Å; V201-N203 VanDerWaalsContact C-N 3.32Å; V201-N203 PolarHBondContact O-N 2.98Å; N203-I205 VanDerWaalsContact C-N 3.33Å; N203-I205 PolarHBondContact O-N 3.43Å; N203-I206 PolarHBondContact O-N 3.09Å; N203-Y207 VanDerWaalsContact O-CB 3.24Å; N203-Y207 WeakPolarHBondContact O-CB 3.33Å; N203-Y207 PolarHBondContact O-N 3.17Å; N203-R242 WeakPolarHBondContact OD1-CD 3.47Å; N203-R242 PolarHBondContact OD1-NH1 3.01Å |
| 204 | M | 71.9 | Confident | 72 | Confident | 59 Ų | 59 | 53.7 Ų | 53.7 | 29% | 0.291 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -59.9 | -42.9 | 174.8 | -84.1 | -76.6 | -121.5 | 0 | 0 | 111.9 | F11 L200 V201 I202 Y207 L208 | F11-M204 HydrophobicContact CE1-CE 3.7Å; F11-M204 HydrophobicContact CE1-SD 4.21Å; F11-M204 HydrophobicContact CE2-CE 4.02Å; F11-M204 HydrophobicContact CE2-SD 4.35Å; F11-M204 HydrophobicContact CZ-CE 3.25Å; F11-M204 HydrophobicContact CZ-SD 3.47Å; F11-M204 WeakPolarHBondContact CZ-SD 3.47Å; L200-M204 WeakPolarHBondContact O-CG 3.22Å; L200-M204 PolarHBondContact O-N 3.46Å; V201-M204 WeakPolarHBondContact O-CB 3.48Å; V201-M204 PolarHBondContact O-N 3.35Å; I202-M204 PolarHBondContact O-N 3.4Å; M204-Y207 PolarHBondContact O-N 2.94Å; M204-L208 WeakPolarHBondContact O-CG 3.44Å; M204-L208 PolarHBondContact O-N 2.88Å |
| 205 | I | 78.3 | Confident | 72.7 | Confident | 91 Ų | 91 | 55 Ų | 55 | 47% | 0.467 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -66 | -47.9 | 179.2 | -67.8 | 166.6 | 0 | 0 | 0 | 110.9 | V201 I202 N203 Y207 L208 I209 | V201-I205 HydrophobicContact CG1-CD1 3.9Å; V201-I205 WeakPolarHBondContact O-CG1 3.46Å; V201-I205 PolarHBondContact O-N 3.31Å; I202-I205 PolarHBondContact O-N 3.27Å; N203-I205 VanDerWaalsContact C-N 3.33Å; N203-I205 PolarHBondContact O-N 3.43Å; I205-Y207 VanDerWaalsContact C-N 3.26Å; I205-Y207 PolarHBondContact O-N 3.26Å; I205-L208 PolarHBondContact O-N 2.8Å; I205-I209 HydrophobicContact CG2-CD1 4.09Å; I205-I209 WeakPolarHBondContact O-CG1 3.46Å; I205-I209 PolarHBondContact O-N 3.33Å; I205-I209 VanDerWaalsContact O-N 3.08Å |
| 206 | I | 74.6 | Confident | 73.3 | Confident | 30 Ų | 30 | 55.2 Ų | 55.2 | 15% | 0.154 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -61 | -39.9 | 178.4 | -68.9 | 170.4 | 0 | 0 | 0 | 110.3 | I202 N203 L208 I209 I210 R242 | I202-I206 HydrophobicContact CG2-CD1 3.69Å; I202-I206 HydrophobicContact CG2-CG1 4.44Å; I202-I206 WeakPolarHBondContact O-CG1 3.45Å; I202-I206 PolarHBondContact O-N 3.5Å; N203-I206 PolarHBondContact O-N 3.09Å; I206-L208 PolarHBondContact O-N 3.47Å; I206-I209 WeakPolarHBondContact O-CB 3.4Å; I206-I209 PolarHBondContact O-N 2.87Å; I206-I210 HydrophobicContact CG2-CD1 3.99Å; I206-I210 WeakPolarHBondContact O-CG1 3.31Å; I206-I210 PolarHBondContact O-N 3.39Å; I206-R242 HydrophobicContact CD1-CB 4.27Å; I206-R242 VanDerWaalsContact CD1-CD 3.4Å; I206-R242 HydrophobicContact CD1-CG 3.93Å |
| 207 | Y | 72 | Confident | 73.8 | Confident | 29 Ų | 29 | 53.6 Ų | 53.6 | 11% | 0.114 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -61.1 | -44.1 | 175.6 | 178.9 | -118.7 | 0 | 0 | 0 | 113.1 | Y134 I135 L138 N203 M204 I205 I209 I210 I211 | Y134-Y207 AromaticContact CD1-CD2 3.93Å; Y134-Y207 HydrophobicContact CD1-CD2 3.93Å; Y134-Y207 AromaticContact CD1-CE2 3.43Å; Y134-Y207 HydrophobicContact CD1-CE2 3.43Å; Y134-Y207 VanDerWaalsContact CD1-CE2 3.43Å; Y134-Y207 AromaticContact CE1-CD2 3.17Å; Y134-Y207 HydrophobicContact CE1-CD2 3.17Å; Y134-Y207 AromaticContact CE1-CE2 3.19Å; Y134-Y207 HydrophobicContact CE1-CE2 3.19Å; Y134-Y207 HydrophobicContact CE1-CG 4.19Å; Y134-Y207 AromaticContact CZ-CD2 3.94Å; I135-Y207 WeakPolarHBondContact CG1-OH 3.19Å; L138-Y207 HydrophobicContact CD2-CD1 3.92Å; L138-Y207 HydrophobicContact CD2-CE1 4.16Å; L138-Y207 HydrophobicContact CD2-CG 4.19Å; N203-Y207 VanDerWaalsContact O-CB 3.24Å; N203-Y207 WeakPolarHBondContact O-CB 3.33Å; N203-Y207 PolarHBondContact O-N 3.17Å; M204-Y207 PolarHBondContact O-N 2.94Å; I205-Y207 VanDerWaalsContact C-N 3.26Å; I205-Y207 PolarHBondContact O-N 3.26Å; Y207-I209 VanDerWaalsContact C-N 3.29Å; Y207-I209 PolarHBondContact O-N 3.44Å; Y207-I210 PolarHBondContact O-N 2.83Å; Y207-I211 HydrophobicContact CD1-CD1 3.76Å; Y207-I211 HydrophobicContact CD2-CD1 4.45Å; Y207-I211 HydrophobicContact CD2-CG1 4.46Å; Y207-I211 HydrophobicContact CE1-CD1 3.24Å; Y207-I211 HydrophobicContact CE1-CG1 4.15Å; Y207-I211 HydrophobicContact CE2-CD1 4.01Å; Y207-I211 HydrophobicContact CE2-CG1 4Å; Y207-I211 HydrophobicContact CG-CD1 4.35Å; Y207-I211 WeakPolarHBondContact O-CG1 3.39Å; Y207-I211 PolarHBondContact O-N 3.22Å |
| 208 | L | 76.3 | Confident | 74.3 | Confident | 76 Ų | 76 | 55.2 Ų | 55.2 | 40% | 0.398 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -60.4 | -39.9 | 174.8 | -71.7 | 172.5 | 0 | 0 | 0 | 111.8 | M204 I205 I206 I210 I211 I212 | M204-L208 WeakPolarHBondContact O-CG 3.44Å; M204-L208 PolarHBondContact O-N 2.88Å; I205-L208 PolarHBondContact O-N 2.8Å; I206-L208 PolarHBondContact O-N 3.47Å; L208-I210 VanDerWaalsContact C-N 3.34Å; L208-I211 PolarHBondContact O-N 2.81Å; L208-I212 VanDerWaalsContact O-CG1 3.29Å; L208-I212 WeakPolarHBondContact O-CG1 3.12Å; L208-I212 PolarHBondContact O-N 2.73Å |
| 209 | I | 77.6 | Confident | 74.6 | Confident | 68 Ų | 68 | 58.1 Ų | 58.1 | 35% | 0.349 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -63 | -41.4 | 176.1 | -66.5 | 167.3 | 0 | 0 | 0 | 110.8 | I205 I206 Y207 I212 S213 S235 | I205-I209 HydrophobicContact CG2-CD1 4.09Å; I205-I209 WeakPolarHBondContact O-CG1 3.46Å; I205-I209 PolarHBondContact O-N 3.33Å; I205-I209 VanDerWaalsContact O-N 3.08Å; I206-I209 WeakPolarHBondContact O-CB 3.4Å; I206-I209 PolarHBondContact O-N 2.87Å; Y207-I209 VanDerWaalsContact C-N 3.29Å; Y207-I209 PolarHBondContact O-N 3.44Å; I209-I212 PolarHBondContact O-N 3.31Å; I209-S213 VanDerWaalsContact O-CB 3.26Å; I209-S213 WeakPolarHBondContact O-CB 3.4Å; I209-S213 PolarHBondContact O-N 2.74Å; I209-S213 PolarHBondContact O-OG 3.37Å; I209-S235 WeakPolarHBondContact CG2-OG 3.25Å |
| 210 | I | 76.4 | Confident | 74.8 | Confident | 31 Ų | 31 | 56.6 Ų | 56.6 | 16% | 0.159 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -65.3 | -42.7 | 176.8 | -67 | 166.1 | 0 | 0 | 0 | 111.2 | I206 Y207 L208 S213 S214 D239 | I206-I210 HydrophobicContact CG2-CD1 3.99Å; I206-I210 WeakPolarHBondContact O-CG1 3.31Å; I206-I210 PolarHBondContact O-N 3.39Å; Y207-I210 PolarHBondContact O-N 2.83Å; L208-I210 VanDerWaalsContact C-N 3.34Å; I210-S213 PolarHBondContact O-N 3.41Å; I210-S214 WeakPolarHBondContact O-CB 3.04Å; I210-S214 PolarHBondContact O-N 3.31Å; I210-S214 PolarHBondContact O-OG 2.93Å; I210-D239 HydrophobicContact CD1-CB 4.03Å |
| 211 | I | 75 | Confident | 75 | Confident | 45 Ų | 45 | 58.7 Ų | 58.7 | 23% | 0.231 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -59.5 | -51.6 | 175.8 | -68.4 | 163.8 | 0 | 0 | 0 | 110.4 | Y207 L208 S213 S214 V215 | Y207-I211 HydrophobicContact CD1-CD1 3.76Å; Y207-I211 HydrophobicContact CD2-CD1 4.45Å; Y207-I211 HydrophobicContact CD2-CG1 4.46Å; Y207-I211 HydrophobicContact CE1-CD1 3.24Å; Y207-I211 HydrophobicContact CE1-CG1 4.15Å; Y207-I211 HydrophobicContact CE2-CD1 4.01Å; Y207-I211 HydrophobicContact CE2-CG1 4Å; Y207-I211 HydrophobicContact CG-CD1 4.35Å; Y207-I211 WeakPolarHBondContact O-CG1 3.39Å; Y207-I211 PolarHBondContact O-N 3.22Å; L208-I211 PolarHBondContact O-N 2.81Å; I211-S213 VanDerWaalsContact C-N 3.29Å; I211-S213 PolarHBondContact O-N 2.71Å; I211-S214 WeakPolarHBondContact O-CB 3.42Å; I211-S214 PolarHBondContact O-N 3.01Å; I211-S214 VanDerWaalsContact O-N 3.1Å; I211-V215 PolarHBondContact O-N 3.39Å |
| 212 | I | 78.7 | Confident | 75.2 | Confident | 105 Ų | 105 | 59.8 Ų | 59.8 | 54% | 0.538 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -58.7 | -45.9 | -179.7 | -68 | 166.3 | 0 | 0 | 0 | 109.7 | L208 I209 S214 V215 L216 | L208-I212 VanDerWaalsContact O-CG1 3.29Å; L208-I212 WeakPolarHBondContact O-CG1 3.12Å; L208-I212 PolarHBondContact O-N 2.73Å; I209-I212 PolarHBondContact O-N 3.31Å; I212-S214 VanDerWaalsContact C-N 3.29Å; I212-S214 PolarHBondContact O-N 2.87Å; I212-V215 PolarHBondContact O-N 2.7Å; I212-L216 HydrophobicContact CG2-CD1 3.82Å; I212-L216 WeakPolarHBondContact O-CD1 3.3Å; I212-L216 PolarHBondContact O-N 2.85Å |
| 213 | S | 75.5 | Confident | 75.7 | Confident | 8 Ų | 8 | 60.3 Ų | 60.3 | 6% | 0.056 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -65.4 | -30.4 | 178.3 | -61.8 | 0 | 0 | 0 | 0 | 113.3 | I209 I210 I211 L216 L217 S235 | I209-S213 VanDerWaalsContact O-CB 3.26Å; I209-S213 WeakPolarHBondContact O-CB 3.4Å; I209-S213 PolarHBondContact O-N 2.74Å; I209-S213 PolarHBondContact O-OG 3.37Å; I210-S213 PolarHBondContact O-N 3.41Å; I211-S213 VanDerWaalsContact C-N 3.29Å; I211-S213 PolarHBondContact O-N 2.71Å; S213-L216 PolarHBondContact O-N 3.42Å; S213-L217 WeakPolarHBondContact O-CB 3.42Å; S213-L217 PolarHBondContact O-N 3.32Å; S213-S235 PolarHBondContact OG-OG 3.03Å |
| 214 | S | 76.2 | Confident | 76.1 | Confident | 25 Ų | 25 | 69 Ų | 69 | 18% | 0.175 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -70.7 | -38.4 | 175.1 | -57.7 | 0 | 0 | 0 | 0 | 111.8 | I210 I211 I212 L216 L217 L218 | I210-S214 WeakPolarHBondContact O-CB 3.04Å; I210-S214 PolarHBondContact O-N 3.31Å; I210-S214 PolarHBondContact O-OG 2.93Å; I211-S214 WeakPolarHBondContact O-CB 3.42Å; I211-S214 PolarHBondContact O-N 3.01Å; I211-S214 VanDerWaalsContact O-N 3.1Å; I212-S214 VanDerWaalsContact C-N 3.29Å; I212-S214 PolarHBondContact O-N 2.87Å; S214-L216 VanDerWaalsContact C-N 3.35Å; S214-L217 WeakPolarHBondContact O-CB 3.14Å; S214-L217 PolarHBondContact O-N 2.65Å; S214-L218 PolarHBondContact O-N 2.95Å |
| 215 | V | 77 | Confident | 76.5 | Confident | 82 Ų | 82 | 68.2 Ų | 68.2 | 50% | 0.497 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -65.4 | -40.6 | 172.4 | 176.5 | 0 | 0 | 0 | 0 | 110.7 | I211 I212 L217 L218 F219 | I211-V215 PolarHBondContact O-N 3.39Å; I212-V215 PolarHBondContact O-N 2.7Å; V215-L217 VanDerWaalsContact C-N 3.34Å; V215-L218 PolarHBondContact O-N 3.41Å; V215-F219 PolarHBondContact O-N 2.9Å; V215-F219 VanDerWaalsContact O-N 3.17Å |
| 216 | L | 74.7 | Confident | 76.4 | Confident | 58 Ų | 58 | 68 Ų | 68 | 30% | 0.304 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -62.5 | -40.4 | 172.9 | -92.1 | 82.5 | 0 | 0 | 0 | 111.9 | I212 S213 S214 L218 F219 A220 L228 P231 | I212-L216 HydrophobicContact CG2-CD1 3.82Å; I212-L216 WeakPolarHBondContact O-CD1 3.3Å; I212-L216 PolarHBondContact O-N 2.85Å; S213-L216 PolarHBondContact O-N 3.42Å; S214-L216 VanDerWaalsContact C-N 3.35Å; L216-L218 VanDerWaalsContact C-N 3.33Å; L216-L218 PolarHBondContact O-N 3.43Å; L216-F219 PolarHBondContact O-N 3.46Å; L216-A220 WeakPolarHBondContact O-CB 3.33Å; L216-A220 PolarHBondContact O-N 2.89Å; L216-L228 HydrophobicContact CB-CG 4.5Å; L216-L228 HydrophobicContact CD2-CD1 4.14Å; L216-L228 HydrophobicContact CD2-CG 4.4Å; L216-L228 WeakPolarHBondContact O-CD2 3.48Å; L216-P231 HydrophobicContact CD2-CB 4.46Å; L216-P231 HydrophobicContact CD2-CG 4.2Å |
| 217 | L | 75.4 | Confident | 76.7 | Confident | 16 Ų | 16 | 76 Ų | 76 | 8% | 0.084 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -60.5 | -43 | 176 | -174.5 | 76.5 | 0 | 0 | 0 | 111.4 | S213 S214 V215 F219 A220 L221 M229 W232 F278 | S213-L217 WeakPolarHBondContact O-CB 3.42Å; S213-L217 PolarHBondContact O-N 3.32Å; S214-L217 WeakPolarHBondContact O-CB 3.14Å; S214-L217 PolarHBondContact O-N 2.65Å; V215-L217 VanDerWaalsContact C-N 3.34Å; L217-F219 VanDerWaalsContact C-N 3.29Å; L217-F219 PolarHBondContact O-N 3.33Å; L217-A220 WeakPolarHBondContact O-CA 3.12Å; L217-A220 VanDerWaalsContact O-CB 3.25Å; L217-A220 WeakPolarHBondContact O-CB 3.46Å; L217-A220 PolarHBondContact O-N 3.37Å; L217-A220 VanDerWaalsContact O-N 3.08Å; L217-L221 HydrophobicContact CG-CD1 4.48Å; L217-L221 WeakPolarHBondContact O-CG 3.15Å; L217-L221 PolarHBondContact O-N 2.94Å; L217-M229 HydrophobicContact CD1-CB 4.24Å; L217-M229 HydrophobicContact CD1-CG 3.94Å; L217-M229 HydrophobicContact CD1-SD 4.3Å; L217-W232 HydrophobicContact CB-CB 4.25Å; L217-W232 HydrophobicContact CB-CG 4.1Å; L217-W232 HydrophobicContact CD1-CB 4.06Å; L217-W232 HydrophobicContact CD1-CD2 4.28Å; L217-W232 HydrophobicContact CD1-CG 4.01Å; L217-W232 HydrophobicContact CD2-CD2 4.05Å; L217-W232 HydrophobicContact CD2-CG 4.01Å; L217-W232 HydrophobicContact CG-CG 4.26Å; L217-F278 HydrophobicContact CD1-CZ 4.17Å; L217-F278 HydrophobicContact CD2-CE2 4.16Å; L217-F278 HydrophobicContact CD2-CZ 3.99Å |
| 218 | L | 74.5 | Confident | 77 | Confident | 115 Ų | 115 | 77 Ų | 77 | 60% | 0.602 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -59.3 | -43.7 | 176.8 | -171 | 67.4 | 0 | 0 | 0 | 111.1 | S214 V215 L216 A220 L221 C222 | S214-L218 PolarHBondContact O-N 2.95Å; V215-L218 PolarHBondContact O-N 3.41Å; L216-L218 VanDerWaalsContact C-N 3.33Å; L216-L218 PolarHBondContact O-N 3.43Å; L218-A220 VanDerWaalsContact C-N 3.33Å; L218-A220 PolarHBondContact O-N 2.9Å; L218-L221 PolarHBondContact O-N 3.43Å; L218-C222 PolarHBondContact O-N 2.79Å; L218-C222 VanDerWaalsContact O-N 3.1Å; L218-C222 PolarHBondContact O-SG 3.08Å |
| 219 | F | 75.3 | Confident | 76.9 | Confident | 123 Ų | 123 | 75 Ų | 75 | 54% | 0.539 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -66.1 | -35.2 | 174.9 | -163.3 | -113.8 | 0 | 0 | 0 | 112.4 | V215 L216 L217 L221 C222 L223 L228 | V215-F219 PolarHBondContact O-N 2.9Å; V215-F219 VanDerWaalsContact O-N 3.17Å; L216-F219 PolarHBondContact O-N 3.46Å; L217-F219 VanDerWaalsContact C-N 3.29Å; L217-F219 PolarHBondContact O-N 3.33Å; F219-L221 PolarHBondContact O-N 2.94Å; F219-C222 PolarHBondContact O-N 3.15Å; F219-L223 HydrophobicContact CD1-CD1 3.64Å; F219-L223 HydrophobicContact CD1-CG 4.24Å; F219-L223 HydrophobicContact CE1-CD1 3.14Å; F219-L223 HydrophobicContact CE1-CG 3.99Å; F219-L223 HydrophobicContact CE2-CD1 4.34Å; F219-L223 HydrophobicContact CE2-CG 4.42Å; F219-L223 HydrophobicContact CG-CD1 4.43Å; F219-L223 HydrophobicContact CZ-CD1 3.54Å; F219-L223 HydrophobicContact CZ-CD2 4.41Å; F219-L223 HydrophobicContact CZ-CG 4.07Å; F219-L223 WeakPolarHBondContact O-CB 2.96Å; F219-L223 WeakPolarHBondContact O-CG 3.24Å; F219-L223 PolarHBondContact O-N 3.36Å; F219-L228 HydrophobicContact CB-CD2 4.07Å; F219-L228 HydrophobicContact CD1-CD2 3.62Å; F219-L228 HydrophobicContact CG-CD2 4.32Å |
| 220 | A | 74.5 | Confident | 77 | Confident | 2 Ų | 2 | 75.6 Ų | 75.6 | 2% | 0.017 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -61.1 | -44.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | L216 L217 L218 L223 K224 S225 L228 M229 | L216-A220 WeakPolarHBondContact O-CB 3.33Å; L216-A220 PolarHBondContact O-N 2.89Å; L217-A220 WeakPolarHBondContact O-CA 3.12Å; L217-A220 VanDerWaalsContact O-CB 3.25Å; L217-A220 WeakPolarHBondContact O-CB 3.46Å; L217-A220 PolarHBondContact O-N 3.37Å; L217-A220 VanDerWaalsContact O-N 3.08Å; L218-A220 VanDerWaalsContact C-N 3.33Å; L218-A220 PolarHBondContact O-N 2.9Å; A220-L223 PolarHBondContact O-N 3.46Å; A220-K224 WeakPolarHBondContact O-CA 3.11Å; A220-K224 PolarHBondContact O-N 2.85Å; A220-S225 PolarHBondContact O-N 2.99Å; A220-S225 VanDerWaalsContact O-N 3.14Å; A220-L228 HydrophobicContact CB-CB 3.6Å; A220-L228 HydrophobicContact CB-CD2 4.04Å; A220-L228 HydrophobicContact CB-CG 4.17Å; A220-M229 HydrophobicContact CB-CG 4.03Å |
| 221 | L | 72.2 | Confident | 77 | Confident | 96 Ų | 96 | 76.3 Ų | 76.3 | 50% | 0.503 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -65.1 | -43.3 | 177.3 | -68.6 | 171.9 | 0 | 0 | 0 | 111.4 | L217 L218 F219 L223 K224 | L217-L221 HydrophobicContact CG-CD1 4.48Å; L217-L221 WeakPolarHBondContact O-CG 3.15Å; L217-L221 PolarHBondContact O-N 2.94Å; L218-L221 PolarHBondContact O-N 3.43Å; F219-L221 PolarHBondContact O-N 2.94Å; L221-L223 VanDerWaalsContact C-N 3.33Å; L221-L223 PolarHBondContact O-N 3.45Å; L221-K224 PolarHBondContact O-N 3.38Å |
| 222 | C | 78.2 | Confident | 77.2 | Confident | 98 Ų | 98 | 75.3 Ų | 75.3 | 66% | 0.662 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -62.3 | -39.3 | 175.7 | -67.7 | 0 | 0 | 0 | 0 | 112.7 | L218 F219 | L218-C222 PolarHBondContact O-N 2.79Å; L218-C222 VanDerWaalsContact O-N 3.1Å; L218-C222 PolarHBondContact O-SG 3.08Å; F219-C222 PolarHBondContact O-N 3.15Å |
| 223 | L | 82.9 | Confident | 77 | Confident | 101 Ų | 101 | 74.3 Ų | 74.3 | 53% | 0.529 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -87.5 | -4.2 | -179.5 | -67.1 | -172.4 | 0 | 0 | 0 | 114.3 | F219 A220 L221 S225 | F219-L223 HydrophobicContact CD1-CD1 3.64Å; F219-L223 HydrophobicContact CD1-CG 4.24Å; F219-L223 HydrophobicContact CE1-CD1 3.14Å; F219-L223 HydrophobicContact CE1-CG 3.99Å; F219-L223 HydrophobicContact CE2-CD1 4.34Å; F219-L223 HydrophobicContact CE2-CG 4.42Å; F219-L223 HydrophobicContact CG-CD1 4.43Å; F219-L223 HydrophobicContact CZ-CD1 3.54Å; F219-L223 HydrophobicContact CZ-CD2 4.41Å; F219-L223 HydrophobicContact CZ-CG 4.07Å; F219-L223 WeakPolarHBondContact O-CB 2.96Å; F219-L223 WeakPolarHBondContact O-CG 3.24Å; F219-L223 PolarHBondContact O-N 3.36Å; A220-L223 PolarHBondContact O-N 3.46Å; L221-L223 VanDerWaalsContact C-N 3.33Å; L221-L223 PolarHBondContact O-N 3.45Å; L223-S225 PolarHBondContact O-N 3.3Å; L223-S225 VanDerWaalsContact O-N 3.1Å |
| 224 | K | 81.1 | Confident | 77.1 | Confident | 192 Ų | 192 | 77 Ų | 77 | 84% | 0.835 | 40% | 0.402 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49 | 32.4 | -170.8 | -62.1 | -176.8 | 175.8 | 179.3 | 0 | 113.1 | A220 L221 | A220-K224 WeakPolarHBondContact O-CA 3.11Å; A220-K224 PolarHBondContact O-N 2.85Å; L221-K224 PolarHBondContact O-N 3.38Å |
| 225 | S | 80.1 | Confident | 77 | Confident | 42 Ų | 42 | 76.2 Ų | 76.2 | 29% | 0.294 | 40% | 0.396 | S | S | . | . | trans | -97.4 | 114.6 | -178.3 | -178.9 | 0 | 0 | 0 | 0 | 110.2 | A220 L223 W227 L228 | A220-S225 PolarHBondContact O-N 2.99Å; A220-S225 VanDerWaalsContact O-N 3.14Å; L223-S225 PolarHBondContact O-N 3.3Å; L223-S225 VanDerWaalsContact O-N 3.1Å; S225-W227 VanDerWaalsContact C-N 3.27Å; S225-W227 PolarHBondContact O-N 3.07Å; S225-L228 PolarHBondContact O-N 2.91Å | ||
| 226 | P | 75.5 | Confident | 76.8 | Confident | 85 Ų | 85 | 73.3 Ų | 73.3 | 55% | 0.552 | 38% | 0.379 | S | S | * | . | G | 310 helix | trans | -67.8 | -28.4 | -177.8 | 26.9 | -34.1 | 0 | 0 | 0 | 112.6 | L228 M229 | P226-L228 PolarHBondContact O-N 3.21Å; P226-M229 WeakPolarHBondContact O-CB 3.36Å; P226-M229 PolarHBondContact O-N 3.11Å; P226-M229 VanDerWaalsContact O-N 3.16Å |
| 227 | W | 82.7 | Confident | 76.7 | Confident | 200 Ų | 200 | 75.9 Ų | 75.9 | 76% | 0.758 | 39% | 0.392 | S | S | * | . | G | 310 helix | trans | -61.7 | -31.1 | -178.2 | -71.2 | 99.7 | 0 | 0 | 0 | 113.2 | S225 M229 I230 | S225-W227 VanDerWaalsContact C-N 3.27Å; S225-W227 PolarHBondContact O-N 3.07Å; W227-M229 VanDerWaalsContact C-N 3.26Å; W227-M229 PolarHBondContact O-N 3.02Å; W227-I230 HydrophobicContact CE3-CD1 3.7Å; W227-I230 HydrophobicContact CZ3-CD1 4.16Å; W227-I230 WeakPolarHBondContact O-CG1 3.2Å; W227-I230 PolarHBondContact O-N 3.26Å |
| 228 | L | 77.8 | Confident | 76.6 | Confident | 50 Ų | 50 | 79.9 Ų | 79.9 | 26% | 0.262 | 41% | 0.413 | S | S | . | . | G | 310 helix | trans | -83.9 | -3.7 | -176.6 | -153.2 | 78 | 0 | 0 | 0 | 112.8 | L216 F219 A220 S225 P226 P231 | L216-L228 HydrophobicContact CB-CG 4.5Å; L216-L228 HydrophobicContact CD2-CD1 4.14Å; L216-L228 HydrophobicContact CD2-CG 4.4Å; L216-L228 WeakPolarHBondContact O-CD2 3.48Å; F219-L228 HydrophobicContact CB-CD2 4.07Å; F219-L228 HydrophobicContact CD1-CD2 3.62Å; F219-L228 HydrophobicContact CG-CD2 4.32Å; A220-L228 HydrophobicContact CB-CB 3.6Å; A220-L228 HydrophobicContact CB-CD2 4.04Å; A220-L228 HydrophobicContact CB-CG 4.17Å; S225-L228 PolarHBondContact O-N 2.91Å; P226-L228 PolarHBondContact O-N 3.21Å; L228-P231 WeakPolarHBondContact O-CD 3.45Å |
| 229 | M | 74 | Confident | 76.5 | Confident | 34 Ų | 34 | 75.3 Ų | 75.3 | 17% | 0.167 | 39% | 0.389 | C | S | . | . | G | 310 helix | trans | -81.8 | -19.9 | 170.1 | -59.2 | -158.8 | -62.7 | 0 | 0 | 112.9 | L217 A220 P226 W227 W232 I233 L282 | L217-M229 HydrophobicContact CD1-CB 4.24Å; L217-M229 HydrophobicContact CD1-CG 3.94Å; L217-M229 HydrophobicContact CD1-SD 4.3Å; A220-M229 HydrophobicContact CB-CG 4.03Å; P226-M229 WeakPolarHBondContact O-CB 3.36Å; P226-M229 PolarHBondContact O-N 3.11Å; P226-M229 VanDerWaalsContact O-N 3.16Å; W227-M229 VanDerWaalsContact C-N 3.26Å; W227-M229 PolarHBondContact O-N 3.02Å; M229-W232 WeakPolarHBondContact O-CB 3.48Å; M229-W232 PolarHBondContact O-N 3.03Å; M229-W232 VanDerWaalsContact O-N 3.16Å; M229-I233 WeakPolarHBondContact O-CG1 3.26Å; M229-I233 PolarHBondContact O-N 3.28Å; M229-I233 VanDerWaalsContact O-N 3.11Å; M229-L282 HydrophobicContact CE-CD1 4.16Å; M229-L282 HydrophobicContact CE-CD2 3.97Å; M229-L282 HydrophobicContact CE-CG 4.39Å; M229-L282 HydrophobicContact SD-CD1 4.4Å |
| 230 | I | 79 | Confident | 76.3 | Confident | 80 Ų | 80 | 70.2 Ų | 70.2 | 41% | 0.41 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -58.6 | -46.9 | -176.6 | -60.1 | 171.8 | 0 | 0 | 0 | 112.4 | W227 W232 I233 C234 | W227-I230 HydrophobicContact CE3-CD1 3.7Å; W227-I230 HydrophobicContact CZ3-CD1 4.16Å; W227-I230 WeakPolarHBondContact O-CG1 3.2Å; W227-I230 PolarHBondContact O-N 3.26Å; I230-W232 PolarHBondContact O-N 3.44Å; I230-I233 PolarHBondContact O-N 3.24Å; I230-I233 VanDerWaalsContact O-N 3.16Å; I230-C234 PolarHBondContact O-N 3.23Å; I230-C234 PolarHBondContact O-SG 3.39Å; I230-C234 VanDerWaalsContact O-SG 3.4Å |
| 231 | P | 77.2 | Confident | 76.3 | Confident | 45 Ų | 45 | 73.6 Ų | 73.6 | 29% | 0.292 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -58.3 | -34 | 178.3 | -24.5 | 35.1 | 0 | 0 | 0 | 113.2 | L216 L228 S235 | L216-P231 HydrophobicContact CD2-CB 4.46Å; L216-P231 HydrophobicContact CD2-CG 4.2Å; L228-P231 WeakPolarHBondContact O-CD 3.45Å; P231-S235 WeakPolarHBondContact O-CB 3.38Å; P231-S235 PolarHBondContact O-N 3.22Å; P231-S235 PolarHBondContact O-OG 3.47Å |
| 232 | W | 78.4 | Confident | 76.4 | Confident | 25 Ų | 25 | 69.9 Ų | 69.9 | 10% | 0.095 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -68.6 | -48.3 | 176.6 | -173.4 | 88.8 | 0 | 0 | 0 | 111.4 | L217 M229 I230 C234 S235 V236 F278 | L217-W232 HydrophobicContact CB-CB 4.25Å; L217-W232 HydrophobicContact CB-CG 4.1Å; L217-W232 HydrophobicContact CD1-CB 4.06Å; L217-W232 HydrophobicContact CD1-CD2 4.28Å; L217-W232 HydrophobicContact CD1-CG 4.01Å; L217-W232 HydrophobicContact CD2-CD2 4.05Å; L217-W232 HydrophobicContact CD2-CG 4.01Å; L217-W232 HydrophobicContact CG-CG 4.26Å; M229-W232 WeakPolarHBondContact O-CB 3.48Å; M229-W232 PolarHBondContact O-N 3.03Å; M229-W232 VanDerWaalsContact O-N 3.16Å; I230-W232 PolarHBondContact O-N 3.44Å; W232-C234 VanDerWaalsContact C-N 3.31Å; W232-C234 PolarHBondContact O-N 2.78Å; W232-S235 PolarHBondContact O-N 3.29Å; W232-S235 VanDerWaalsContact O-N 3.15Å; W232-V236 HydrophobicContact CD2-CG2 3.99Å; W232-V236 HydrophobicContact CE3-CG2 4.07Å; W232-V236 HydrophobicContact CH2-CG2 3.85Å; W232-V236 HydrophobicContact CZ2-CG2 3.78Å; W232-V236 HydrophobicContact CZ3-CG2 3.98Å; W232-V236 WeakPolarHBondContact O-CG2 3.45Å; W232-V236 PolarHBondContact O-N 3.41Å; W232-F278 HydrophobicContact CE3-CD1 4.1Å; W232-F278 AromaticContact CE3-CE1 3.69Å; W232-F278 HydrophobicContact CE3-CE1 3.69Å; W232-F278 HydrophobicContact CE3-CZ 4.2Å; W232-F278 HydrophobicContact CH2-CB 3.95Å; W232-F278 AromaticContact CH2-CD1 3.3Å; W232-F278 HydrophobicContact CH2-CD1 3.3Å; W232-F278 AromaticContact CH2-CD2 3.85Å; W232-F278 HydrophobicContact CH2-CD2 3.85Å; W232-F278 AromaticContact CH2-CE1 3.63Å; W232-F278 HydrophobicContact CH2-CE1 3.63Å; W232-F278 HydrophobicContact CH2-CE2 4.14Å; W232-F278 AromaticContact CH2-CG 3.4Å; W232-F278 HydrophobicContact CH2-CG 3.4Å; W232-F278 VanDerWaalsContact CH2-CG 3.4Å; W232-F278 HydrophobicContact CH2-CZ 4.03Å; W232-F278 HydrophobicContact CZ2-CD1 4.39Å; W232-F278 HydrophobicContact CZ2-CD2 4.32Å; W232-F278 HydrophobicContact CZ2-CE1 4.46Å; W232-F278 HydrophobicContact CZ2-CE2 4.41Å; W232-F278 HydrophobicContact CZ2-CG 4.31Å; W232-F278 HydrophobicContact CZ2-CZ 4.47Å; W232-F278 AromaticContact CZ3-CD1 3.12Å; W232-F278 HydrophobicContact CZ3-CD1 3.12Å; W232-F278 HydrophobicContact CZ3-CD2 4.42Å; W232-F278 AromaticContact CZ3-CE1 3.18Å; W232-F278 HydrophobicContact CZ3-CE1 3.18Å; W232-F278 HydrophobicContact CZ3-CE2 4.47Å; W232-F278 AromaticContact CZ3-CG 3.78Å; W232-F278 HydrophobicContact CZ3-CG 3.78Å; W232-F278 AromaticContact CZ3-CZ 3.91Å; W232-F278 HydrophobicContact CZ3-CZ 3.91Å |
| 233 | I | 74.9 | Confident | 76 | Confident | 83 Ų | 83 | 65.2 Ų | 65.2 | 43% | 0.426 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -58.9 | -43.9 | 176.8 | -61.8 | 167.2 | 0 | 0 | 0 | 110.8 | M229 I230 V236 L237 | M229-I233 WeakPolarHBondContact O-CG1 3.26Å; M229-I233 PolarHBondContact O-N 3.28Å; M229-I233 VanDerWaalsContact O-N 3.11Å; I230-I233 PolarHBondContact O-N 3.24Å; I230-I233 VanDerWaalsContact O-N 3.16Å; I233-V236 PolarHBondContact O-N 2.96Å; I233-L237 WeakPolarHBondContact O-CB 3.34Å; I233-L237 PolarHBondContact O-N 3.47Å |
| 234 | C | 77.5 | Confident | 75.4 | Confident | 65 Ų | 65 | 65.6 Ų | 65.6 | 44% | 0.439 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -63.3 | -41.2 | 177 | -68.4 | 0 | 0 | 0 | 0 | 112.4 | I230 W232 L237 L238 | I230-C234 PolarHBondContact O-N 3.23Å; I230-C234 PolarHBondContact O-SG 3.39Å; I230-C234 VanDerWaalsContact O-SG 3.4Å; W232-C234 VanDerWaalsContact C-N 3.31Å; W232-C234 PolarHBondContact O-N 2.78Å; C234-L237 PolarHBondContact O-N 2.91Å; C234-L238 WeakPolarHBondContact O-CG 3.22Å; C234-L238 PolarHBondContact O-N 3.02Å |
| 235 | S | 74.7 | Confident | 74.9 | Confident | 8 Ų | 8 | 61.2 Ų | 61.2 | 6% | 0.056 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -68 | -38.8 | -179.5 | -60.9 | 0 | 0 | 0 | 0 | 112.4 | I209 S213 P231 W232 L238 D239 | I209-S235 WeakPolarHBondContact CG2-OG 3.25Å; S213-S235 PolarHBondContact OG-OG 3.03Å; P231-S235 WeakPolarHBondContact O-CB 3.38Å; P231-S235 PolarHBondContact O-N 3.22Å; P231-S235 PolarHBondContact O-OG 3.47Å; W232-S235 PolarHBondContact O-N 3.29Å; W232-S235 VanDerWaalsContact O-N 3.15Å; S235-L238 PolarHBondContact O-N 3.05Å; S235-D239 PolarHBondContact O-N 3.19Å; S235-D239 VanDerWaalsContact O-N 3.1Å |
| 236 | V | 71.6 | Confident | 74.4 | Confident | 21 Ų | 21 | 59.7 Ų | 59.7 | 13% | 0.127 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -63.2 | -46.2 | 173.6 | 167.4 | 0 | 0 | 0 | 0 | 110.9 | W232 I233 L238 D239 V240 D275 | W232-V236 HydrophobicContact CD2-CG2 3.99Å; W232-V236 HydrophobicContact CE3-CG2 4.07Å; W232-V236 HydrophobicContact CH2-CG2 3.85Å; W232-V236 HydrophobicContact CZ2-CG2 3.78Å; W232-V236 HydrophobicContact CZ3-CG2 3.98Å; W232-V236 WeakPolarHBondContact O-CG2 3.45Å; W232-V236 PolarHBondContact O-N 3.41Å; I233-V236 PolarHBondContact O-N 2.96Å; V236-L238 VanDerWaalsContact C-N 3.29Å; V236-L238 PolarHBondContact O-N 3.26Å; V236-D239 PolarHBondContact O-N 2.88Å; V236-V240 PolarHBondContact O-N 2.93Å; V236-D275 HydrophobicContact CG1-CB 4.06Å; V236-D275 WeakPolarHBondContact CG1-OD1 3.49Å; V236-D275 WeakPolarHBondContact CG1-OD2 3.19Å |
| 237 | L | 74 | Confident | 73.9 | Confident | 113 Ų | 113 | 56 Ų | 56 | 59% | 0.592 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -59.9 | -40.1 | 176.6 | -172.7 | 68.8 | 0 | 0 | 0 | 112.1 | I233 C234 D239 V240 V241 | I233-L237 WeakPolarHBondContact O-CB 3.34Å; I233-L237 PolarHBondContact O-N 3.47Å; C234-L237 PolarHBondContact O-N 2.91Å; L237-D239 VanDerWaalsContact C-N 3.32Å; L237-D239 PolarHBondContact O-N 3.07Å; L237-V240 PolarHBondContact O-N 3.43Å; L237-V241 WeakPolarHBondContact O-CG2 3.34Å; L237-V241 PolarHBondContact O-N 3.34Å |
| 238 | L | 73.3 | Confident | 73.1 | Confident | 100 Ų | 100 | 50.6 Ų | 50.6 | 52% | 0.524 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -62.1 | -38.2 | 174.5 | -73.5 | 173.6 | 0 | 0 | 0 | 112.1 | C234 S235 V236 R242 | C234-L238 WeakPolarHBondContact O-CG 3.22Å; C234-L238 PolarHBondContact O-N 3.02Å; S235-L238 PolarHBondContact O-N 3.05Å; V236-L238 VanDerWaalsContact C-N 3.29Å; V236-L238 PolarHBondContact O-N 3.26Å; L238-R242 VanDerWaalsContact O-CB 3.31Å; L238-R242 WeakPolarHBondContact O-CB 3.32Å; L238-R242 PolarHBondContact O-N 2.78Å |
| 239 | D | 71.5 | Confident | 72.5 | Confident | 18 Ų | 18 | 52 Ų | 52 | 10% | 0.096 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -70.4 | -35.6 | 176.8 | -165 | 36.6 | 0 | 0 | 0 | 112.4 | I210 S235 V236 L237 R242 G243 Q271 | I210-D239 HydrophobicContact CD1-CB 4.03Å; S235-D239 PolarHBondContact O-N 3.19Å; S235-D239 VanDerWaalsContact O-N 3.1Å; V236-D239 PolarHBondContact O-N 2.88Å; L237-D239 VanDerWaalsContact C-N 3.32Å; L237-D239 PolarHBondContact O-N 3.07Å; D239-R242 WeakPolarHBondContact O-CB 3.24Å; D239-R242 PolarHBondContact O-N 2.76Å; D239-R242 IonicContact OD1-CZ 3.61Å; D239-R242 IonicContact OD1-NE 2.89Å; D239-R242 PolarHBondContact OD1-NE 3.49Å; D239-R242 IonicContact OD1-NH2 3.4Å; D239-R242 PolarHBondContact OD1-NH2 2.79Å; D239-G243 PolarHBondContact O-N 3.49Å; D239-Q271 PolarHBondContact OD2-NE2 2.79Å |
| 240 | V | 71.4 | Confident | 72.1 | Confident | 16 Ų | 16 | 50.4 Ų | 50.4 | 10% | 0.097 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -62.4 | -49.4 | 172.6 | 172.8 | 0 | 0 | 0 | 0 | 110.7 | V236 L237 R242 G243 F244 L272 D275 | V236-V240 PolarHBondContact O-N 2.93Å; L237-V240 PolarHBondContact O-N 3.43Å; V240-R242 VanDerWaalsContact C-N 3.29Å; V240-R242 PolarHBondContact O-N 3.29Å; V240-G243 PolarHBondContact O-N 3.5Å; V240-G243 VanDerWaalsContact O-N 3.13Å; V240-F244 HydrophobicContact CG1-CD2 3.89Å; V240-F244 HydrophobicContact CG1-CE2 3.85Å; V240-F244 WeakPolarHBondContact O-CD2 3.19Å; V240-F244 PolarHBondContact O-N 2.82Å; V240-L272 HydrophobicContact CG1-CD2 3.72Å; V240-L272 HydrophobicContact CG2-CD2 4.02Å; V240-D275 WeakPolarHBondContact CG2-OD2 3.24Å |
| 241 | V | 74.5 | Confident | 71.4 | Confident | 74 Ų | 74 | 50.2 Ų | 50.2 | 45% | 0.448 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -60.1 | -42.2 | 177.3 | 173.2 | 0 | 0 | 0 | 0 | 110.7 | L237 F244 I245 | L237-V241 WeakPolarHBondContact O-CG2 3.34Å; L237-V241 PolarHBondContact O-N 3.34Å; V241-F244 WeakPolarHBondContact O-CB 3.2Å; V241-F244 PolarHBondContact O-N 3.29Å; V241-I245 HydrophobicContact CG1-CD1 3.94Å; V241-I245 WeakPolarHBondContact O-CG1 3.12Å; V241-I245 PolarHBondContact O-N 2.78Å |
| 242 | R | 74.2 | Confident | 70.9 | Confident | 17 Ų | 17 | 52.6 Ų | 52.6 | 6% | 0.064 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -58.8 | -47.8 | 173.5 | -172.4 | -162.1 | 75.1 | 75.5 | 12.1 | 111.2 | Y185 E188 N203 I206 L238 D239 V240 F244 I245 S246 | Y185-R242 PolarHBondContact OH-NH2 3.43Å; E188-R242 IonicContact OE1-NH1 3.59Å; E188-R242 IonicContact OE2-NH1 3.73Å; N203-R242 WeakPolarHBondContact OD1-CD 3.47Å; N203-R242 PolarHBondContact OD1-NH1 3.01Å; I206-R242 HydrophobicContact CD1-CB 4.27Å; I206-R242 VanDerWaalsContact CD1-CD 3.4Å; I206-R242 HydrophobicContact CD1-CG 3.93Å; L238-R242 VanDerWaalsContact O-CB 3.31Å; L238-R242 WeakPolarHBondContact O-CB 3.32Å; L238-R242 PolarHBondContact O-N 2.78Å; D239-R242 WeakPolarHBondContact O-CB 3.24Å; D239-R242 PolarHBondContact O-N 2.76Å; D239-R242 IonicContact OD1-CZ 3.61Å; D239-R242 IonicContact OD1-NE 2.89Å; D239-R242 PolarHBondContact OD1-NE 3.49Å; D239-R242 IonicContact OD1-NH2 3.4Å; D239-R242 PolarHBondContact OD1-NH2 2.79Å; V240-R242 VanDerWaalsContact C-N 3.29Å; V240-R242 PolarHBondContact O-N 3.29Å; R242-F244 VanDerWaalsContact C-N 3.29Å; R242-F244 PolarHBondContact O-N 3.33Å; R242-I245 PolarHBondContact O-N 2.81Å; R242-I245 VanDerWaalsContact O-N 3.11Å; R242-S246 PolarHBondContact O-N 3.48Å; R242-S246 PolarHBondContact O-OG 3.09Å |
| 243 | G | 69.3 | Low | 70.1 | Confident | 0 Ų | 0 | 55 Ų | 55 | 0% | 0 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -57.7 | -41.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | D239 V240 S246 C247 | D239-G243 PolarHBondContact O-N 3.49Å; V240-G243 PolarHBondContact O-N 3.5Å; V240-G243 VanDerWaalsContact O-N 3.13Å; G243-S246 PolarHBondContact O-N 3.27Å; G243-C247 PolarHBondContact O-N 2.83Å; G243-C247 PolarHBondContact O-SG 3.2Å |
| 244 | F | 70.2 | Confident | 69.5 | Low | 109 Ų | 109 | 51.9 Ų | 51.9 | 48% | 0.478 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -61.7 | -47.3 | 172.9 | -90.7 | -78.8 | 0 | 0 | 0 | 112.2 | V240 V241 R242 S246 C247 V248 L268 | V240-F244 HydrophobicContact CG1-CD2 3.89Å; V240-F244 HydrophobicContact CG1-CE2 3.85Å; V240-F244 WeakPolarHBondContact O-CD2 3.19Å; V240-F244 PolarHBondContact O-N 2.82Å; V241-F244 WeakPolarHBondContact O-CB 3.2Å; V241-F244 PolarHBondContact O-N 3.29Å; R242-F244 VanDerWaalsContact C-N 3.29Å; R242-F244 PolarHBondContact O-N 3.33Å; F244-S246 VanDerWaalsContact C-N 3.34Å; F244-S246 PolarHBondContact O-N 3.12Å; F244-C247 WeakPolarHBondContact O-CB 3.38Å; F244-C247 PolarHBondContact O-N 3.02Å; F244-V248 WeakPolarHBondContact O-CG2 3.17Å; F244-V248 PolarHBondContact O-N 3.24Å; F244-L268 HydrophobicContact CD1-CD2 3.76Å; F244-L268 HydrophobicContact CD2-CD1 4Å; F244-L268 HydrophobicContact CD2-CD2 3.9Å; F244-L268 HydrophobicContact CD2-CG 4.48Å; F244-L268 HydrophobicContact CE1-CD2 3.66Å; F244-L268 HydrophobicContact CE2-CD1 4.29Å; F244-L268 HydrophobicContact CE2-CD2 3.8Å; F244-L268 HydrophobicContact CE2-CG 4.38Å; F244-L268 HydrophobicContact CG-CD1 4.41Å; F244-L268 HydrophobicContact CG-CD2 3.88Å; F244-L268 HydrophobicContact CZ-CD2 3.68Å |
| 245 | I | 71.8 | Confident | 68.9 | Low | 101 Ų | 101 | 52.2 Ų | 52.2 | 52% | 0.518 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -60.9 | -44.4 | 177.9 | -65.5 | 163 | 0 | 0 | 0 | 110.3 | V241 R242 C247 V248 M249 | V241-I245 HydrophobicContact CG1-CD1 3.94Å; V241-I245 WeakPolarHBondContact O-CG1 3.12Å; V241-I245 PolarHBondContact O-N 2.78Å; R242-I245 PolarHBondContact O-N 2.81Å; R242-I245 VanDerWaalsContact O-N 3.11Å; I245-C247 VanDerWaalsContact C-N 3.34Å; I245-C247 PolarHBondContact O-N 3.19Å; I245-V248 PolarHBondContact O-N 3.45Å; I245-M249 HydrophobicContact CG2-CG 4.26Å; I245-M249 WeakPolarHBondContact O-CB 3.44Å; I245-M249 WeakPolarHBondContact O-CG 3.35Å; I245-M249 PolarHBondContact O-N 2.94Å |
| 246 | S | 69.2 | Low | 68 | Low | 9 Ų | 9 | 53.3 Ų | 53.3 | 6% | 0.063 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -60.5 | -41.8 | 176.4 | -66.8 | 0 | 0 | 0 | 0 | 111.6 | E188 R242 G243 F244 V248 M249 I250 | E188-S246 WeakPolarHBondContact OE2-CB 3.48Å; E188-S246 PolarHBondContact OE2-OG 3.36Å; R242-S246 PolarHBondContact O-N 3.48Å; R242-S246 PolarHBondContact O-OG 3.09Å; G243-S246 PolarHBondContact O-N 3.27Å; F244-S246 VanDerWaalsContact C-N 3.34Å; F244-S246 PolarHBondContact O-N 3.12Å; S246-V248 PolarHBondContact O-N 3.4Å; S246-M249 PolarHBondContact O-N 3.34Å; S246-I250 WeakPolarHBondContact O-CB 3.19Å; S246-I250 WeakPolarHBondContact O-CD1 3.13Å; S246-I250 WeakPolarHBondContact O-CG1 3.4Å; S246-I250 PolarHBondContact O-N 3.08Å |
| 247 | C | 64.8 | Low | 67.2 | Low | 8 Ų | 8 | 56 Ų | 56 | 5% | 0.054 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -60.3 | -44.4 | 175.2 | -68.9 | 0 | 0 | 0 | 0 | 112.4 | G243 F244 I245 I250 F251 G264 | G243-C247 PolarHBondContact O-N 2.83Å; G243-C247 PolarHBondContact O-SG 3.2Å; F244-C247 WeakPolarHBondContact O-CB 3.38Å; F244-C247 PolarHBondContact O-N 3.02Å; I245-C247 VanDerWaalsContact C-N 3.34Å; I245-C247 PolarHBondContact O-N 3.19Å; C247-I250 PolarHBondContact O-N 3.4Å; C247-F251 PolarHBondContact O-N 3.06Å; C247-G264 PolarHBondContact SG-O 2.87Å; C247-G264 VanDerWaalsContact SG-O 3.35Å |
| 248 | V | 66.3 | Low | 66.3 | Low | 87 Ų | 87 | 55.7 Ų | 55.7 | 53% | 0.527 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -65 | -44.2 | 177.5 | 174.7 | 0 | 0 | 0 | 0 | 110.8 | F244 I245 S246 I250 F251 V252 | F244-V248 WeakPolarHBondContact O-CG2 3.17Å; F244-V248 PolarHBondContact O-N 3.24Å; I245-V248 PolarHBondContact O-N 3.45Å; S246-V248 PolarHBondContact O-N 3.4Å; V248-I250 VanDerWaalsContact C-N 3.35Å; V248-I250 PolarHBondContact O-N 3.17Å; V248-F251 PolarHBondContact O-N 3.07Å; V248-F251 VanDerWaalsContact O-N 3.17Å; V248-V252 HydrophobicContact CG1-CG2 4.31Å; V248-V252 WeakPolarHBondContact O-CG2 3.5Å; V248-V252 PolarHBondContact O-N 2.67Å |
| 249 | M | 66 | Low | 65.3 | Low | 80 Ų | 80 | 58.3 Ų | 58.3 | 39% | 0.394 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -61.6 | -41.9 | 177.3 | -74 | -66 | -76.4 | 0 | 0 | 111.9 | I245 S246 F251 V252 L253 | I245-M249 HydrophobicContact CG2-CG 4.26Å; I245-M249 WeakPolarHBondContact O-CB 3.44Å; I245-M249 WeakPolarHBondContact O-CG 3.35Å; I245-M249 PolarHBondContact O-N 2.94Å; S246-M249 PolarHBondContact O-N 3.34Å; M249-F251 VanDerWaalsContact C-N 3.33Å; M249-F251 PolarHBondContact O-N 3.45Å; M249-V252 PolarHBondContact O-N 3.09Å; M249-L253 HydrophobicContact CB-CD1 4.42Å; M249-L253 HydrophobicContact CE-CD1 3.91Å; M249-L253 WeakPolarHBondContact O-CB 3.05Å; M249-L253 WeakPolarHBondContact O-CD1 3.3Å; M249-L253 WeakPolarHBondContact O-CG 3.42Å; M249-L253 PolarHBondContact O-N 3.26Å |
| 250 | I | 64.8 | Low | 64.4 | Low | 0 Ų | 0 | 59.6 Ų | 59.6 | 0% | 0 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -60.2 | -44.1 | 174 | -70.6 | 161.6 | 0 | 0 | 0 | 110.5 | L184 E187 Y191 S246 C247 V248 S254 K260 | L184-I250 HydrophobicContact CD1-CD1 3.7Å; E187-I250 HydrophobicContact CB-CD1 3.74Å; E187-I250 HydrophobicContact CB-CG1 4.23Å; Y191-I250 HydrophobicContact CE2-CB 4.42Å; Y191-I250 HydrophobicContact CE2-CG1 4.04Å; Y191-I250 PolarHBondContact OH-O 2.99Å; Y191-I250 VanDerWaalsContact OH-O 3.07Å; S246-I250 WeakPolarHBondContact O-CB 3.19Å; S246-I250 WeakPolarHBondContact O-CD1 3.13Å; S246-I250 WeakPolarHBondContact O-CG1 3.4Å; S246-I250 PolarHBondContact O-N 3.08Å; C247-I250 PolarHBondContact O-N 3.4Å; V248-I250 VanDerWaalsContact C-N 3.35Å; V248-I250 PolarHBondContact O-N 3.17Å; I250-S254 WeakPolarHBondContact O-CB 3.48Å; I250-S254 PolarHBondContact O-N 2.82Å; I250-K260 HydrophobicContact CG2-CB 3.8Å |
| 251 | F | 63.1 | Low | 63.8 | Low | 76 Ų | 76 | 61.3 Ų | 61.3 | 33% | 0.333 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -63.9 | -48.3 | 179.6 | -179.1 | -104.6 | 0 | 0 | 0 | 112.5 | C247 V248 M249 G256 I261 | C247-F251 PolarHBondContact O-N 3.06Å; V248-F251 PolarHBondContact O-N 3.07Å; V248-F251 VanDerWaalsContact O-N 3.17Å; M249-F251 VanDerWaalsContact C-N 3.33Å; M249-F251 PolarHBondContact O-N 3.45Å; F251-G256 PolarHBondContact O-N 2.62Å; F251-G256 VanDerWaalsContact O-N 3.08Å; F251-I261 HydrophobicContact CB-CD1 4.18Å; F251-I261 HydrophobicContact CD2-CB 4.08Å; F251-I261 HydrophobicContact CD2-CD1 3.87Å; F251-I261 HydrophobicContact CD2-CG2 4.3Å; F251-I261 HydrophobicContact CG-CD1 4.09Å |
| 252 | V | 68.5 | Low | 62.8 | Low | 94 Ų | 94 | 60.6 Ų | 60.6 | 57% | 0.57 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -64.6 | -48.6 | 180 | 173.5 | 0 | 0 | 0 | 0 | 110.8 | V248 M249 S254 G255 | V248-V252 HydrophobicContact CG1-CG2 4.31Å; V248-V252 WeakPolarHBondContact O-CG2 3.5Å; V248-V252 PolarHBondContact O-N 2.67Å; M249-V252 PolarHBondContact O-N 3.09Å; V252-S254 VanDerWaalsContact C-N 3.29Å; V252-S254 PolarHBondContact O-N 3.37Å; V252-G255 PolarHBondContact O-N 3.44Å |
| 253 | L | 61.7 | Low | 62 | Low | 77 Ų | 77 | 61 Ų | 61 | 40% | 0.403 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -74.6 | -20.3 | -175.6 | -64.4 | 168.7 | 0 | 0 | 0 | 113 | Y191 M249 G255 | Y191-L253 HydrophobicContact CD1-CB 3.27Å; Y191-L253 HydrophobicContact CD1-CD1 4.07Å; Y191-L253 HydrophobicContact CD1-CG 4.21Å; Y191-L253 HydrophobicContact CD2-CB 3.97Å; Y191-L253 HydrophobicContact CD2-CD1 3.54Å; Y191-L253 HydrophobicContact CD2-CG 4.41Å; Y191-L253 VanDerWaalsContact CE1-C 3.43Å; Y191-L253 HydrophobicContact CE1-CB 3.27Å; Y191-L253 WeakPolarHBondContact CE1-O 3.37Å; Y191-L253 HydrophobicContact CE2-CB 4Å; Y191-L253 HydrophobicContact CE2-CD1 4.18Å; Y191-L253 HydrophobicContact CG-CB 3.63Å; Y191-L253 HydrophobicContact CG-CD1 3.47Å; Y191-L253 VanDerWaalsContact CG-CD1 3.47Å; Y191-L253 HydrophobicContact CG-CG 4.12Å; M249-L253 HydrophobicContact CB-CD1 4.42Å; M249-L253 HydrophobicContact CE-CD1 3.91Å; M249-L253 WeakPolarHBondContact O-CB 3.05Å; M249-L253 WeakPolarHBondContact O-CD1 3.3Å; M249-L253 WeakPolarHBondContact O-CG 3.42Å; M249-L253 PolarHBondContact O-N 3.26Å; L253-G255 VanDerWaalsContact C-N 3.28Å |
| 254 | S | 61.1 | Low | 61.4 | Low | 16 Ų | 16 | 61 Ų | 61 | 11% | 0.112 | 35% | 0.347 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -85.6 | 7.6 | 171.7 | -161.6 | 0 | 0 | 0 | 0 | 114.2 | I250 V252 G256 D257 K260 | I250-S254 WeakPolarHBondContact O-CB 3.48Å; I250-S254 PolarHBondContact O-N 2.82Å; V252-S254 VanDerWaalsContact C-N 3.29Å; V252-S254 PolarHBondContact O-N 3.37Å; S254-G256 VanDerWaalsContact C-N 3.27Å; S254-G256 PolarHBondContact O-N 2.85Å; S254-D257 WeakPolarHBondContact OG-CB 3.49Å; S254-D257 PolarHBondContact OG-OD2 3.43Å; S254-K260 VanDerWaalsContact OG-CD 3.22Å; S254-K260 WeakPolarHBondContact OG-CD 3.21Å; S254-K260 WeakPolarHBondContact OG-CE 3.41Å; S254-K260 PolarHBondContact OG-NZ 2.67Å |
| 255 | G | 65.4 | Low | 60.9 | Low | 73 Ų | 73 | 59.8 Ų | 59.8 | 75% | 0.753 | 35% | 0.348 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66.2 | 26.8 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | V252 L253 | V252-G255 PolarHBondContact O-N 3.44Å; L253-G255 VanDerWaalsContact C-N 3.28Å |
| 256 | G | 54.8 | Low | 60.3 | Low | 31 Ų | 31 | 58.9 Ų | 58.9 | 32% | 0.32 | 34% | 0.34 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 87.9 | 14.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | F251 S254 V258 | F251-G256 PolarHBondContact O-N 2.62Å; F251-G256 VanDerWaalsContact O-N 3.08Å; S254-G256 VanDerWaalsContact C-N 3.27Å; S254-G256 PolarHBondContact O-N 2.85Å; G256-V258 PolarHBondContact O-N 2.84Å |
| 257 | D | 56.3 | Low | 59.9 | Low | 76 Ų | 76 | 59.3 Ų | 59.3 | 41% | 0.406 | 34% | 0.341 | S | S | . | . | trans | -62.4 | 101.9 | 175 | -82.4 | -27.5 | 0 | 0 | 0 | 111.9 | S254 R259 K260 | S254-D257 WeakPolarHBondContact OG-CB 3.49Å; S254-D257 PolarHBondContact OG-OD2 3.43Å; D257-R259 PolarHBondContact O-N 2.93Å; D257-K260 HydrophobicContact CB-CG 4.4Å; D257-K260 PolarHBondContact O-N 2.85Å; D257-K260 VanDerWaalsContact O-N 3.09Å | ||
| 258 | V | 55.1 | Low | 59.6 | Low | 107 Ų | 107 | 59.3 Ų | 59.3 | 65% | 0.648 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -58.3 | -15.7 | 178.7 | -79.7 | 0 | 0 | 0 | 0 | 115 | G256 I261 A262 | G256-V258 PolarHBondContact O-N 2.84Å; V258-I261 HydrophobicContact CB-CG2 4.47Å; V258-I261 WeakPolarHBondContact O-CG2 3.3Å; V258-A262 PolarHBondContact O-N 3.41Å |
| 259 | R | 51.7 | Low | 59.1 | Low | 155 Ų | 155 | 56.2 Ų | 56.2 | 59% | 0.585 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -76.9 | -35.2 | 176.5 | -62.1 | -174.2 | -174.3 | -163.2 | 2.3 | 112.4 | D257 A262 V263 | D257-R259 PolarHBondContact O-N 2.93Å; R259-A262 WeakPolarHBondContact O-CB 3.47Å; R259-A262 PolarHBondContact O-N 3.05Å; R259-V263 PolarHBondContact O-N 2.97Å |
| 260 | K | 53.1 | Low | 58.6 | Low | 45 Ų | 45 | 54.3 Ų | 54.3 | 20% | 0.196 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -76.1 | -34.1 | -179.3 | -62.2 | -162.7 | -165.2 | 161.1 | 0 | 112.3 | I250 S254 D257 A262 V263 G264 | I250-K260 HydrophobicContact CG2-CB 3.8Å; S254-K260 VanDerWaalsContact OG-CD 3.22Å; S254-K260 WeakPolarHBondContact OG-CD 3.21Å; S254-K260 WeakPolarHBondContact OG-CE 3.41Å; S254-K260 PolarHBondContact OG-NZ 2.67Å; D257-K260 HydrophobicContact CB-CG 4.4Å; D257-K260 PolarHBondContact O-N 2.85Å; D257-K260 VanDerWaalsContact O-N 3.09Å; K260-A262 VanDerWaalsContact C-N 3.29Å; K260-A262 PolarHBondContact O-N 3.43Å; K260-V263 PolarHBondContact O-N 3.29Å; K260-G264 PolarHBondContact O-N 3.34Å |
| 261 | I | 58.3 | Low | 58.3 | Low | 53 Ų | 53 | 55.8 Ų | 55.8 | 27% | 0.272 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -64 | -35.2 | 170.7 | -166 | 171.5 | 0 | 0 | 0 | 111.5 | F251 V258 V263 G264 V265 | F251-I261 HydrophobicContact CB-CD1 4.18Å; F251-I261 HydrophobicContact CD2-CB 4.08Å; F251-I261 HydrophobicContact CD2-CD1 3.87Å; F251-I261 HydrophobicContact CD2-CG2 4.3Å; F251-I261 HydrophobicContact CG-CD1 4.09Å; V258-I261 HydrophobicContact CB-CG2 4.47Å; V258-I261 WeakPolarHBondContact O-CG2 3.3Å; I261-V263 VanDerWaalsContact C-N 3.29Å; I261-V263 PolarHBondContact O-N 2.78Å; I261-G264 PolarHBondContact O-N 2.9Å; I261-V265 HydrophobicContact CG1-CG2 3.98Å; I261-V265 WeakPolarHBondContact O-CB 3.13Å; I261-V265 WeakPolarHBondContact O-CG2 3.46Å; I261-V265 PolarHBondContact O-N 2.94Å |
| 262 | A | 52.7 | Low | 58 | Low | 58 Ų | 58 | 55.2 Ų | 55.2 | 48% | 0.479 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -61.5 | -39 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112 | V258 R259 K260 F266 | V258-A262 PolarHBondContact O-N 3.41Å; R259-A262 WeakPolarHBondContact O-CB 3.47Å; R259-A262 PolarHBondContact O-N 3.05Å; K260-A262 VanDerWaalsContact C-N 3.29Å; K260-A262 PolarHBondContact O-N 3.43Å; A262-F266 VanDerWaalsContact O-CB 3.24Å; A262-F266 WeakPolarHBondContact O-CB 3.23Å; A262-F266 PolarHBondContact O-N 2.77Å |
| 263 | V | 57.8 | Low | 57.1 | Low | 26 Ų | 26 | 57.4 Ų | 57.4 | 16% | 0.158 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -66.7 | -45.7 | 174.2 | 178.1 | 0 | 0 | 0 | 0 | 111 | R259 K260 I261 F266 F267 | R259-V263 PolarHBondContact O-N 2.97Å; K260-V263 PolarHBondContact O-N 3.29Å; I261-V263 VanDerWaalsContact C-N 3.29Å; I261-V263 PolarHBondContact O-N 2.78Å; V263-F266 PolarHBondContact O-N 3.44Å; V263-F267 HydrophobicContact CG1-CD2 3.75Å; V263-F267 HydrophobicContact CG1-CE2 3.52Å; V263-F267 WeakPolarHBondContact O-CD2 3.31Å; V263-F267 PolarHBondContact O-N 3.44Å |
| 264 | G | 57.5 | Low | 56.6 | Low | 1 Ų | 1 | 57.4 Ų | 57.4 | 1% | 0.01 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -59.1 | -49.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | C247 K260 I261 F266 F267 L268 | C247-G264 PolarHBondContact SG-O 2.87Å; C247-G264 VanDerWaalsContact SG-O 3.35Å; K260-G264 PolarHBondContact O-N 3.34Å; I261-G264 PolarHBondContact O-N 2.9Å; G264-F266 VanDerWaalsContact C-N 3.3Å; G264-F266 PolarHBondContact O-N 3.1Å; G264-F267 PolarHBondContact O-N 3.12Å; G264-L268 WeakPolarHBondContact O-CB 3.16Å; G264-L268 PolarHBondContact O-N 3.16Å |
| 265 | V | 59.1 | Low | 56.3 | Low | 82 Ų | 82 | 58 Ų | 58 | 50% | 0.497 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -62.4 | -36.4 | 177.1 | 172.3 | 0 | 0 | 0 | 0 | 111.3 | I261 L268 G269 | I261-V265 HydrophobicContact CG1-CG2 3.98Å; I261-V265 WeakPolarHBondContact O-CB 3.13Å; I261-V265 WeakPolarHBondContact O-CG2 3.46Å; I261-V265 PolarHBondContact O-N 2.94Å; V265-L268 PolarHBondContact O-N 3.17Å; V265-G269 PolarHBondContact O-N 3.32Å |
| 266 | F | 58.7 | Low | 55.5 | Low | 82 Ų | 82 | 57.8 Ų | 57.8 | 36% | 0.36 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -63.7 | -47.7 | 175.4 | -179.2 | -95.2 | 0 | 0 | 0 | 111.8 | L103 T107 A262 V263 G264 G269 L270 | L103-F266 HydrophobicContact CD1-CZ 4.28Å; T107-F266 HydrophobicContact CG2-CD1 3.79Å; T107-F266 HydrophobicContact CG2-CE1 3.33Å; T107-F266 HydrophobicContact CG2-CZ 4.24Å; A262-F266 VanDerWaalsContact O-CB 3.24Å; A262-F266 WeakPolarHBondContact O-CB 3.23Å; A262-F266 PolarHBondContact O-N 2.77Å; V263-F266 PolarHBondContact O-N 3.44Å; G264-F266 VanDerWaalsContact C-N 3.3Å; G264-F266 PolarHBondContact O-N 3.1Å; F266-G269 PolarHBondContact O-N 3.35Å; F266-L270 HydrophobicContact CD1-CD1 3.86Å; F266-L270 HydrophobicContact CE1-CD1 3.37Å; F266-L270 HydrophobicContact CE1-CG 4.16Å; F266-L270 HydrophobicContact CZ-CD1 4Å; F266-L270 HydrophobicContact CZ-CG 4.42Å; F266-L270 WeakPolarHBondContact O-CG 3.46Å; F266-L270 PolarHBondContact O-N 3.1Å |
| 267 | F | 60.8 | Low | 55.1 | Low | 18 Ų | 18 | 60 Ų | 60 | 8% | 0.079 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -67.4 | -36.9 | 177.1 | -75.8 | -64.2 | 0 | 0 | 0 | 112.8 | T107 I110 G183 L184 V263 G264 G269 L270 Q271 | T107-F267 HydrophobicContact CG2-CE1 4.18Å; T107-F267 HydrophobicContact CG2-CZ 3.79Å; I110-F267 HydrophobicContact CD1-CE1 3.84Å; G183-F267 VanDerWaalsContact CA-CE2 3.46Å; G183-F267 VanDerWaalsContact CA-CZ 3.46Å; L184-F267 HydrophobicContact CB-CB 4.01Å; L184-F267 HydrophobicContact CB-CG 4.47Å; V263-F267 HydrophobicContact CG1-CD2 3.75Å; V263-F267 HydrophobicContact CG1-CE2 3.52Å; V263-F267 WeakPolarHBondContact O-CD2 3.31Å; V263-F267 PolarHBondContact O-N 3.44Å; G264-F267 PolarHBondContact O-N 3.12Å; F267-G269 VanDerWaalsContact C-N 3.34Å; F267-L270 HydrophobicContact CD1-CD1 4.1Å; F267-L270 HydrophobicContact CE1-CD1 4.49Å; F267-L270 PolarHBondContact O-N 2.71Å; F267-Q271 PolarHBondContact O-N 3.32Å |
| 268 | L | 60.1 | Low | 54.6 | Low | 9 Ų | 9 | 58.3 Ų | 58.3 | 5% | 0.047 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -62.9 | -41.4 | 171.7 | -174 | 71.6 | 0 | 0 | 0 | 111.5 | F244 G264 V265 L270 Q271 L272 | F244-L268 HydrophobicContact CD1-CD2 3.76Å; F244-L268 HydrophobicContact CD2-CD1 4Å; F244-L268 HydrophobicContact CD2-CD2 3.9Å; F244-L268 HydrophobicContact CD2-CG 4.48Å; F244-L268 HydrophobicContact CE1-CD2 3.66Å; F244-L268 HydrophobicContact CE2-CD1 4.29Å; F244-L268 HydrophobicContact CE2-CD2 3.8Å; F244-L268 HydrophobicContact CE2-CG 4.38Å; F244-L268 HydrophobicContact CG-CD1 4.41Å; F244-L268 HydrophobicContact CG-CD2 3.88Å; F244-L268 HydrophobicContact CZ-CD2 3.68Å; G264-L268 WeakPolarHBondContact O-CB 3.16Å; G264-L268 PolarHBondContact O-N 3.16Å; V265-L268 PolarHBondContact O-N 3.17Å; L268-L270 VanDerWaalsContact C-N 3.32Å; L268-L270 PolarHBondContact O-N 3.33Å; L268-Q271 WeakPolarHBondContact O-CB 3.22Å; L268-Q271 PolarHBondContact O-N 3.45Å; L268-L272 HydrophobicContact CG-CD1 4.49Å; L268-L272 WeakPolarHBondContact O-CG 3.36Å; L268-L272 PolarHBondContact O-N 2.98Å |
| 269 | G | 53.9 | Low | 54 | Low | 22 Ų | 22 | 57 Ų | 57 | 23% | 0.227 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -59.4 | -42.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | V265 F266 F267 L272 F273 | V265-G269 PolarHBondContact O-N 3.32Å; F266-G269 PolarHBondContact O-N 3.35Å; F267-G269 VanDerWaalsContact C-N 3.34Å; G269-L272 PolarHBondContact O-N 3.5Å; G269-F273 WeakPolarHBondContact O-CD2 3.33Å; G269-F273 PolarHBondContact O-N 2.75Å |
| 270 | L | 56 | Low | 53.4 | Low | 40 Ų | 40 | 56 Ų | 56 | 21% | 0.209 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -62.9 | -40.3 | 174.1 | -70.8 | 168.5 | 0 | 0 | 0 | 112.7 | I110 F266 F267 L268 F273 H274 | I110-L270 HydrophobicContact CB-CD1 4.42Å; I110-L270 HydrophobicContact CD1-CD1 4.39Å; I110-L270 HydrophobicContact CG2-CD1 3.63Å; I110-L270 HydrophobicContact CG2-CD2 3.86Å; I110-L270 HydrophobicContact CG2-CG 4.3Å; F266-L270 HydrophobicContact CD1-CD1 3.86Å; F266-L270 HydrophobicContact CE1-CD1 3.37Å; F266-L270 HydrophobicContact CE1-CG 4.16Å; F266-L270 HydrophobicContact CZ-CD1 4Å; F266-L270 HydrophobicContact CZ-CG 4.42Å; F266-L270 WeakPolarHBondContact O-CG 3.46Å; F266-L270 PolarHBondContact O-N 3.1Å; F267-L270 HydrophobicContact CD1-CD1 4.1Å; F267-L270 HydrophobicContact CE1-CD1 4.49Å; F267-L270 PolarHBondContact O-N 2.71Å; L268-L270 VanDerWaalsContact C-N 3.32Å; L268-L270 PolarHBondContact O-N 3.33Å; L270-F273 PolarHBondContact O-N 2.92Å; L270-H274 PolarHBondContact O-N 2.77Å; L270-H274 VanDerWaalsContact O-N 3.11Å |
| 271 | Q | 58.8 | Low | 52.9 | Low | 31 Ų | 31 | 56.7 Ų | 56.7 | 15% | 0.145 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -62.3 | -42.5 | 172.6 | -78.7 | 171.8 | -47.8 | 0 | 0 | 111.6 | D239 F267 L268 H274 D275 | D239-Q271 PolarHBondContact OD2-NE2 2.79Å; F267-Q271 PolarHBondContact O-N 3.32Å; L268-Q271 WeakPolarHBondContact O-CB 3.22Å; L268-Q271 PolarHBondContact O-N 3.45Å; Q271-H274 WeakPolarHBondContact O-CB 3.41Å; Q271-H274 PolarHBondContact O-N 3.02Å; Q271-D275 PolarHBondContact O-N 2.99Å |
| 272 | L | 55.7 | Low | 52 | Low | 64 Ų | 64 | 56.6 Ų | 56.6 | 34% | 0.335 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -67.7 | -36.1 | 176.9 | -70.1 | 173 | 0 | 0 | 0 | 112.8 | V240 L268 G269 H274 D275 S276 | V240-L272 HydrophobicContact CG1-CD2 3.72Å; V240-L272 HydrophobicContact CG2-CD2 4.02Å; L268-L272 HydrophobicContact CG-CD1 4.49Å; L268-L272 WeakPolarHBondContact O-CG 3.36Å; L268-L272 PolarHBondContact O-N 2.98Å; G269-L272 PolarHBondContact O-N 3.5Å; L272-H274 VanDerWaalsContact C-N 3.3Å; L272-H274 PolarHBondContact O-N 3.46Å; L272-D275 PolarHBondContact O-N 2.93Å; L272-S276 VanDerWaalsContact O-CB 3.29Å; L272-S276 WeakPolarHBondContact O-CB 3.38Å; L272-S276 PolarHBondContact O-N 3.19Å; L272-S276 PolarHBondContact O-OG 3.45Å |
| 273 | F | 51.4 | Low | 51.1 | Low | 140 Ų | 140 | 56.8 Ų | 56.8 | 61% | 0.614 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -64.9 | -35.4 | 174.7 | -84 | -64.3 | 0 | 0 | 0 | 112.1 | G269 L270 K277 | G269-F273 WeakPolarHBondContact O-CD2 3.33Å; G269-F273 PolarHBondContact O-N 2.75Å; L270-F273 PolarHBondContact O-N 2.92Å; F273-K277 WeakPolarHBondContact O-CG 3.24Å; F273-K277 PolarHBondContact O-N 3.39Å |
| 274 | H | 51 | Low | 49.9 | Very low | 77 Ų | 77 | 60 Ų | 60 | 36% | 0.356 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -59.4 | -46.3 | 172.1 | 170.7 | -89.7 | 0 | 0 | 0 | 111.5 | F130 L270 Q271 L272 F278 | F130-H274 AromaticContact CD1-CD2 3.53Å; F130-H274 AromaticContact CD1-NE2 3.38Å; F130-H274 WeakPolarHBondContact CD1-NE2 3.46Å; F130-H274 AromaticContact CE1-CD2 3.11Å; F130-H274 WeakPolarHBondContact CE1-CD2 3.49Å; F130-H274 AromaticContact CE1-CG 3.96Å; F130-H274 AromaticContact CE1-NE2 3.23Å; F130-H274 WeakPolarHBondContact CE1-NE2 3.4Å; F130-H274 HydrophobicContact CZ-CB 4.5Å; F130-H274 AromaticContact CZ-CD2 3.48Å; F130-H274 VanDerWaalsContact CZ-CD2 3.48Å; F130-H274 WeakPolarHBondContact CZ-CD2 3.37Å; L270-H274 PolarHBondContact O-N 2.77Å; L270-H274 VanDerWaalsContact O-N 3.11Å; Q271-H274 WeakPolarHBondContact O-CB 3.41Å; Q271-H274 PolarHBondContact O-N 3.02Å; L272-H274 VanDerWaalsContact C-N 3.3Å; L272-H274 PolarHBondContact O-N 3.46Å; H274-F278 PolarHBondContact O-N 2.74Å |
| 275 | D | 53.6 | Low | 48.8 | Very low | 28 Ų | 28 | 66.8 Ų | 66.8 | 15% | 0.15 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -76.5 | -37.8 | -177.1 | -58.7 | -19.7 | 0 | 0 | 0 | 113.1 | V236 V240 Q271 L272 K277 F278 S279 | V236-D275 HydrophobicContact CG1-CB 4.06Å; V236-D275 WeakPolarHBondContact CG1-OD1 3.49Å; V236-D275 WeakPolarHBondContact CG1-OD2 3.19Å; V240-D275 WeakPolarHBondContact CG2-OD2 3.24Å; Q271-D275 PolarHBondContact O-N 2.99Å; L272-D275 PolarHBondContact O-N 2.93Å; D275-K277 VanDerWaalsContact C-N 3.3Å; D275-K277 PolarHBondContact O-N 3.18Å; D275-F278 PolarHBondContact O-N 3.05Å; D275-S279 WeakPolarHBondContact O-CB 3.3Å; D275-S279 PolarHBondContact O-N 3.14Å |
| 276 | S | 48.9 | Very low | 47.7 | Very low | 69 Ų | 69 | 68.1 Ų | 68.1 | 48% | 0.483 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -63.1 | -39.1 | 179.5 | -57.6 | 0 | 0 | 0 | 0 | 110.7 | L272 L280 | L272-S276 VanDerWaalsContact O-CB 3.29Å; L272-S276 WeakPolarHBondContact O-CB 3.38Å; L272-S276 PolarHBondContact O-N 3.19Å; L272-S276 PolarHBondContact O-OG 3.45Å; S276-L280 WeakPolarHBondContact O-CB 3.05Å; S276-L280 PolarHBondContact O-N 2.83Å |
| 277 | K | 46.1 | Very low | 46.8 | Very low | 76 Ų | 76 | 69.4 Ų | 69.4 | 33% | 0.33 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -69.9 | -33.2 | 177.1 | -74 | -168.8 | 179.9 | -177.3 | 0 | 112.4 | F273 D275 T281 | F273-K277 WeakPolarHBondContact O-CG 3.24Å; F273-K277 PolarHBondContact O-N 3.39Å; D275-K277 VanDerWaalsContact C-N 3.3Å; D275-K277 PolarHBondContact O-N 3.18Å; K277-T281 PolarHBondContact O-N 3.39Å; K277-T281 PolarHBondContact O-OG1 2.74Å |
| 278 | F | 47 | Very low | 45.2 | Very low | 41 Ų | 41 | 73.5 Ų | 73.5 | 18% | 0.18 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -71.2 | -47 | 173.6 | -171 | -90.3 | 0 | 0 | 0 | 111.7 | L217 W232 H274 D275 L280 T281 L282 | L217-F278 HydrophobicContact CD1-CZ 4.17Å; L217-F278 HydrophobicContact CD2-CE2 4.16Å; L217-F278 HydrophobicContact CD2-CZ 3.99Å; W232-F278 HydrophobicContact CE3-CD1 4.1Å; W232-F278 AromaticContact CE3-CE1 3.69Å; W232-F278 HydrophobicContact CE3-CE1 3.69Å; W232-F278 HydrophobicContact CE3-CZ 4.2Å; W232-F278 HydrophobicContact CH2-CB 3.95Å; W232-F278 AromaticContact CH2-CD1 3.3Å; W232-F278 HydrophobicContact CH2-CD1 3.3Å; W232-F278 AromaticContact CH2-CD2 3.85Å; W232-F278 HydrophobicContact CH2-CD2 3.85Å; W232-F278 AromaticContact CH2-CE1 3.63Å; W232-F278 HydrophobicContact CH2-CE1 3.63Å; W232-F278 HydrophobicContact CH2-CE2 4.14Å; W232-F278 AromaticContact CH2-CG 3.4Å; W232-F278 HydrophobicContact CH2-CG 3.4Å; W232-F278 VanDerWaalsContact CH2-CG 3.4Å; W232-F278 HydrophobicContact CH2-CZ 4.03Å; W232-F278 HydrophobicContact CZ2-CD1 4.39Å; W232-F278 HydrophobicContact CZ2-CD2 4.32Å; W232-F278 HydrophobicContact CZ2-CE1 4.46Å; W232-F278 HydrophobicContact CZ2-CE2 4.41Å; W232-F278 HydrophobicContact CZ2-CG 4.31Å; W232-F278 HydrophobicContact CZ2-CZ 4.47Å; W232-F278 AromaticContact CZ3-CD1 3.12Å; W232-F278 HydrophobicContact CZ3-CD1 3.12Å; W232-F278 HydrophobicContact CZ3-CD2 4.42Å; W232-F278 AromaticContact CZ3-CE1 3.18Å; W232-F278 HydrophobicContact CZ3-CE1 3.18Å; W232-F278 HydrophobicContact CZ3-CE2 4.47Å; W232-F278 AromaticContact CZ3-CG 3.78Å; W232-F278 HydrophobicContact CZ3-CG 3.78Å; W232-F278 AromaticContact CZ3-CZ 3.91Å; W232-F278 HydrophobicContact CZ3-CZ 3.91Å; H274-F278 PolarHBondContact O-N 2.74Å; D275-F278 PolarHBondContact O-N 3.05Å; F278-L280 VanDerWaalsContact C-N 3.34Å; F278-L280 PolarHBondContact O-N 2.73Å; F278-T281 PolarHBondContact O-N 3.46Å; F278-T281 VanDerWaalsContact O-N 3.12Å; F278-L282 HydrophobicContact CD1-CD1 4.48Å; F278-L282 HydrophobicContact CE1-CD1 3.96Å; F278-L282 HydrophobicContact CZ-CD1 4.49Å; F278-L282 PolarHBondContact O-N 3.12Å |
| 279 | S | 42.3 | Very low | 43.7 | Very low | 81 Ų | 81 | 79.1 Ų | 79.1 | 57% | 0.566 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -64.5 | -36.5 | 179.6 | -155.1 | 0 | 0 | 0 | 0 | 112.1 | D275 T281 L282 P283 | D275-S279 WeakPolarHBondContact O-CB 3.3Å; D275-S279 PolarHBondContact O-N 3.14Å; S279-T281 VanDerWaalsContact C-N 3.28Å; S279-T281 PolarHBondContact O-N 3.38Å; S279-L282 WeakPolarHBondContact O-CB 3.15Å; S279-L282 PolarHBondContact O-N 3.35Å; S279-P283 WeakPolarHBondContact O-CD 3.15Å |
| 280 | L | 38.2 | Very low | 42.6 | Very low | 134 Ų | 134 | 89.4 Ų | 89.4 | 70% | 0.702 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -71.5 | -19.3 | 176 | -155.2 | 95 | 0 | 0 | 0 | 113.4 | S276 F278 L282 P283 | S276-L280 WeakPolarHBondContact O-CB 3.05Å; S276-L280 PolarHBondContact O-N 2.83Å; F278-L280 VanDerWaalsContact C-N 3.34Å; F278-L280 PolarHBondContact O-N 2.73Å; L280-L282 VanDerWaalsContact C-N 3.34Å; L280-P283 WeakPolarHBondContact O-CD 3.36Å; L280-P283 WeakPolarHBondContact O-CG 3.23Å |
| 281 | T | 42.9 | Very low | 41.6 | Very low | 59 Ų | 59 | 91.2 Ų | 91.2 | 36% | 0.362 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -80.5 | -20.4 | 173.9 | -42.8 | 0 | 0 | 0 | 0 | 111.5 | K277 F278 S279 | K277-T281 PolarHBondContact O-N 3.39Å; K277-T281 PolarHBondContact O-OG1 2.74Å; F278-T281 PolarHBondContact O-N 3.46Å; F278-T281 VanDerWaalsContact O-N 3.12Å; S279-T281 VanDerWaalsContact C-N 3.28Å; S279-T281 PolarHBondContact O-N 3.38Å |
| 282 | L | 39.2 | Very low | 40.3 | Very low | 50 Ų | 50 | 95.6 Ų | 95.6 | 26% | 0.262 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -72.2 | -37.8 | 179.9 | -126.2 | 87.5 | 0 | 0 | 0 | 115.9 | M229 F278 S279 L280 C284 L285 T286 | M229-L282 HydrophobicContact CE-CD1 4.16Å; M229-L282 HydrophobicContact CE-CD2 3.97Å; M229-L282 HydrophobicContact CE-CG 4.39Å; M229-L282 HydrophobicContact SD-CD1 4.4Å; F278-L282 HydrophobicContact CD1-CD1 4.48Å; F278-L282 HydrophobicContact CE1-CD1 3.96Å; F278-L282 HydrophobicContact CZ-CD1 4.49Å; F278-L282 PolarHBondContact O-N 3.12Å; S279-L282 WeakPolarHBondContact O-CB 3.15Å; S279-L282 PolarHBondContact O-N 3.35Å; L280-L282 VanDerWaalsContact C-N 3.34Å; L282-C284 VanDerWaalsContact C-N 3.27Å; L282-C284 PolarHBondContact O-N 3.43Å; L282-L285 PolarHBondContact O-N 3.31Å; L282-T286 PolarHBondContact O-N 3.45Å; L282-T286 PolarHBondContact O-OG1 3.22Å |
| 283 | P | 34.1 | Very low | 39.2 | Very low | 63 Ų | 63 | 101.3 Ų | 101.3 | 41% | 0.409 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -67.1 | -27.6 | 175 | 22.7 | -31.4 | 0 | 0 | 0 | 112.4 | S279 L280 T286 V287 | S279-P283 WeakPolarHBondContact O-CD 3.15Å; L280-P283 WeakPolarHBondContact O-CD 3.36Å; L280-P283 WeakPolarHBondContact O-CG 3.23Å; P283-T286 WeakPolarHBondContact CA-OG1 3.31Å; P283-T286 PolarHBondContact O-N 3.2Å; P283-T286 PolarHBondContact O-OG1 3.34Å; P283-V287 WeakPolarHBondContact O-CB 3.11Å; P283-V287 WeakPolarHBondContact O-CG2 3.49Å; P283-V287 PolarHBondContact O-N 3.43Å |
| 284 | C | 33.4 | Very low | 38.2 | Very low | 93 Ų | 93 | 101.3 Ų | 101.3 | 63% | 0.628 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -68.4 | -34.4 | 173.9 | -71.6 | 0 | 0 | 0 | 0 | 112.5 | L282 D288 | L282-C284 VanDerWaalsContact C-N 3.27Å; L282-C284 PolarHBondContact O-N 3.43Å; C284-D288 PolarHBondContact O-N 3.34Å |
| 285 | L | 34.4 | Very low | 37.4 | Very low | 144 Ų | 144 | 102 Ų | 102 | 75% | 0.754 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -78 | -18.2 | 176.7 | -103 | 147.4 | 0 | 0 | 0 | 113.9 | L282 | L282-L285 PolarHBondContact O-N 3.31Å |
| 286 | T | 35.7 | Very low | 36.5 | Very low | 110 Ų | 110 | 107.1 Ų | 107.1 | 68% | 0.675 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -100 | -19.3 | 177.6 | 45.9 | 0 | 0 | 0 | 0 | 114 | L282 P283 | L282-T286 PolarHBondContact O-N 3.45Å; L282-T286 PolarHBondContact O-OG1 3.22Å; P283-T286 WeakPolarHBondContact CA-OG1 3.31Å; P283-T286 PolarHBondContact O-N 3.2Å; P283-T286 PolarHBondContact O-OG1 3.34Å |
| 287 | V | 38.2 | Very low | 35.7 | Very low | 109 Ų | 109 | 109 Ų | 109 | 66% | 0.661 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -100 | -24.3 | -179 | -177.1 | 0 | 0 | 0 | 0 | 114.1 | P283 C289 | P283-V287 WeakPolarHBondContact O-CB 3.11Å; P283-V287 WeakPolarHBondContact O-CG2 3.49Å; P283-V287 PolarHBondContact O-N 3.43Å; V287-C289 PolarHBondContact O-N 3.42Å |
| 288 | D | 27.9 | Very low | 34.9 | Very low | 104 Ų | 104 | 108.8 Ų | 108.8 | 56% | 0.556 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.3 | 70.9 | 176.1 | -93.5 | -38.4 | 0 | 0 | 0 | 113.6 | C284 S291 | C284-D288 PolarHBondContact O-N 3.34Å; D288-S291 PolarHBondContact OD1-OG 3.21Å |
| 289 | C | 29.5 | Very low | 34.1 | Very low | 127 Ų | 127 | 116.5 Ų | 116.5 | 86% | 0.858 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -136.1 | 19.1 | 151.5 | -97.3 | 0 | 0 | 0 | 0 | 113 | V287 | V287-C289 PolarHBondContact O-N 3.42Š|
| 290 | R | 30.5 | Very low | 33.8 | Very low | 237 Ų | 237 | 117.7 Ų | 117.7 | 89% | 0.894 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -118.7 | -3.6 | 172.3 | -120.8 | -178.7 | -154.5 | -163.4 | 5.8 | 116 | ||
| 291 | S | 35.2 | Very low | 33.4 | Very low | 79 Ų | 79 | 118.5 Ų | 118.5 | 55% | 0.552 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -100.2 | -11.1 | -175.2 | 69.4 | 0 | 0 | 0 | 0 | 115.6 | D288 | D288-S291 PolarHBondContact OD1-OG 3.21Š|
| 292 | T | 31.5 | Very low | 33 | Very low | 122 Ų | 122 | 123.9 Ų | 123.9 | 75% | 0.748 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -118.4 | 21.2 | -174.9 | 10.4 | 0 | 0 | 0 | 0 | 116.5 | ||
| 293 | Q | 31.1 | Very low | 32.7 | Very low | 184 Ų | 184 | 130.2 Ų | 130.2 | 86% | 0.86 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -117.8 | 21.7 | 169.7 | -74.3 | -120.8 | -19.4 | 0 | 0 | 114.4 | ||
| 294 | V | 32.1 | Very low | 32.6 | Very low | 140 Ų | 140 | 130.8 Ų | 130.8 | 85% | 0.848 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -124.3 | 51.3 | 168.9 | -164.1 | 0 | 0 | 0 | 0 | 111 | ||
| 295 | A | 34 | Very low | 32.5 | Very low | 91 Ų | 91 | 137.4 Ų | 137.4 | 75% | 0.752 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -133.6 | -2.8 | 166.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 296 | T | 34.2 | Very low | 33.1 | Very low | 136 Ų | 136 | 141 Ų | 141 | 83% | 0.834 | 80% | 0.796 | S | S | * | * | S | Bend | trans | -138.5 | 54.3 | -179 | 47.8 | 0 | 0 | 0 | 0 | 112.4 | ||
| 297 | A | 32.4 | Very low | 33.4 | Very low | 109 Ų | 109 | 148.9 Ų | 148.9 | 90% | 0.901 | 82% | 0.821 | S | S | * | * | trans | -134.9 | 56.7 | 160.4 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 298 | G | 28.1 | Very low | 33.2 | Very low | 71 Ų | 71 | 150.9 Ų | 150.9 | 73% | 0.732 | 83% | 0.829 | S | S | * | * | trans | -151.8 | 52 | -171.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 299 | K | 30.2 | Very low | 33.5 | Very low | 204 Ų | 204 | 153.4 Ų | 153.4 | 89% | 0.887 | 84% | 0.843 | S | S | * | * | trans | -167.9 | 122.9 | 136.7 | -114.2 | 171.6 | -177.2 | 178 | 0 | 112.3 | ||||
| 300 | P | 36 | Very low | 33.7 | Very low | 105 Ų | 105 | 154.8 Ų | 154.8 | 68% | 0.682 | 84% | 0.843 | S | S | * | * | trans | -90.7 | 162.6 | 178.7 | 37.3 | -33.3 | 0 | 0 | 0 | 111.8 | ||||
| 301 | N | 30.5 | Very low | 33.9 | Very low | 151 Ų | 151 | 150 Ų | 150 | 81% | 0.807 | 84% | 0.839 | S | S | * | * | trans | 63.7 | 100.7 | 152.4 | -61.7 | -25.4 | 0 | 0 | 0 | 118.4 | ||||
| 302 | L | 35.4 | Very low | 33.8 | Very low | 173 Ų | 173 | 154.4 Ų | 154.4 | 91% | 0.906 | 86% | 0.857 | S | S | * | * | trans | -154.8 | 52.1 | 147.9 | -108.6 | 161 | 0 | 0 | 0 | 110.6 | ||||
| 303 | L | 33.3 | Very low | 33.9 | Very low | 183 Ų | 183 | 156.6 Ų | 156.6 | 96% | 0.958 | 87% | 0.865 | S | S | * | * | S | Bend | trans | -147.9 | 89.4 | 165.8 | -111 | 119.1 | 0 | 0 | 0 | 109 | ||
| 304 | G | 31 | Very low | 34.2 | Very low | 74 Ų | 74 | 154.6 Ų | 154.6 | 76% | 0.763 | 87% | 0.865 | S | S | * | * | S | Bend | trans | 152.7 | 63.1 | 172.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 305 | R | 31.3 | Very low | 34.3 | Very low | 233 Ų | 233 | 155.8 Ų | 155.8 | 88% | 0.879 | 87% | 0.866 | S | S | * | * | trans | 179.8 | 88.9 | 148.8 | -106 | -177 | -160.5 | -165.7 | 5.7 | 109.9 | ||||
| 306 | F | 46.8 | Very low | 34.3 | Very low | 218 Ų | 218 | 161.2 Ų | 161.2 | 96% | 0.956 | 88% | 0.876 | S | S | * | * | trans | -151.1 | 87.1 | 139.3 | -87.5 | -70.3 | 0 | 0 | 0 | 105.7 | ||||
| 307 | K | 42.9 | Very low | 34.3 | Very low | 277 Ų | 277 | 163.5 Ų | 163.5 | 100% | 1.204 | 88% | 0.88 | S | S | * | * | trans | -79.4 | 0 | 141.6 | -88.9 | -174 | 173.8 | -177 | 0 | 106.5 |
Retrieved 307 of 307 residues in 112.4 ms
(Link to these results)