| 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 | 46.4 | Very low | 52.4 | Low | 233 Ų | 233 | 119 Ų | 119 | 100% | 1.148 | 61% | 0.61 | S | S | * | * | 0 | -7.2 | 0 | -92.7 | 175.3 | 165.3 | 0 | 0 | 114.3 | |||||
| 2 | Y | 42.3 | Very low | 53.1 | Low | 203 Ų | 203 | 115.8 Ų | 115.8 | 80% | 0.796 | 61% | 0.607 | S | S | * | * | trans | -91.6 | -3.8 | -173.7 | -72 | -78.3 | 0 | 0 | 0 | 116.9 | ||||
| 3 | D | 45.6 | Very low | 54.3 | Low | 152 Ų | 152 | 115.5 Ų | 115.5 | 81% | 0.813 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -77.4 | -31.2 | -168 | -115.4 | -16.2 | 0 | 0 | 0 | 114.9 | ||
| 4 | K | 47.7 | Very low | 55.3 | Low | 182 Ų | 182 | 114.9 Ų | 114.9 | 79% | 0.791 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -94.8 | -15.4 | -167.7 | -63.4 | -171.9 | -179.5 | -178.7 | 0 | 115.2 | P8 | K4-P8 WeakPolarHBondContact O-CD 3.29Å; K4-P8 WeakPolarHBondContact O-CG 3.14Å |
| 5 | V | 49.1 | Very low | 56.2 | Low | 102 Ų | 102 | 108.9 Ų | 108.9 | 62% | 0.618 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -91.7 | -31.5 | -176 | -174.5 | 0 | 0 | 0 | 0 | 111.7 | P8 V9 | V5-P8 WeakPolarHBondContact O-CD 3.08Å; V5-V9 WeakPolarHBondContact O-CG2 3.47Å; V5-V9 PolarHBondContact O-N 2.89Å |
| 6 | I | 49.2 | Very low | 57.3 | Low | 101 Ų | 101 | 105 Ų | 105 | 52% | 0.518 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -71.5 | -39 | -179 | -62.8 | 173.3 | 0 | 0 | 0 | 110.7 | V9 V10 | I6-V9 PolarHBondContact O-N 2.81Å; I6-V10 HydrophobicContact CG2-CG2 3.5Å; I6-V10 VanDerWaalsContact CG2-CG2 3.5Å; I6-V10 VanDerWaalsContact O-CB 3.28Å; I6-V10 WeakPolarHBondContact O-CB 3.43Å; I6-V10 VanDerWaalsContact O-CG2 3.26Å; I6-V10 WeakPolarHBondContact O-CG2 3.41Å; I6-V10 PolarHBondContact O-N 2.82Å |
| 7 | A | 57.9 | Low | 58.2 | Low | 39 Ų | 39 | 105.8 Ų | 105.8 | 32% | 0.322 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -58.6 | -49.1 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | V9 F11 | A7-V9 PolarHBondContact O-N 3.17Å; A7-F11 WeakPolarHBondContact O-CB 3.46Å; A7-F11 PolarHBondContact O-N 3.04Å |
| 8 | P | 53 | Low | 59.2 | Low | 75 Ų | 75 | 103.8 Ų | 103.8 | 49% | 0.487 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -60.2 | -44.5 | 173.3 | -24.7 | 33 | 0 | 0 | 0 | 113.7 | K4 V5 F11 S12 | K4-P8 WeakPolarHBondContact O-CD 3.29Å; K4-P8 WeakPolarHBondContact O-CG 3.14Å; V5-P8 WeakPolarHBondContact O-CD 3.08Å; P8-F11 PolarHBondContact O-N 3.14Å; P8-S12 PolarHBondContact O-N 2.99Å; P8-S12 PolarHBondContact O-OG 2.81Å; P8-S12 VanDerWaalsContact O-OG 3.09Å |
| 9 | V | 59.7 | Low | 60 | Low | 86 Ų | 86 | 102.1 Ų | 102.1 | 52% | 0.521 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -64.3 | -49.4 | -178.3 | 175 | 0 | 0 | 0 | 0 | 110.7 | V5 I6 A7 F11 S12 L13 | V5-V9 WeakPolarHBondContact O-CG2 3.47Å; V5-V9 PolarHBondContact O-N 2.89Å; I6-V9 PolarHBondContact O-N 2.81Å; A7-V9 PolarHBondContact O-N 3.17Å; V9-F11 VanDerWaalsContact C-N 3.31Å; V9-F11 PolarHBondContact O-N 3.31Å; V9-S12 PolarHBondContact O-N 3.41Å; V9-L13 WeakPolarHBondContact O-CG 2.97Å; V9-L13 PolarHBondContact O-N 2.89Å; V9-L13 VanDerWaalsContact O-N 3.13Å |
| 10 | V | 61.4 | Low | 60.7 | Low | 62 Ų | 62 | 100.9 Ų | 100.9 | 38% | 0.376 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -59.4 | -46.6 | 176.3 | 170.9 | 0 | 0 | 0 | 0 | 109.6 | I6 S12 L13 Y14 | I6-V10 HydrophobicContact CG2-CG2 3.5Å; I6-V10 VanDerWaalsContact CG2-CG2 3.5Å; I6-V10 VanDerWaalsContact O-CB 3.28Å; I6-V10 WeakPolarHBondContact O-CB 3.43Å; I6-V10 VanDerWaalsContact O-CG2 3.26Å; I6-V10 WeakPolarHBondContact O-CG2 3.41Å; I6-V10 PolarHBondContact O-N 2.82Å; V10-S12 VanDerWaalsContact C-N 3.35Å; V10-S12 PolarHBondContact O-N 2.83Å; V10-L13 WeakPolarHBondContact O-CB 3.38Å; V10-L13 PolarHBondContact O-N 3.49Å; V10-Y14 HydrophobicContact CG1-CD2 3.83Å; V10-Y14 HydrophobicContact CG1-CE2 3.81Å; V10-Y14 WeakPolarHBondContact O-CD2 3.19Å; V10-Y14 PolarHBondContact O-N 3.3Å |
| 11 | F | 64.1 | Low | 61.5 | Low | 74 Ų | 74 | 101.1 Ų | 101.1 | 33% | 0.325 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -57.7 | -45.6 | 178.6 | -170.5 | -90.3 | 0 | 0 | 0 | 112 | A7 P8 V9 L13 Y14 F15 F27 | A7-F11 WeakPolarHBondContact O-CB 3.46Å; A7-F11 PolarHBondContact O-N 3.04Å; P8-F11 PolarHBondContact O-N 3.14Å; V9-F11 VanDerWaalsContact C-N 3.31Å; V9-F11 PolarHBondContact O-N 3.31Å; F11-L13 VanDerWaalsContact C-N 3.26Å; F11-L13 PolarHBondContact O-N 3.2Å; F11-Y14 PolarHBondContact O-N 3.34Å; F11-F15 HydrophobicContact CD1-CB 4.23Å; F11-F15 HydrophobicContact CD1-CD2 4.46Å; F11-F15 AromaticContact CD2-CD2 3.68Å; F11-F15 HydrophobicContact CD2-CD2 3.68Å; F11-F15 HydrophobicContact CD2-CE2 4.03Å; F11-F15 HydrophobicContact CD2-CG 4.37Å; F11-F15 HydrophobicContact CE1-CB 3.88Å; F11-F15 HydrophobicContact CE1-CD2 4.46Å; F11-F15 HydrophobicContact CE1-CG 4.29Å; F11-F15 HydrophobicContact CE2-CB 4.48Å; F11-F15 AromaticContact CE2-CD2 3.68Å; F11-F15 HydrophobicContact CE2-CD2 3.68Å; F11-F15 AromaticContact CE2-CE2 3.99Å; F11-F15 HydrophobicContact CE2-CE2 3.99Å; F11-F15 HydrophobicContact CE2-CG 4Å; F11-F15 HydrophobicContact CG-CD2 4.09Å; F11-F15 HydrophobicContact CZ-CB 4.03Å; F11-F15 HydrophobicContact CZ-CD2 4.1Å; F11-F15 AromaticContact CZ-CG 3.97Å; F11-F15 HydrophobicContact CZ-CG 3.97Å; F11-F15 WeakPolarHBondContact O-CB 3.45Å; F11-F15 WeakPolarHBondContact O-CD2 3.49Å; F11-F15 PolarHBondContact O-N 3.15Å; F11-F27 AromaticContact CE1-CD1 3.33Å; F11-F27 HydrophobicContact CE1-CD1 3.33Å; F11-F27 AromaticContact CE1-CE1 3.34Å; F11-F27 HydrophobicContact CE1-CE1 3.34Å; F11-F27 HydrophobicContact CE1-CG 4.26Å; F11-F27 HydrophobicContact CE1-CZ 4.29Å; F11-F27 HydrophobicContact CZ-CB 4.32Å; F11-F27 AromaticContact CZ-CD1 3.25Å; F11-F27 HydrophobicContact CZ-CD1 3.25Å; F11-F27 HydrophobicContact CZ-CD2 4.37Å; F11-F27 AromaticContact CZ-CE1 3.48Å; F11-F27 HydrophobicContact CZ-CE1 3.48Å; F11-F27 VanDerWaalsContact CZ-CE1 3.48Å; F11-F27 AromaticContact CZ-CG 3.72Å; F11-F27 HydrophobicContact CZ-CG 3.72Å; F11-F27 HydrophobicContact CZ-CZ 4.14Å |
| 12 | S | 61.2 | Low | 62.7 | Low | 81 Ų | 81 | 97.1 Ų | 97.1 | 57% | 0.566 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65 | -23.9 | 175.8 | -60 | 0 | 0 | 0 | 0 | 114.5 | P8 V9 V10 | P8-S12 PolarHBondContact O-N 2.99Å; P8-S12 PolarHBondContact O-OG 2.81Å; P8-S12 VanDerWaalsContact O-OG 3.09Å; V9-S12 PolarHBondContact O-N 3.41Å; V10-S12 VanDerWaalsContact C-N 3.35Å; V10-S12 PolarHBondContact O-N 2.83Å |
| 13 | L | 68.3 | Low | 64.1 | Low | 111 Ų | 111 | 92.1 Ų | 92.1 | 58% | 0.581 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -71.5 | -42 | 174.8 | -69.3 | 171.9 | 0 | 0 | 0 | 111.2 | V9 V10 F11 | V9-L13 WeakPolarHBondContact O-CG 2.97Å; V9-L13 PolarHBondContact O-N 2.89Å; V9-L13 VanDerWaalsContact O-N 3.13Å; V10-L13 WeakPolarHBondContact O-CB 3.38Å; V10-L13 PolarHBondContact O-N 3.49Å; F11-L13 VanDerWaalsContact C-N 3.26Å; F11-L13 PolarHBondContact O-N 3.2Å |
| 14 | Y | 68 | Low | 65.2 | Low | 108 Ų | 108 | 86.8 Ų | 86.8 | 42% | 0.424 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -89 | -28.7 | -175.6 | -69.3 | -78.7 | 0 | 0 | 0 | 113.6 | V10 F11 N29 K30 | V10-Y14 HydrophobicContact CG1-CD2 3.83Å; V10-Y14 HydrophobicContact CG1-CE2 3.81Å; V10-Y14 WeakPolarHBondContact O-CD2 3.19Å; V10-Y14 PolarHBondContact O-N 3.3Å; F11-Y14 PolarHBondContact O-N 3.34Å; Y14-N29 CarbonylContact O-C 3.5Å; Y14-N29 VanDerWaalsContact O-CA 3.31Å; Y14-N29 WeakPolarHBondContact O-CA 3.37Å; Y14-K30 PolarHBondContact O-N 2.92Å |
| 15 | F | 68.4 | Low | 66.2 | Low | 25 Ų | 25 | 78.3 Ų | 78.3 | 11% | 0.11 | 44% | 0.443 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.9 | 135.1 | -171 | -62.4 | -91.8 | 0 | 0 | 0 | 113.4 | F11 F27 E28 N29 A54 | F11-F15 HydrophobicContact CD1-CB 4.23Å; F11-F15 HydrophobicContact CD1-CD2 4.46Å; F11-F15 AromaticContact CD2-CD2 3.68Å; F11-F15 HydrophobicContact CD2-CD2 3.68Å; F11-F15 HydrophobicContact CD2-CE2 4.03Å; F11-F15 HydrophobicContact CD2-CG 4.37Å; F11-F15 HydrophobicContact CE1-CB 3.88Å; F11-F15 HydrophobicContact CE1-CD2 4.46Å; F11-F15 HydrophobicContact CE1-CG 4.29Å; F11-F15 HydrophobicContact CE2-CB 4.48Å; F11-F15 AromaticContact CE2-CD2 3.68Å; F11-F15 HydrophobicContact CE2-CD2 3.68Å; F11-F15 AromaticContact CE2-CE2 3.99Å; F11-F15 HydrophobicContact CE2-CE2 3.99Å; F11-F15 HydrophobicContact CE2-CG 4Å; F11-F15 HydrophobicContact CG-CD2 4.09Å; F11-F15 HydrophobicContact CZ-CB 4.03Å; F11-F15 HydrophobicContact CZ-CD2 4.1Å; F11-F15 AromaticContact CZ-CG 3.97Å; F11-F15 HydrophobicContact CZ-CG 3.97Å; F11-F15 WeakPolarHBondContact O-CB 3.45Å; F11-F15 WeakPolarHBondContact O-CD2 3.49Å; F11-F15 PolarHBondContact O-N 3.15Å; F15-F27 HydrophobicContact CD1-CB 3.9Å; F15-E28 CarbonylContact C-O 3.5Å; F15-E28 VanDerWaalsContact CA-O 3.22Å; F15-E28 WeakPolarHBondContact CA-O 3.39Å; F15-N29 HydrophobicContact CD1-CB 3.92Å; F15-N29 HydrophobicContact CE1-CB 3.64Å; F15-N29 HydrophobicContact CZ-CB 4.27Å; F15-N29 WeakPolarHBondContact CZ-ND2 3.37Å; F15-A54 HydrophobicContact CE2-CB 4.14Å; F15-A54 HydrophobicContact CZ-CB 4.07Å |
| 16 | S | 74.1 | Confident | 67 | Low | 46 Ų | 46 | 75 Ų | 75 | 32% | 0.322 | 42% | 0.421 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.9 | 139.9 | 163.1 | -62 | 0 | 0 | 0 | 0 | 109.3 | F27 E28 K30 | S16-F27 CarbonylContact O-C 3.57Å; S16-F27 WeakPolarHBondContact O-CA 3.39Å; S16-E28 PolarHBondContact N-O 3.19Å; S16-E28 PolarHBondContact O-N 2.69Å; S16-K30 WeakPolarHBondContact OG-CE 3.41Å |
| 17 | M | 73.1 | Confident | 68 | Low | 119 Ų | 119 | 70.7 Ų | 70.7 | 59% | 0.586 | 40% | 0.399 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -111.9 | 117.6 | -178.1 | -169.4 | -179.6 | 72.8 | 0 | 0 | 110.5 | I25 I26 F27 | M17-I25 HydrophobicContact CG-CG2 3.16Å; M17-I25 HydrophobicContact SD-CD1 4.19Å; M17-I25 HydrophobicContact SD-CG2 3.73Å; M17-I26 WeakPolarHBondContact CA-O 3.4Å; M17-F27 HydrophobicContact CB-CD1 4.25Å; M17-F27 HydrophobicContact CB-CE1 4.15Å; M17-F27 HydrophobicContact CG-CD1 4.07Å; M17-F27 HydrophobicContact CG-CE1 3.65Å; M17-F27 HydrophobicContact CG-CZ 4.31Å; M17-F27 HydrophobicContact SD-CE1 3.71Å; M17-F27 HydrophobicContact SD-CZ 4.11Å |
| 18 | T | 76.6 | Confident | 68.2 | Low | 70 Ų | 70 | 73.3 Ų | 73.3 | 43% | 0.429 | 40% | 0.404 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.6 | 119.7 | 176.6 | -59.3 | 0 | 0 | 0 | 0 | 109.9 | I26 | T18-I26 PolarHBondContact N-O 2.9Å; T18-I26 PolarHBondContact O-N 2.8Å |
| 19 | S | 73.7 | Confident | 68.6 | Low | 70 Ų | 70 | 70.7 Ų | 70.7 | 49% | 0.49 | 39% | 0.387 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82 | 120.1 | 172.7 | -168.6 | 0 | 0 | 0 | 0 | 108.9 | R39 | S19-R39 PolarHBondContact OG-NH1 3.41Å |
| 20 | V | 75.1 | Confident | 68.8 | Low | 79 Ų | 79 | 72.7 Ų | 72.7 | 48% | 0.479 | 39% | 0.388 | S | S | . | . | trans | -93.6 | -45 | 177.8 | -179.2 | 0 | 0 | 0 | 0 | 110.2 | V24 I26 | V20-V24 HydrophobicContact CB-CG1 4.45Å; V20-V24 PolarHBondContact N-O 3.05Å; V20-V24 VanDerWaalsContact N-O 3.15Å; V20-I26 HydrophobicContact CG2-CD1 3.55Å; V20-I26 HydrophobicContact CG2-CG1 3.83Å | ||
| 21 | D | 76.1 | Confident | 69.3 | Low | 106 Ų | 106 | 76.5 Ų | 76.5 | 57% | 0.567 | 40% | 0.402 | S | S | * | . | S | Bend | trans | -143.7 | 177.9 | -179.2 | -74.5 | -46.9 | 0 | 0 | 0 | 111.2 | N23 V24 | D21-N23 PolarHBondContact O-N 2.8Å; D21-V24 PolarHBondContact O-N 3.3Å |
| 22 | N | 73 | Confident | 69.2 | Low | 149 Ų | 149 | 77.5 Ų | 77.5 | 80% | 0.797 | 41% | 0.41 | S | S | * | . | S | Bend | trans | -57.7 | -19.5 | 176.4 | -76.7 | -18 | 0 | 0 | 0 | 114.1 | R39 | N22-R39 WeakPolarHBondContact O-CD 3.39Š|
| 23 | N | 69.8 | Low | 69.3 | Low | 97 Ų | 97 | 75.8 Ų | 75.8 | 52% | 0.519 | 41% | 0.405 | S | S | . | . | S | Bend | trans | -114.9 | -13.7 | -176.5 | -62.7 | -28.8 | 0 | 0 | 0 | 113.9 | D21 R39 | D21-N23 PolarHBondContact O-N 2.8Å; N23-R39 WeakPolarHBondContact O-CB 3.41Å; N23-R39 WeakPolarHBondContact O-CG 3.21Å; N23-R39 PolarHBondContact O-N 2.79Å |
| 24 | V | 70 | Confident | 69 | Low | 40 Ų | 40 | 72.7 Ų | 72.7 | 24% | 0.242 | 40% | 0.4 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.3 | 126.7 | -168.5 | -177.2 | 0 | 0 | 0 | 0 | 110.9 | V20 D21 I36 | V20-V24 HydrophobicContact CB-CG1 4.45Å; V20-V24 PolarHBondContact N-O 3.05Å; V20-V24 VanDerWaalsContact N-O 3.15Å; D21-V24 PolarHBondContact O-N 3.3Å; V24-I36 HydrophobicContact CG1-CG2 3.66Å |
| 25 | I | 67.2 | Low | 68.8 | Low | 4 Ų | 4 | 71.2 Ų | 71.2 | 2% | 0.021 | 40% | 0.397 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.1 | 127.8 | 170 | -69.9 | 176.3 | 0 | 0 | 0 | 108.3 | M17 F27 V37 R39 L42 | M17-I25 HydrophobicContact CG-CG2 3.16Å; M17-I25 HydrophobicContact SD-CD1 4.19Å; M17-I25 HydrophobicContact SD-CG2 3.73Å; I25-F27 HydrophobicContact CG2-CD2 4.45Å; I25-F27 HydrophobicContact CG2-CE1 4.14Å; I25-F27 HydrophobicContact CG2-CE2 3.98Å; I25-F27 HydrophobicContact CG2-CZ 3.82Å; I25-V37 CarbonylContact C-O 3.57Å; I25-V37 PolarHBondContact N-O 2.89Å; I25-V37 VanDerWaalsContact N-O 3.14Å; I25-V37 CarbonylContact O-C 3.59Å; I25-V37 PolarHBondContact O-N 2.82Å; I25-R39 HydrophobicContact CB-CG 4.3Å; I25-R39 HydrophobicContact CD1-CG 3.56Å; I25-R39 HydrophobicContact CG1-CG 3.53Å; I25-L42 HydrophobicContact CD1-CD2 3.89Å |
| 26 | I | 67.6 | Low | 68.4 | Low | 33 Ų | 33 | 76 Ų | 76 | 17% | 0.169 | 42% | 0.422 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.3 | 129.2 | 173.8 | -53.5 | -176.8 | 0 | 0 | 0 | 108.6 | M17 T18 V20 E28 I36 | M17-I26 WeakPolarHBondContact CA-O 3.4Å; T18-I26 PolarHBondContact N-O 2.9Å; T18-I26 PolarHBondContact O-N 2.8Å; V20-I26 HydrophobicContact CG2-CD1 3.55Å; V20-I26 HydrophobicContact CG2-CG1 3.83Å; I26-E28 HydrophobicContact CG2-CG 3.86Å; I26-I36 HydrophobicContact CD1-CD1 4.5Å; I26-I36 HydrophobicContact CD1-CG1 4.17Å; I26-I36 HydrophobicContact CG1-CG1 4.04Å; I26-I36 HydrophobicContact CG1-CG2 4.29Å; I26-I36 HydrophobicContact CG2-CG1 4.31Å |
| 27 | F | 68.8 | Low | 67.7 | Low | 10 Ų | 10 | 74.1 Ų | 74.1 | 4% | 0.044 | 41% | 0.409 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.6 | 105.5 | 168 | -66 | -72.6 | 0 | 0 | 0 | 109.4 | F11 F15 S16 M17 I25 G34 E35 V37 L42 | F11-F27 AromaticContact CE1-CD1 3.33Å; F11-F27 HydrophobicContact CE1-CD1 3.33Å; F11-F27 AromaticContact CE1-CE1 3.34Å; F11-F27 HydrophobicContact CE1-CE1 3.34Å; F11-F27 HydrophobicContact CE1-CG 4.26Å; F11-F27 HydrophobicContact CE1-CZ 4.29Å; F11-F27 HydrophobicContact CZ-CB 4.32Å; F11-F27 AromaticContact CZ-CD1 3.25Å; F11-F27 HydrophobicContact CZ-CD1 3.25Å; F11-F27 HydrophobicContact CZ-CD2 4.37Å; F11-F27 AromaticContact CZ-CE1 3.48Å; F11-F27 HydrophobicContact CZ-CE1 3.48Å; F11-F27 VanDerWaalsContact CZ-CE1 3.48Å; F11-F27 AromaticContact CZ-CG 3.72Å; F11-F27 HydrophobicContact CZ-CG 3.72Å; F11-F27 HydrophobicContact CZ-CZ 4.14Å; F15-F27 HydrophobicContact CD1-CB 3.9Å; S16-F27 CarbonylContact O-C 3.57Å; S16-F27 WeakPolarHBondContact O-CA 3.39Å; M17-F27 HydrophobicContact CB-CD1 4.25Å; M17-F27 HydrophobicContact CB-CE1 4.15Å; M17-F27 HydrophobicContact CG-CD1 4.07Å; M17-F27 HydrophobicContact CG-CE1 3.65Å; M17-F27 HydrophobicContact CG-CZ 4.31Å; M17-F27 HydrophobicContact SD-CE1 3.71Å; M17-F27 HydrophobicContact SD-CZ 4.11Å; I25-F27 HydrophobicContact CG2-CD2 4.45Å; I25-F27 HydrophobicContact CG2-CE1 4.14Å; I25-F27 HydrophobicContact CG2-CE2 3.98Å; I25-F27 HydrophobicContact CG2-CZ 3.82Å; F27-G34 CarbonylContact O-C 3.55Å; F27-G34 WeakPolarHBondContact O-CA 3.45Å; F27-E35 PolarHBondContact N-O 3.04Å; F27-E35 PolarHBondContact O-N 2.99Å; F27-V37 HydrophobicContact CD2-CB 3.64Å; F27-V37 HydrophobicContact CD2-CG1 4.42Å; F27-V37 HydrophobicContact CD2-CG2 3.58Å; F27-V37 HydrophobicContact CE2-CB 3.75Å; F27-V37 HydrophobicContact CE2-CG1 4.12Å; F27-V37 HydrophobicContact CE2-CG2 4.12Å; F27-L42 HydrophobicContact CE1-CD1 4.44Å; F27-L42 HydrophobicContact CE2-CD1 3.72Å; F27-L42 HydrophobicContact CE2-CD2 4.23Å; F27-L42 HydrophobicContact CE2-CG 4.45Å; F27-L42 HydrophobicContact CZ-CD1 3.36Å; F27-L42 HydrophobicContact CZ-CD2 3.61Å; F27-L42 HydrophobicContact CZ-CG 4.06Å |
| 28 | E | 62.8 | Low | 67 | Low | 94 Ų | 94 | 71 Ų | 71 | 44% | 0.439 | 40% | 0.395 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.3 | 111.1 | 176.6 | -65.4 | -171.1 | 157.8 | 0 | 0 | 111 | F15 S16 I26 K30 | F15-E28 CarbonylContact C-O 3.5Å; F15-E28 VanDerWaalsContact CA-O 3.22Å; F15-E28 WeakPolarHBondContact CA-O 3.39Å; S16-E28 PolarHBondContact N-O 3.19Å; S16-E28 PolarHBondContact O-N 2.69Å; I26-E28 HydrophobicContact CG2-CG 3.86Å; E28-K30 PolarHBondContact O-N 2.83Å |
| 29 | N | 62.1 | Low | 66.1 | Low | 21 Ų | 21 | 70.7 Ų | 70.7 | 11% | 0.112 | 39% | 0.386 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.9 | 118.4 | 169.5 | -171.7 | -61.8 | 0 | 0 | 0 | 109.1 | Y14 F15 H31 L32 G33 | Y14-N29 CarbonylContact O-C 3.5Å; Y14-N29 VanDerWaalsContact O-CA 3.31Å; Y14-N29 WeakPolarHBondContact O-CA 3.37Å; F15-N29 HydrophobicContact CD1-CB 3.92Å; F15-N29 HydrophobicContact CE1-CB 3.64Å; F15-N29 HydrophobicContact CZ-CB 4.27Å; F15-N29 WeakPolarHBondContact CZ-ND2 3.37Å; N29-H31 PolarHBondContact O-N 2.95Å; N29-H31 PolarHBondContact OD1-N 2.86Å; N29-L32 HydrophobicContact CB-CB 4.34Å; N29-L32 PolarHBondContact O-N 3.11Å; N29-L32 PolarHBondContact OD1-N 3.03Å; N29-G33 WeakPolarHBondContact CA-O 3.23Å; N29-G33 VanDerWaalsContact CB-O 3.23Å; N29-G33 WeakPolarHBondContact CB-O 3.43Å; N29-G33 PolarHBondContact N-O 3.25Å; N29-G33 PolarHBondContact O-N 2.76Å |
| 30 | K | 64 | Low | 65.2 | Low | 127 Ų | 127 | 73 Ų | 73 | 55% | 0.552 | 39% | 0.393 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.9 | -16.6 | -175.3 | -66.6 | -179.9 | -176.1 | 165.4 | 0 | 114.3 | Y14 S16 E28 | Y14-K30 PolarHBondContact O-N 2.92Å; S16-K30 WeakPolarHBondContact OG-CE 3.41Å; E28-K30 PolarHBondContact O-N 2.83Å |
| 31 | H | 70.5 | Confident | 64 | Low | 143 Ų | 143 | 73.6 Ų | 73.6 | 66% | 0.662 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -107.6 | -18.6 | -177.2 | -60.4 | -72.5 | 0 | 0 | 0 | 113.8 | N29 | N29-H31 PolarHBondContact O-N 2.95Å; N29-H31 PolarHBondContact OD1-N 2.86Å |
| 32 | L | 62.7 | Low | 63 | Low | 94 Ų | 94 | 70.4 Ų | 70.4 | 49% | 0.492 | 37% | 0.373 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -135.2 | -5 | -165.4 | -64.7 | 163.3 | 0 | 0 | 0 | 114.9 | N29 Y57 | N29-L32 HydrophobicContact CB-CB 4.34Å; N29-L32 PolarHBondContact O-N 3.11Å; N29-L32 PolarHBondContact OD1-N 3.03Å; L32-Y57 HydrophobicContact CD1-CD1 3.08Å; L32-Y57 HydrophobicContact CD1-CD2 4.07Å; L32-Y57 HydrophobicContact CD1-CE1 3.37Å; L32-Y57 HydrophobicContact CD1-CE2 4.31Å; L32-Y57 HydrophobicContact CD1-CG 3.44Å; L32-Y57 VanDerWaalsContact CD1-CG 3.44Å; L32-Y57 HydrophobicContact CD2-CD1 3.99Å; L32-Y57 HydrophobicContact CD2-CE1 3.57Å; L32-Y57 HydrophobicContact CG-CD1 4.14Å; L32-Y57 HydrophobicContact CG-CE1 4.02Å |
| 33 | G | 62.4 | Low | 62 | Low | 45 Ų | 45 | 71.7 Ų | 71.7 | 46% | 0.464 | 37% | 0.368 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 98.7 | 179.4 | -174 | 0 | 0 | 0 | 0 | 0 | 112.6 | N29 | N29-G33 WeakPolarHBondContact CA-O 3.23Å; N29-G33 VanDerWaalsContact CB-O 3.23Å; N29-G33 WeakPolarHBondContact CB-O 3.43Å; N29-G33 PolarHBondContact N-O 3.25Å; N29-G33 PolarHBondContact O-N 2.76Å |
| 34 | G | 62.4 | Low | 61.2 | Low | 47 Ų | 47 | 68.5 Ų | 68.5 | 49% | 0.485 | 36% | 0.358 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.4 | 141.8 | -171.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | F27 | F27-G34 CarbonylContact O-C 3.55Å; F27-G34 WeakPolarHBondContact O-CA 3.45Å |
| 35 | E | 63.9 | Low | 60.4 | Low | 76 Ų | 76 | 72.2 Ų | 72.2 | 36% | 0.355 | 38% | 0.383 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.2 | 125.1 | 166.7 | -67.1 | -173.2 | -172.1 | 0 | 0 | 109 | F27 | F27-E35 PolarHBondContact N-O 3.04Å; F27-E35 PolarHBondContact O-N 2.99Å |
| 36 | I | 59.4 | Low | 59.7 | Low | 125 Ų | 125 | 76.5 Ų | 76.5 | 64% | 0.641 | 41% | 0.405 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -81.1 | 122.2 | 173.6 | -55.5 | 177.6 | 0 | 0 | 0 | 107.6 | V24 I26 | V24-I36 HydrophobicContact CG1-CG2 3.66Å; I26-I36 HydrophobicContact CD1-CD1 4.5Å; I26-I36 HydrophobicContact CD1-CG1 4.17Å; I26-I36 HydrophobicContact CG1-CG1 4.04Å; I26-I36 HydrophobicContact CG1-CG2 4.29Å; I26-I36 HydrophobicContact CG2-CG1 4.31Å |
| 37 | V | 59.4 | Low | 58.8 | Low | 7 Ų | 7 | 77.2 Ų | 77.2 | 4% | 0.042 | 41% | 0.409 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121 | 133.6 | 179.5 | -179.4 | 0 | 0 | 0 | 0 | 109.9 | I25 F27 Q41 L50 | I25-V37 CarbonylContact C-O 3.57Å; I25-V37 PolarHBondContact N-O 2.89Å; I25-V37 VanDerWaalsContact N-O 3.14Å; I25-V37 CarbonylContact O-C 3.59Å; I25-V37 PolarHBondContact O-N 2.82Å; F27-V37 HydrophobicContact CD2-CB 3.64Å; F27-V37 HydrophobicContact CD2-CG1 4.42Å; F27-V37 HydrophobicContact CD2-CG2 3.58Å; F27-V37 HydrophobicContact CE2-CB 3.75Å; F27-V37 HydrophobicContact CE2-CG1 4.12Å; F27-V37 HydrophobicContact CE2-CG2 4.12Å; V37-Q41 HydrophobicContact CG1-CB 4.3Å; V37-L50 HydrophobicContact CG1-CD1 3.77Å; V37-L50 HydrophobicContact CG2-CD1 3.98Å; V37-L50 HydrophobicContact CG2-CD2 3.88Å |
| 38 | D | 59.7 | Low | 57.9 | Low | 55 Ų | 55 | 81.2 Ų | 81.2 | 29% | 0.294 | 44% | 0.436 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.6 | 136.1 | 174 | -174.5 | -81.6 | 0 | 0 | 0 | 110.6 | N40 Q41 L42 | D38-N40 PolarHBondContact O-N 3.34Å; D38-N40 WeakPolarHBondContact OD1-CA 3.34Å; D38-N40 WeakPolarHBondContact OD1-CB 3.46Å; D38-N40 PolarHBondContact OD1-N 3.17Å; D38-N40 PolarHBondContact OD1-ND2 3.39Å; D38-Q41 HydrophobicContact CB-CG 4.33Å; D38-Q41 WeakPolarHBondContact O-CB 3.07Å; D38-Q41 PolarHBondContact O-N 3.14Å; D38-L42 PolarHBondContact O-N 3.5Å |
| 39 | R | 57.1 | Low | 57.5 | Low | 63 Ų | 63 | 82 Ų | 82 | 24% | 0.238 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -57.7 | -31.7 | -178.8 | -76.8 | -177.4 | 98.2 | 122.4 | -0.8 | 113.1 | S19 N22 N23 I25 Q41 L42 Y43 | S19-R39 PolarHBondContact OG-NH1 3.41Å; N22-R39 WeakPolarHBondContact O-CD 3.39Å; N23-R39 WeakPolarHBondContact O-CB 3.41Å; N23-R39 WeakPolarHBondContact O-CG 3.21Å; N23-R39 PolarHBondContact O-N 2.79Å; I25-R39 HydrophobicContact CB-CG 4.3Å; I25-R39 HydrophobicContact CD1-CG 3.56Å; I25-R39 HydrophobicContact CG1-CG 3.53Å; R39-Q41 PolarHBondContact O-N 3.37Å; R39-L42 PolarHBondContact O-N 2.8Å; R39-Y43 VanDerWaalsContact O-CD2 3.29Å; R39-Y43 WeakPolarHBondContact O-CD2 3.26Å; R39-Y43 PolarHBondContact O-N 3.23Å |
| 40 | N | 55.3 | Low | 57.2 | Low | 118 Ų | 118 | 82.9 Ų | 82.9 | 63% | 0.631 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -69.4 | -27.1 | 179.8 | -55.2 | -63.8 | 0 | 0 | 0 | 111.5 | D38 G44 | D38-N40 PolarHBondContact O-N 3.34Å; D38-N40 WeakPolarHBondContact OD1-CA 3.34Å; D38-N40 WeakPolarHBondContact OD1-CB 3.46Å; D38-N40 PolarHBondContact OD1-N 3.17Å; D38-N40 PolarHBondContact OD1-ND2 3.39Å; N40-G44 PolarHBondContact O-N 3.05Å |
| 41 | Q | 50.3 | Low | 56.6 | Low | 91 Ų | 91 | 81.5 Ų | 81.5 | 43% | 0.425 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -79.4 | -25.6 | 174 | -63.2 | -175 | 60.5 | 0 | 0 | 112.5 | V37 D38 R39 N47 | V37-Q41 HydrophobicContact CG1-CB 4.3Å; D38-Q41 HydrophobicContact CB-CG 4.33Å; D38-Q41 WeakPolarHBondContact O-CB 3.07Å; D38-Q41 PolarHBondContact O-N 3.14Å; R39-Q41 PolarHBondContact O-N 3.37Å; Q41-N47 PolarHBondContact OE1-ND2 2.86Å |
| 42 | L | 54.5 | Low | 56 | Low | 40 Ų | 40 | 83.8 Ų | 83.8 | 21% | 0.209 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -73.7 | -40.6 | 179.5 | -174.6 | 65.6 | 0 | 0 | 0 | 113 | I25 F27 D38 R39 G44 | I25-L42 HydrophobicContact CD1-CD2 3.89Å; F27-L42 HydrophobicContact CE1-CD1 4.44Å; F27-L42 HydrophobicContact CE2-CD1 3.72Å; F27-L42 HydrophobicContact CE2-CD2 4.23Å; F27-L42 HydrophobicContact CE2-CG 4.45Å; F27-L42 HydrophobicContact CZ-CD1 3.36Å; F27-L42 HydrophobicContact CZ-CD2 3.61Å; F27-L42 HydrophobicContact CZ-CG 4.06Å; D38-L42 PolarHBondContact O-N 3.5Å; R39-L42 PolarHBondContact O-N 2.8Å; L42-G44 VanDerWaalsContact C-N 3.33Å |
| 43 | Y | 52.9 | Low | 55.5 | Low | 176 Ų | 176 | 82.3 Ų | 82.3 | 69% | 0.69 | 44% | 0.438 | S | S | * | . | S | Bend | trans | -83.7 | -8.3 | 176.8 | -65.9 | -69.5 | 0 | 0 | 0 | 113.7 | R39 | R39-Y43 VanDerWaalsContact O-CD2 3.29Å; R39-Y43 WeakPolarHBondContact O-CD2 3.26Å; R39-Y43 PolarHBondContact O-N 3.23Å |
| 44 | G | 52.8 | Low | 55 | Low | 30 Ų | 30 | 82 Ų | 82 | 31% | 0.309 | 43% | 0.432 | S | S | . | . | S | Bend | trans | -65.6 | 178.3 | 163.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | N40 L42 I46 | N40-G44 PolarHBondContact O-N 3.05Å; L42-G44 VanDerWaalsContact C-N 3.33Å; G44-I46 VanDerWaalsContact C-N 3.35Å; G44-I46 PolarHBondContact O-N 3.19Å |
| 45 | P | 53 | Low | 54.7 | Low | 117 Ų | 117 | 85.1 Ų | 85.1 | 76% | 0.76 | 44% | 0.437 | S | S | * | . | S | Bend | trans | -54.6 | 108.8 | 160.5 | 25.4 | -30.2 | 0 | 0 | 0 | 105.9 | N47 | P45-N47 WeakPolarHBondContact O-CA 3.28Å; P45-N47 PolarHBondContact O-N 3.37Å |
| 46 | I | 51.3 | Low | 54 | Low | 94 Ų | 94 | 85 Ų | 85 | 48% | 0.482 | 44% | 0.444 | S | S | . | . | trans | -33.6 | 113.3 | 179.7 | -70.2 | 167.4 | 0 | 0 | 0 | 106.8 | G44 P48 M51 | G44-I46 VanDerWaalsContact C-N 3.35Å; G44-I46 PolarHBondContact O-N 3.19Å; I46-P48 WeakPolarHBondContact O-CD 3.31Å; I46-M51 HydrophobicContact CG2-CB 4.47Å | ||
| 47 | N | 50.7 | Low | 53.6 | Low | 49 Ų | 49 | 86 Ų | 86 | 26% | 0.262 | 44% | 0.441 | S | S | . | . | trans | -47.5 | 118 | -170.3 | -94.4 | -8.7 | 0 | 0 | 0 | 107.5 | Q41 P45 I49 L50 M51 | Q41-N47 PolarHBondContact OE1-ND2 2.86Å; P45-N47 WeakPolarHBondContact O-CA 3.28Å; P45-N47 PolarHBondContact O-N 3.37Å; N47-I49 CarbonylContact O-C 3.58Å; N47-I49 PolarHBondContact O-N 3.35Å; N47-L50 HydrophobicContact CB-CB 4.44Å; N47-L50 HydrophobicContact CB-CD1 4.06Å; N47-L50 HydrophobicContact CB-CG 3.95Å; N47-L50 WeakPolarHBondContact O-CB 3.01Å; N47-L50 PolarHBondContact O-N 3.25Å; N47-M51 PolarHBondContact O-N 2.98Å | ||
| 48 | P | 49.8 | Very low | 53.1 | Low | 93 Ų | 93 | 95.9 Ų | 95.9 | 60% | 0.604 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -54.9 | -21.3 | 179 | -28 | 34.8 | 0 | 0 | 0 | 111.4 | I46 R52 | I46-P48 WeakPolarHBondContact O-CD 3.31Å; P48-R52 WeakPolarHBondContact O-CA 3.42Å; P48-R52 WeakPolarHBondContact O-CB 3.43Å; P48-R52 PolarHBondContact O-N 2.89Å |
| 49 | I | 53 | Low | 52.4 | Low | 112 Ų | 112 | 101.5 Ų | 101.5 | 57% | 0.574 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63.3 | -46.8 | 170.8 | -59.3 | 169.1 | 0 | 0 | 0 | 112.1 | N47 M51 R52 N53 | N47-I49 CarbonylContact O-C 3.58Å; N47-I49 PolarHBondContact O-N 3.35Å; I49-M51 VanDerWaalsContact C-N 3.33Å; I49-R52 PolarHBondContact O-N 2.96Å; I49-N53 WeakPolarHBondContact O-CB 3.44Å; I49-N53 PolarHBondContact O-N 2.83Å |
| 50 | L | 55.9 | Low | 52.2 | Low | 38 Ų | 38 | 103.4 Ų | 103.4 | 20% | 0.199 | 54% | 0.535 | C | S | . | . | H | α-helix | trans | -63.6 | -43.1 | 175.7 | -63.8 | 174.1 | 0 | 0 | 0 | 110.3 | V37 N47 A54 | V37-L50 HydrophobicContact CG1-CD1 3.77Å; V37-L50 HydrophobicContact CG2-CD1 3.98Å; V37-L50 HydrophobicContact CG2-CD2 3.88Å; N47-L50 HydrophobicContact CB-CB 4.44Å; N47-L50 HydrophobicContact CB-CD1 4.06Å; N47-L50 HydrophobicContact CB-CG 3.95Å; N47-L50 WeakPolarHBondContact O-CB 3.01Å; N47-L50 PolarHBondContact O-N 3.25Å; L50-A54 WeakPolarHBondContact O-CB 3.42Å; L50-A54 PolarHBondContact O-N 3.37Å |
| 51 | M | 51.2 | Low | 52 | Low | 98 Ų | 98 | 102.6 Ų | 102.6 | 48% | 0.483 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -68.2 | -35.3 | 177.3 | -157.1 | 165.7 | 161.9 | 0 | 0 | 111.8 | I46 N47 I49 L55 | I46-M51 HydrophobicContact CG2-CB 4.47Å; N47-M51 PolarHBondContact O-N 2.98Å; I49-M51 VanDerWaalsContact C-N 3.33Å; M51-L55 WeakPolarHBondContact O-CB 3.22Å; M51-L55 WeakPolarHBondContact O-CG 3.2Å; M51-L55 PolarHBondContact O-N 3.24Å |
| 52 | R | 58.8 | Low | 52.1 | Low | 191 Ų | 191 | 103.3 Ų | 103.3 | 72% | 0.721 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -73 | -40.2 | 177.2 | -175.6 | 176.7 | -161.2 | -137.7 | 2.8 | 111.9 | P48 I49 L55 S56 | P48-R52 WeakPolarHBondContact O-CA 3.42Å; P48-R52 WeakPolarHBondContact O-CB 3.43Å; P48-R52 PolarHBondContact O-N 2.89Å; I49-R52 PolarHBondContact O-N 2.96Å; R52-L55 PolarHBondContact O-N 3.3Å; R52-S56 WeakPolarHBondContact O-CB 3.41Å; R52-S56 PolarHBondContact O-N 3.04Å; R52-S56 PolarHBondContact O-OG 3.47Å; R52-S56 VanDerWaalsContact O-OG 3.11Å |
| 53 | N | 51.2 | Low | 52 | Low | 63 Ų | 63 | 107 Ų | 107 | 34% | 0.337 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -63.8 | -44.2 | 174 | -77.8 | -1.8 | 0 | 0 | 0 | 110.4 | I49 L55 S56 Y57 | I49-N53 WeakPolarHBondContact O-CB 3.44Å; I49-N53 PolarHBondContact O-N 2.83Å; N53-L55 VanDerWaalsContact C-N 3.29Å; N53-L55 PolarHBondContact O-N 2.9Å; N53-S56 WeakPolarHBondContact CA-OG 3.4Å; N53-S56 PolarHBondContact O-N 3.35Å; N53-S56 PolarHBondContact O-OG 3.09Å; N53-Y57 WeakPolarHBondContact O-CD2 3.36Å; N53-Y57 PolarHBondContact O-N 2.83Å |
| 54 | A | 53.3 | Low | 51.9 | Low | 39 Ų | 39 | 102.7 Ų | 102.7 | 32% | 0.322 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -60.3 | -37.7 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | F15 L50 | F15-A54 HydrophobicContact CE2-CB 4.14Å; F15-A54 HydrophobicContact CZ-CB 4.07Å; L50-A54 WeakPolarHBondContact O-CB 3.42Å; L50-A54 PolarHBondContact O-N 3.37Å |
| 55 | L | 54.7 | Low | 51.9 | Low | 113 Ų | 113 | 107.5 Ų | 107.5 | 59% | 0.592 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -76.5 | -38 | 177.1 | -74.1 | 170.4 | 0 | 0 | 0 | 113.7 | M51 R52 N53 Y57 R58 | M51-L55 WeakPolarHBondContact O-CB 3.22Å; M51-L55 WeakPolarHBondContact O-CG 3.2Å; M51-L55 PolarHBondContact O-N 3.24Å; R52-L55 PolarHBondContact O-N 3.3Å; N53-L55 VanDerWaalsContact C-N 3.29Å; N53-L55 PolarHBondContact O-N 2.9Å; L55-Y57 PolarHBondContact O-N 3.13Å; L55-R58 WeakPolarHBondContact O-CB 3.46Å; L55-R58 PolarHBondContact O-N 3.3Å; L55-R58 VanDerWaalsContact O-N 3.14Å |
| 56 | S | 49.3 | Very low | 51.8 | Low | 74 Ų | 74 | 106.9 Ų | 106.9 | 52% | 0.517 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -67.5 | -23.6 | 178.2 | 57.5 | 0 | 0 | 0 | 0 | 112.2 | R52 N53 R58 | R52-S56 WeakPolarHBondContact O-CB 3.41Å; R52-S56 PolarHBondContact O-N 3.04Å; R52-S56 PolarHBondContact O-OG 3.47Å; R52-S56 VanDerWaalsContact O-OG 3.11Å; N53-S56 WeakPolarHBondContact CA-OG 3.4Å; N53-S56 PolarHBondContact O-N 3.35Å; N53-S56 PolarHBondContact O-OG 3.09Å; S56-R58 PolarHBondContact O-N 3.46Å |
| 57 | Y | 51.8 | Low | 51.8 | Low | 145 Ų | 145 | 107.8 Ų | 107.8 | 57% | 0.569 | 55% | 0.554 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78 | -0.4 | 173.8 | -99.2 | -71.7 | 0 | 0 | 0 | 114.6 | L32 N53 L55 S59 | L32-Y57 HydrophobicContact CD1-CD1 3.08Å; L32-Y57 HydrophobicContact CD1-CD2 4.07Å; L32-Y57 HydrophobicContact CD1-CE1 3.37Å; L32-Y57 HydrophobicContact CD1-CE2 4.31Å; L32-Y57 HydrophobicContact CD1-CG 3.44Å; L32-Y57 VanDerWaalsContact CD1-CG 3.44Å; L32-Y57 HydrophobicContact CD2-CD1 3.99Å; L32-Y57 HydrophobicContact CD2-CE1 3.57Å; L32-Y57 HydrophobicContact CG-CD1 4.14Å; L32-Y57 HydrophobicContact CG-CE1 4.02Å; N53-Y57 WeakPolarHBondContact O-CD2 3.36Å; N53-Y57 PolarHBondContact O-N 2.83Å; L55-Y57 PolarHBondContact O-N 3.13Å; Y57-S59 VanDerWaalsContact C-N 3.32Å |
| 58 | R | 49.1 | Very low | 51.9 | Low | 214 Ų | 214 | 112.8 Ų | 112.8 | 81% | 0.808 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.7 | -6.2 | 175.4 | -170.6 | 172.8 | 177.3 | -155.3 | -1.5 | 113.7 | L55 S56 | L55-R58 WeakPolarHBondContact O-CB 3.46Å; L55-R58 PolarHBondContact O-N 3.3Å; L55-R58 VanDerWaalsContact O-N 3.14Å; S56-R58 PolarHBondContact O-N 3.46Å |
| 59 | S | 45.2 | Very low | 52.1 | Low | 173 Ų | 173 | 114.5 Ų | 114.5 | 100% | 1.21 | 58% | 0.576 | S | S | * | * | trans | -89.9 | 0 | 178.8 | -168.8 | 0 | 0 | 0 | 0 | 113.4 | Y57 | Y57-S59 VanDerWaalsContact C-N 3.32Š|
Retrieved 59 of 59 residues in 31.5 ms
(Link to these results)