| 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 | 42.3 | Very low | 62 | Low | 244 Ų | 244 | 150.5 Ų | 150.5 | 100% | 1.202 | 81% | 0.807 | S | S | * | * | 0 | 111.8 | 0 | -70.8 | -141.2 | -134.8 | 0 | 0 | 107.6 | |||||
| 2 | S | 56.3 | Low | 62.3 | Low | 124 Ų | 124 | 145 Ų | 145 | 87% | 0.867 | 79% | 0.786 | S | S | * | * | trans | -77.7 | 121.1 | -175.4 | -49.3 | 0 | 0 | 0 | 0 | 109.9 | I4 | S2-I4 PolarHBondContact O-N 3.31Š| ||
| 3 | S | 65.4 | Low | 61.9 | Low | 105 Ų | 105 | 145.8 Ų | 145.8 | 73% | 0.734 | 78% | 0.778 | S | S | * | * | trans | -70.1 | 124.4 | 179.2 | 52.8 | 0 | 0 | 0 | 0 | 111.1 | Q5 | S3-Q5 PolarHBondContact O-N 2.69Š| ||
| 4 | I | 65.7 | Low | 61.9 | Low | 147 Ų | 147 | 138.9 Ų | 138.9 | 75% | 0.754 | 75% | 0.751 | S | S | * | * | trans | -72.5 | 113.3 | 176.9 | -66.9 | 162.9 | 0 | 0 | 0 | 108.9 | S2 N6 | S2-I4 PolarHBondContact O-N 3.31Å; I4-N6 HydrophobicContact CG2-CB 4.22Å; I4-N6 PolarHBondContact O-N 3.28Å | ||
| 5 | Q | 65.4 | Low | 61.4 | Low | 164 Ų | 164 | 136.9 Ų | 136.9 | 77% | 0.766 | 74% | 0.74 | S | S | * | * | G | 310 helix | trans | -72.7 | -10.7 | -176.1 | -67.1 | 176.2 | -18 | 0 | 0 | 114 | S3 L7 | S3-Q5 PolarHBondContact O-N 2.69Å; Q5-L7 PolarHBondContact O-N 3.27Å |
| 6 | N | 63.3 | Low | 60.9 | Low | 156 Ų | 156 | 133 Ų | 133 | 83% | 0.834 | 73% | 0.732 | S | S | * | * | G | 310 helix | trans | -88.6 | 5.5 | -170 | -149.4 | 26.3 | 0 | 0 | 0 | 114.9 | I4 | I4-N6 HydrophobicContact CG2-CB 4.22Å; I4-N6 PolarHBondContact O-N 3.28Å |
| 7 | L | 60 | Low | 60.4 | Low | 163 Ų | 163 | 129.2 Ų | 129.2 | 85% | 0.853 | 71% | 0.714 | S | S | * | * | G | 310 helix | trans | -107.8 | 26.8 | 172.7 | -161.7 | 66.6 | 0 | 0 | 0 | 111.5 | Q5 S9 | Q5-L7 PolarHBondContact O-N 3.27Å; L7-S9 PolarHBondContact O-N 3.42Å |
| 8 | Q | 64.2 | Low | 59.8 | Low | 165 Ų | 165 | 130.3 Ų | 130.3 | 77% | 0.771 | 71% | 0.71 | S | S | * | * | trans | -72.2 | 107.9 | 161.7 | -70.6 | -178.8 | -20.8 | 0 | 0 | 106.6 | F10 | Q8-F10 VanDerWaalsContact C-N 3.3Å; Q8-F10 PolarHBondContact O-N 3.49Å | ||
| 9 | S | 65.9 | Low | 58.7 | Low | 118 Ų | 118 | 126.8 Ų | 126.8 | 83% | 0.825 | 71% | 0.707 | S | S | * | * | trans | -59.5 | 95.4 | 171.1 | 51 | 0 | 0 | 0 | 0 | 108.2 | L7 D11 | L7-S9 PolarHBondContact O-N 3.42Å; S9-D11 PolarHBondContact O-N 3.34Å; S9-D11 VanDerWaalsContact O-N 3.09Å | ||
| 10 | F | 63.6 | Low | 58 | Low | 176 Ų | 176 | 127.9 Ų | 127.9 | 77% | 0.772 | 71% | 0.712 | S | S | * | * | trans | -68.8 | 104.1 | 175.4 | -176.1 | -99.8 | 0 | 0 | 0 | 107.6 | Q8 P12 | Q8-F10 VanDerWaalsContact C-N 3.3Å; Q8-F10 PolarHBondContact O-N 3.49Å; F10-P12 HydrophobicContact CE1-CB 4.47Å; F10-P12 VanDerWaalsContact O-CD 3.23Å; F10-P12 WeakPolarHBondContact O-CD 3.25Å | ||
| 11 | D | 70.2 | Confident | 57.3 | Low | 93 Ų | 93 | 128.3 Ų | 128.3 | 50% | 0.497 | 71% | 0.713 | S | S | . | * | trans | -85.3 | 106.5 | 174.2 | -178 | -2.6 | 0 | 0 | 0 | 109 | S9 F13 A14 | S9-D11 PolarHBondContact O-N 3.34Å; S9-D11 VanDerWaalsContact O-N 3.09Å; D11-F13 PolarHBondContact O-N 3.3Å; D11-F13 VanDerWaalsContact O-N 3.12Å; D11-F13 PolarHBondContact OD1-N 2.67Å; D11-A14 HydrophobicContact CB-CB 4.21Å; D11-A14 WeakPolarHBondContact O-CB 3.44Å; D11-A14 PolarHBondContact O-N 3.43Å; D11-A14 VanDerWaalsContact O-N 3.08Å | ||
| 12 | P | 65.8 | Low | 57.3 | Low | 85 Ų | 85 | 125.2 Ų | 125.2 | 55% | 0.552 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.9 | -9.5 | -178.3 | 28 | -34.2 | 0 | 0 | 0 | 113.7 | F10 | F10-P12 HydrophobicContact CE1-CB 4.47Å; F10-P12 VanDerWaalsContact O-CD 3.23Å; F10-P12 WeakPolarHBondContact O-CD 3.25Å |
| 13 | F | 56.5 | Low | 56.7 | Low | 156 Ų | 156 | 125 Ų | 125 | 68% | 0.684 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -92 | -10.1 | 173.9 | -68.2 | -80.8 | 0 | 0 | 0 | 113.6 | D11 D15 | D11-F13 PolarHBondContact O-N 3.3Å; D11-F13 VanDerWaalsContact O-N 3.12Å; D11-F13 PolarHBondContact OD1-N 2.67Å; F13-D15 PolarHBondContact O-N 3.11Å |
| 14 | A | 61.3 | Low | 55.6 | Low | 49 Ų | 49 | 123.7 Ų | 123.7 | 41% | 0.405 | 68% | 0.677 | S | S | . | * | H | α-helix | trans | -69.9 | -20.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | D11 T17 | D11-A14 HydrophobicContact CB-CB 4.21Å; D11-A14 WeakPolarHBondContact O-CB 3.44Å; D11-A14 PolarHBondContact O-N 3.43Å; D11-A14 VanDerWaalsContact O-N 3.08Å; A14-T17 PolarHBondContact O-OG1 3.2Å |
| 15 | D | 54.8 | Low | 54.6 | Low | 108 Ų | 108 | 120.4 Ų | 120.4 | 58% | 0.578 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -95.5 | -30.2 | 179.4 | -127.4 | -90.4 | 0 | 0 | 0 | 112.7 | F13 T17 K18 | F13-D15 PolarHBondContact O-N 3.11Å; D15-T17 PolarHBondContact O-N 3.24Å; D15-K18 PolarHBondContact O-N 3.37Å; D15-K18 VanDerWaalsContact O-N 3.11Å |
| 16 | A | 53.5 | Low | 53.4 | Low | 75 Ų | 75 | 114.5 Ų | 114.5 | 62% | 0.62 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -68.5 | -17.9 | 178 | 0 | 0 | 0 | 0 | 0 | 113.7 | K18 | A16-K18 VanDerWaalsContact C-N 3.26Å; A16-K18 PolarHBondContact O-N 3.48Å |
| 17 | T | 51.8 | Low | 52.5 | Low | 68 Ų | 68 | 113.2 Ų | 113.2 | 42% | 0.417 | 65% | 0.654 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -80.6 | -3.6 | 174.1 | 43.3 | 0 | 0 | 0 | 0 | 113.7 | A14 D15 A25 | A14-T17 PolarHBondContact O-OG1 3.2Å; D15-T17 PolarHBondContact O-N 3.24Å; T17-A25 HydrophobicContact CG2-CB 3.33Å |
| 18 | K | 51.1 | Low | 52.2 | Low | 149 Ų | 149 | 112.2 Ų | 112.2 | 65% | 0.648 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.5 | -3.4 | -179.8 | -62.9 | 178.5 | -176.8 | 169 | 0 | 113.9 | D15 A16 | D15-K18 PolarHBondContact O-N 3.37Å; D15-K18 VanDerWaalsContact O-N 3.11Å; A16-K18 VanDerWaalsContact C-N 3.26Å; A16-K18 PolarHBondContact O-N 3.48Å |
| 19 | G | 38.9 | Very low | 52.3 | Low | 64 Ų | 64 | 108.7 Ų | 108.7 | 66% | 0.66 | 63% | 0.631 | S | S | * | * | S | Bend | trans | -105.4 | -3.8 | -159.1 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||
| 20 | D | 43 | Very low | 53 | Low | 149 Ų | 149 | 107.8 Ų | 107.8 | 80% | 0.797 | 61% | 0.613 | S | S | * | * | S | Bend | trans | -135.6 | -3.5 | -177.5 | -160.6 | 60.9 | 0 | 0 | 0 | 115.9 | ||
| 21 | D | 44.6 | Very low | 54.1 | Low | 137 Ų | 137 | 100.1 Ų | 100.1 | 73% | 0.733 | 58% | 0.579 | S | S | * | * | S | Bend | trans | -155 | 142.3 | 166.9 | -95.8 | -55.2 | 0 | 0 | 0 | 107.9 | L23 | D21-L23 PolarHBondContact O-N 2.93Š|
| 22 | L | 42.3 | Very low | 55 | Low | 178 Ų | 178 | 97.6 Ų | 97.6 | 93% | 0.932 | 57% | 0.565 | S | S | * | * | S | Bend | trans | -63.2 | 22.2 | -173.3 | -93.4 | 154.9 | 0 | 0 | 0 | 116.1 | ||
| 23 | L | 43 | Very low | 56.2 | Low | 119 Ų | 119 | 93.6 Ų | 93.6 | 62% | 0.623 | 54% | 0.539 | S | S | * | . | S | Bend | trans | -143.5 | 137.8 | 178.8 | -64.9 | 171.4 | 0 | 0 | 0 | 109.8 | D21 | D21-L23 PolarHBondContact O-N 2.93Š|
| 24 | P | 42 | Very low | 57.8 | Low | 78 Ų | 78 | 90.2 Ų | 90.2 | 51% | 0.506 | 52% | 0.521 | S | S | . | . | trans | -58.1 | 146.6 | -175.8 | 26.5 | -34.3 | 0 | 0 | 0 | 110.8 | G26 | P24-G26 PolarHBondContact O-N 3.17Š| ||
| 25 | A | 45.6 | Very low | 59.3 | Low | 78 Ų | 78 | 88.8 Ų | 88.8 | 65% | 0.645 | 51% | 0.506 | S | S | * | . | S | Bend | trans | -62.3 | 81.5 | 168 | 0 | 0 | 0 | 0 | 0 | 110.3 | T17 | T17-A25 HydrophobicContact CG2-CB 3.33Š|
| 26 | G | 39.4 | Very low | 61 | Low | 41 Ų | 41 | 89.3 Ų | 89.3 | 42% | 0.423 | 51% | 0.506 | S | S | . | . | S | Bend | trans | -148.9 | 146.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 106.6 | P24 E28 | P24-G26 PolarHBondContact O-N 3.17Å; G26-E28 PolarHBondContact O-N 3.13Å |
| 27 | T | 45.7 | Very low | 62.8 | Low | 129 Ų | 129 | 91.2 Ų | 91.2 | 79% | 0.791 | 50% | 0.502 | S | S | * | . | S | Bend | trans | -67 | 49.2 | 179.6 | 46.5 | 0 | 0 | 0 | 0 | 113.8 | ||
| 28 | E | 53.3 | Low | 64.6 | Low | 141 Ų | 141 | 96.1 Ų | 96.1 | 66% | 0.659 | 51% | 0.512 | S | S | * | . | trans | -107.4 | -6.4 | -151.4 | -64.2 | -168.6 | 128.5 | 0 | 0 | 118.1 | G26 | G26-E28 PolarHBondContact O-N 3.13Š| ||
| 29 | D | 66.5 | Low | 66.4 | Low | 92 Ų | 92 | 94.9 Ų | 94.9 | 49% | 0.492 | 51% | 0.513 | S | S | . | . | S | Bend | trans | -129.6 | 33.5 | 173.7 | -74.6 | -56.2 | 0 | 0 | 0 | 113.9 | ||
| 30 | K | 80.6 | Confident | 68.7 | Low | 99 Ų | 99 | 94 Ų | 94 | 43% | 0.43 | 50% | 0.504 | S | S | . | . | trans | -102.4 | 124.9 | 175.3 | -69.5 | 175.5 | -175.3 | 164 | 0 | 110.3 | H32 Q107 K109 | K30-H32 PolarHBondContact O-CD2 3.31Å; K30-H32 PolarHBondContact O-N 2.88Å; K30-Q107 CarbonylContact C-O 3.48Å; K30-Q107 VanDerWaalsContact CA-O 3.25Å; K30-Q107 WeakPolarHBondContact CA-O 3.46Å; K30-K109 HydrophobicContact CB-CG 4.47Å; K30-K109 HydrophobicContact CD-CG 4.35Å | ||
| 31 | I | 87 | Confident | 70.7 | Confident | 14 Ų | 14 | 98.9 Ų | 98.9 | 7% | 0.072 | 51% | 0.511 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.5 | 115.4 | 173.5 | -72.6 | 165.3 | 0 | 0 | 0 | 108.3 | V47 Q48 G49 I50 L97 V103 Q107 K109 | I31-V47 HydrophobicContact CG2-CG1 3.67Å; I31-Q48 WeakPolarHBondContact CA-O 3.39Å; I31-G49 VanDerWaalsContact CG1-O 3.27Å; I31-G49 WeakPolarHBondContact CG1-O 3.26Å; I31-I50 HydrophobicContact CD1-CG1 4.38Å; I31-L97 HydrophobicContact CG2-CD1 4.17Å; I31-V103 HydrophobicContact CD1-CB 4.18Å; I31-V103 HydrophobicContact CD1-CG1 3.8Å; I31-V103 HydrophobicContact CD1-CG2 3.23Å; I31-Q107 PolarHBondContact N-O 2.78Å; I31-K109 PolarHBondContact O-N 2.88Å |
| 32 | H | 88.4 | Confident | 72.9 | Confident | 41 Ų | 41 | 99.4 Ų | 99.4 | 19% | 0.19 | 51% | 0.507 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.4 | 117.6 | -179.9 | -64.6 | -70.7 | 0 | 0 | 0 | 110 | K30 V47 Q48 K109 H111 | K30-H32 PolarHBondContact O-CD2 3.31Å; K30-H32 PolarHBondContact O-N 2.88Å; H32-V47 WeakPolarHBondContact O-CA 3.39Å; H32-Q48 HydrophobicContact CB-CB 4.23Å; H32-Q48 PolarHBondContact N-O 2.9Å; H32-Q48 PolarHBondContact O-N 3.24Å; H32-K109 WeakPolarHBondContact CA-O 3.5Å; H32-K109 WeakPolarHBondContact ND1-CB 3.44Å; H32-H111 AromaticContact CE1-NE2 3.76Å; H32-H111 AromaticContact CG-NE2 3.71Å; H32-H111 AromaticContact ND1-CD2 3.72Å; H32-H111 AromaticContact ND1-CE1 3.98Å; H32-H111 AromaticContact ND1-NE2 2.92Å; H32-H111 PolarHBondContact ND1-NE2 3.02Å |
| 33 | I | 91.3 | Very high | 75.3 | Confident | 1 Ų | 1 | 92.3 Ų | 92.3 | 1% | 0.005 | 47% | 0.471 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.1 | 110.2 | 170.9 | -56.1 | 176.3 | 0 | 0 | 0 | 106.9 | T45 T46 V47 R90 I93 L97 L108 K109 V110 H111 | I33-T45 HydrophobicContact CG2-CG2 3.63Å; I33-T46 WeakPolarHBondContact CA-O 3.49Å; I33-V47 HydrophobicContact CG1-CG1 4.47Å; I33-R90 HydrophobicContact CG2-CB 4.27Å; I33-I93 HydrophobicContact CD1-CB 4.11Å; I33-I93 HydrophobicContact CD1-CG2 3.59Å; I33-I93 HydrophobicContact CG1-CG2 4.27Å; I33-L97 HydrophobicContact CD1-CD1 4.41Å; I33-L108 HydrophobicContact CD1-CD1 4.1Å; I33-L108 HydrophobicContact CD1-CD2 3.93Å; I33-L108 HydrophobicContact CD1-CG 4.14Å; I33-K109 PolarHBondContact N-O 2.71Å; I33-V110 HydrophobicContact CD1-CG2 4.47Å; I33-H111 PolarHBondContact O-N 2.75Å |
| 34 | R | 90.5 | Very high | 77.6 | Confident | 84 Ų | 84 | 88.5 Ų | 88.5 | 32% | 0.317 | 45% | 0.451 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.7 | 144.8 | 178.9 | -53.9 | 178.7 | -179.1 | -89.2 | 2.4 | 110.2 | T45 T46 H111 | R34-T45 CarbonylContact O-C 3.46Å; R34-T45 WeakPolarHBondContact O-CA 3.47Å; R34-T46 PolarHBondContact N-O 2.84Å; R34-T46 PolarHBondContact O-N 3.09Å; R34-T46 PolarHBondContact O-OG1 2.79Å; R34-H111 HydrophobicContact CB-CB 4.44Å; R34-H111 HydrophobicContact CG-CB 4.02Å |
| 35 | I | 92.8 | Very high | 80 | Confident | 19 Ų | 19 | 84.8 Ų | 84.8 | 10% | 0.097 | 43% | 0.427 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109 | 134.7 | 172.5 | -170.3 | 167.8 | 0 | 0 | 0 | 110.3 | T43 L44 D88 H111 F113 | I35-T43 HydrophobicContact CD1-CG2 4.02Å; I35-T43 HydrophobicContact CG1-CG2 4.27Å; I35-L44 CarbonylContact C-O 3.57Å; I35-L44 WeakPolarHBondContact CA-O 3.35Å; I35-D88 HydrophobicContact CD1-CB 3.63Å; I35-H111 PolarHBondContact N-O 2.67Å; I35-F113 HydrophobicContact CG2-CD2 4.24Å |
| 36 | Q | 90.3 | Very high | 82.2 | Confident | 120 Ų | 120 | 81.7 Ų | 81.7 | 56% | 0.561 | 40% | 0.4 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -123.1 | 135.5 | 175.8 | -62.4 | -69.5 | 72.3 | 0 | 0 | 109.1 | T43 L44 | Q36-T43 CarbonylContact O-C 3.6Å; Q36-T43 VanDerWaalsContact O-CA 3.26Å; Q36-T43 WeakPolarHBondContact O-CA 3.39Å; Q36-L44 PolarHBondContact N-O 2.91Å; Q36-L44 PolarHBondContact O-N 3.45Å |
| 37 | Q | 91.4 | Very high | 84.6 | Confident | 115 Ų | 115 | 79.8 Ų | 79.8 | 54% | 0.537 | 38% | 0.38 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.5 | 121.7 | 174.5 | -163.8 | 173.7 | 34.1 | 0 | 0 | 109.5 | G40 T43 F113 | Q37-G40 WeakPolarHBondContact CG-O 3.43Å; Q37-G40 PolarHBondContact NE2-O 2.94Å; Q37-T43 HydrophobicContact CG-CG2 4.48Å; Q37-F113 HydrophobicContact CB-CE2 4.09Å; Q37-F113 HydrophobicContact CB-CZ 4.34Å |
| 38 | R | 89.5 | Confident | 86.7 | Confident | 170 Ų | 170 | 74.5 Ų | 74.5 | 64% | 0.642 | 35% | 0.347 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -85.7 | -49 | 178.6 | -176.3 | -178.7 | 176.1 | -177.2 | -0.2 | 111.5 | K42 L44 | R38-K42 HydrophobicContact CB-CB 4.46Å; R38-K42 PolarHBondContact N-O 3.45Å; R38-L44 HydrophobicContact CB-CD1 4.13Å; R38-L44 HydrophobicContact CB-CG 4.16Å; R38-L44 HydrophobicContact CG-CD1 4.35Å |
| 39 | N | 88.1 | Confident | 88.1 | Confident | 123 Ų | 123 | 70 Ų | 70 | 66% | 0.658 | 34% | 0.337 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -162 | 116 | 178.5 | -172.5 | -7.7 | 0 | 0 | 0 | 110.1 | R41 K42 | N39-R41 PolarHBondContact O-N 3.49Å; N39-K42 PolarHBondContact N-O 3.37Å; N39-K42 WeakPolarHBondContact O-CB 3.18Å; N39-K42 PolarHBondContact O-N 3.12Å |
| 40 | G | 86.4 | Confident | 88.9 | Confident | 46 Ų | 46 | 66.2 Ų | 66.2 | 47% | 0.474 | 32% | 0.317 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 47 | -105 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q37 | Q37-G40 WeakPolarHBondContact CG-O 3.43Å; Q37-G40 PolarHBondContact NE2-O 2.94Å |
| 41 | R | 86 | Confident | 88.8 | Confident | 251 Ų | 251 | 63.5 Ų | 63.5 | 95% | 0.947 | 31% | 0.313 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82 | -10.1 | -179.3 | -59.2 | -177.4 | -176.6 | -178.6 | 0.5 | 115.2 | N39 | N39-R41 PolarHBondContact O-N 3.49Š|
| 42 | K | 91.1 | Very high | 88.1 | Confident | 149 Ų | 149 | 66.6 Ų | 66.6 | 65% | 0.648 | 34% | 0.341 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -88.6 | 125.3 | -179.1 | -62.7 | -169.7 | 179.9 | -176.4 | 0 | 110.2 | R38 N39 | R38-K42 HydrophobicContact CB-CB 4.46Å; R38-K42 PolarHBondContact N-O 3.45Å; N39-K42 PolarHBondContact N-O 3.37Å; N39-K42 WeakPolarHBondContact O-CB 3.18Å; N39-K42 PolarHBondContact O-N 3.12Å |
| 43 | T | 92.4 | Very high | 87.7 | Confident | 28 Ų | 28 | 72.1 Ų | 72.1 | 17% | 0.172 | 37% | 0.372 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.6 | 161.5 | 175.2 | 55.6 | 0 | 0 | 0 | 0 | 111.3 | I35 Q36 Q37 G87 D88 | I35-T43 HydrophobicContact CD1-CG2 4.02Å; I35-T43 HydrophobicContact CG1-CG2 4.27Å; Q36-T43 CarbonylContact O-C 3.6Å; Q36-T43 VanDerWaalsContact O-CA 3.26Å; Q36-T43 WeakPolarHBondContact O-CA 3.39Å; Q37-T43 HydrophobicContact CG-CG2 4.48Å; T43-G87 WeakPolarHBondContact O-CA 3.43Å; T43-G87 PolarHBondContact O-N 3.11Å; T43-G87 WeakPolarHBondContact OG1-CA 3.4Å; T43-D88 PolarHBondContact OG1-N 2.95Å |
| 44 | L | 91.8 | Very high | 87.2 | Confident | 39 Ų | 39 | 77.4 Ų | 77.4 | 20% | 0.204 | 39% | 0.393 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.1 | 128.4 | 173.1 | -67.3 | 171.2 | 0 | 0 | 0 | 106.9 | I35 Q36 R38 L85 Q86 | I35-L44 CarbonylContact C-O 3.57Å; I35-L44 WeakPolarHBondContact CA-O 3.35Å; Q36-L44 PolarHBondContact N-O 2.91Å; Q36-L44 PolarHBondContact O-N 3.45Å; R38-L44 HydrophobicContact CB-CD1 4.13Å; R38-L44 HydrophobicContact CB-CG 4.16Å; R38-L44 HydrophobicContact CG-CD1 4.35Å; L44-L85 CarbonylContact C-O 3.58Å; L44-L85 WeakPolarHBondContact CA-O 3.25Å; L44-Q86 HydrophobicContact CD2-CG 4.3Å |
| 45 | T | 92.7 | Very high | 86.9 | Confident | 0 Ų | 0 | 78 Ų | 78 | 0% | 0 | 40% | 0.402 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100 | 127.4 | 172.1 | -56.3 | 0 | 0 | 0 | 0 | 108.2 | I33 R34 Q84 L85 G87 Q89 I93 | I33-T45 HydrophobicContact CG2-CG2 3.63Å; R34-T45 CarbonylContact O-C 3.46Å; R34-T45 WeakPolarHBondContact O-CA 3.47Å; T45-Q84 WeakPolarHBondContact O-CA 3.34Å; T45-L85 PolarHBondContact N-O 2.89Å; T45-L85 PolarHBondContact O-N 2.86Å; T45-G87 PolarHBondContact OG1-O 2.92Å; T45-Q89 PolarHBondContact OG1-N 3.2Å; T45-Q89 VanDerWaalsContact OG1-N 3.15Å; T45-I93 HydrophobicContact CG2-CD1 3.53Å |
| 46 | T | 91.1 | Very high | 86.4 | Confident | 14 Ų | 14 | 78 Ų | 78 | 9% | 0.086 | 40% | 0.401 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.5 | 133.8 | 177.2 | 63.1 | 0 | 0 | 0 | 0 | 109.6 | I33 R34 I83 Q84 | I33-T46 WeakPolarHBondContact CA-O 3.49Å; R34-T46 PolarHBondContact N-O 2.84Å; R34-T46 PolarHBondContact O-N 3.09Å; R34-T46 PolarHBondContact O-OG1 2.79Å; T46-I83 CarbonylContact C-O 3.56Å; T46-I83 WeakPolarHBondContact CA-O 3.48Å; T46-Q84 HydrophobicContact CG2-CG 3.96Å |
| 47 | V | 89.7 | Confident | 86.3 | Confident | 1 Ų | 1 | 80.3 Ų | 80.3 | 1% | 0.006 | 41% | 0.409 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.1 | 118.1 | 175.2 | -171.6 | 0 | 0 | 0 | 0 | 107.5 | I31 H32 I33 I50 I83 I93 | I31-V47 HydrophobicContact CG2-CG1 3.67Å; H32-V47 WeakPolarHBondContact O-CA 3.39Å; I33-V47 HydrophobicContact CG1-CG1 4.47Å; V47-I50 HydrophobicContact CG1-CD1 3.99Å; V47-I50 HydrophobicContact CG1-CG1 4.07Å; V47-I83 HydrophobicContact CB-CB 4.43Å; V47-I83 PolarHBondContact N-O 2.98Å; V47-I83 PolarHBondContact O-N 2.86Å; V47-I83 VanDerWaalsContact O-N 3.07Å; V47-I93 HydrophobicContact CG2-CD1 3.94Å; V47-I93 HydrophobicContact CG2-CG2 3.94Å |
| 48 | Q | 88.9 | Confident | 86.1 | Confident | 18 Ų | 18 | 81.3 Ų | 81.3 | 8% | 0.084 | 41% | 0.412 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.9 | 153.7 | -179.5 | -51.3 | 176.6 | -19.8 | 0 | 0 | 109.4 | I31 H32 V82 | I31-Q48 WeakPolarHBondContact CA-O 3.39Å; H32-Q48 HydrophobicContact CB-CB 4.23Å; H32-Q48 PolarHBondContact N-O 2.9Å; H32-Q48 PolarHBondContact O-N 3.24Å; Q48-V82 HydrophobicContact CB-CG1 4.39Å; Q48-V82 HydrophobicContact CG-CG1 3.89Å |
| 49 | G | 83.6 | Confident | 86.1 | Confident | 45 Ų | 45 | 74.1 Ų | 74.1 | 46% | 0.464 | 39% | 0.386 | S | S | . | . | trans | 83.1 | 20.5 | 175 | 0 | 0 | 0 | 0 | 0 | 115 | I31 | I31-G49 VanDerWaalsContact CG1-O 3.27Å; I31-G49 WeakPolarHBondContact CG1-O 3.26Å | ||
| 50 | I | 82.8 | Confident | 86.1 | Confident | 14 Ų | 14 | 68.6 Ų | 68.6 | 7% | 0.072 | 36% | 0.357 | C | S | . | . | trans | -79.8 | 123.4 | 169.4 | -62.4 | -159.5 | 0 | 0 | 0 | 109 | I31 V47 K56 L59 I83 | I31-I50 HydrophobicContact CD1-CG1 4.38Å; V47-I50 HydrophobicContact CG1-CD1 3.99Å; V47-I50 HydrophobicContact CG1-CG1 4.07Å; I50-K56 HydrophobicContact CG2-CG 4.29Å; I50-K56 WeakPolarHBondContact O-CE 3.23Å; I50-L59 HydrophobicContact CD1-CD2 3.45Å; I50-L59 VanDerWaalsContact CD1-CD2 3.45Å; I50-I83 HydrophobicContact CD1-CD1 4.06Å | ||
| 51 | A | 78.8 | Confident | 86.4 | Confident | 42 Ų | 42 | 73.8 Ų | 73.8 | 35% | 0.347 | 37% | 0.367 | S | S | . | . | trans | -53.7 | 142.9 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | D53 Y54 | A51-D53 PolarHBondContact O-N 3.08Å; A51-Y54 HydrophobicContact CB-CD2 4.01Å; A51-Y54 HydrophobicContact CB-CE2 4.32Å; A51-Y54 PolarHBondContact O-N 3.12Å | ||
| 52 | A | 73.5 | Confident | 86.6 | Confident | 79 Ų | 79 | 63.6 Ų | 63.6 | 65% | 0.653 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66 | -21.9 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y54 | A52-Y54 PolarHBondContact O-N 2.99Š|
| 53 | D | 78.8 | Confident | 86.5 | Confident | 156 Ų | 156 | 56.5 Ų | 56.5 | 83% | 0.834 | 31% | 0.305 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.8 | -21.9 | 178.7 | -54.8 | -51 | 0 | 0 | 0 | 112.9 | A51 | A51-D53 PolarHBondContact O-N 3.08Š|
| 54 | Y | 80.1 | Confident | 86.4 | Confident | 113 Ų | 113 | 59.1 Ų | 59.1 | 44% | 0.443 | 31% | 0.314 | S | S | . | . | S | Bend | trans | -82.1 | 136.7 | 176.1 | -71.1 | -75.5 | 0 | 0 | 0 | 111.7 | A51 A52 K56 I102 | A51-Y54 HydrophobicContact CB-CD2 4.01Å; A51-Y54 HydrophobicContact CB-CE2 4.32Å; A51-Y54 PolarHBondContact O-N 3.12Å; A52-Y54 PolarHBondContact O-N 2.99Å; Y54-K56 VanDerWaalsContact C-N 3.31Å; Y54-K56 PolarHBondContact O-N 3.47Å; Y54-I102 HydrophobicContact CD2-CG2 4.37Å; Y54-I102 HydrophobicContact CE1-CG1 4.24Å; Y54-I102 HydrophobicContact CE1-CG2 4.15Å; Y54-I102 HydrophobicContact CE2-CG2 3.91Å |
| 55 | D | 84.1 | Confident | 86.3 | Confident | 95 Ų | 95 | 66.5 Ų | 66.5 | 51% | 0.508 | 34% | 0.344 | S | S | . | . | trans | -66.3 | 83.7 | 172.7 | -85.8 | -48.6 | 0 | 0 | 0 | 111.8 | K57 K58 L59 | D55-K57 PolarHBondContact O-N 3.18Å; D55-K57 VanDerWaalsContact O-N 3.13Å; D55-K58 HydrophobicContact CB-CB 3.93Å; D55-K58 HydrophobicContact CB-CD 3.75Å; D55-K58 HydrophobicContact CB-CG 3.87Å; D55-K58 WeakPolarHBondContact O-CB 3.46Å; D55-K58 PolarHBondContact O-N 3.45Å; D55-K58 WeakPolarHBondContact OD2-CD 3.41Å; D55-K58 VanDerWaalsContact OD2-CE 3.25Å; D55-K58 WeakPolarHBondContact OD2-CE 2.87Å; D55-K58 IonicContact OD2-NZ 2.69Å; D55-K58 PolarHBondContact OD2-NZ 2.77Å; D55-L59 PolarHBondContact O-N 2.77Å | ||
| 56 | K | 84.3 | Confident | 86.1 | Confident | 19 Ų | 19 | 71.3 Ų | 71.3 | 8% | 0.083 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -54.8 | -34.4 | 178.4 | -68.8 | 161.5 | -167.8 | 174 | 0 | 112.2 | I50 Y54 K58 L59 V60 V73 E81 I83 | I50-K56 HydrophobicContact CG2-CG 4.29Å; I50-K56 WeakPolarHBondContact O-CE 3.23Å; Y54-K56 VanDerWaalsContact C-N 3.31Å; Y54-K56 PolarHBondContact O-N 3.47Å; K56-K58 PolarHBondContact O-N 3.33Å; K56-L59 PolarHBondContact O-N 2.84Å; K56-V60 WeakPolarHBondContact O-CG2 3.37Å; K56-V60 PolarHBondContact O-N 3.39Å; K56-V73 HydrophobicContact CB-CG1 4.45Å; K56-V73 HydrophobicContact CB-CG2 4.04Å; K56-E81 HydrophobicContact CD-CB 4.04Å; K56-E81 WeakPolarHBondContact CD-OE2 3.12Å; K56-E81 WeakPolarHBondContact CE-OE2 3.5Å; K56-E81 VanDerWaalsContact NZ-CB 3.31Å; K56-E81 IonicContact NZ-OE2 2.91Å; K56-E81 PolarHBondContact NZ-OE2 2.82Å; K56-I83 HydrophobicContact CB-CD1 4.38Å; K56-I83 HydrophobicContact CG-CD1 4.47Å |
| 57 | K | 86.5 | Confident | 85.9 | Confident | 169 Ų | 169 | 71.8 Ų | 71.8 | 74% | 0.735 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -63.5 | -39 | 175.1 | -69.6 | 179.5 | -177.6 | 170.8 | 0 | 112.8 | D55 K61 | D55-K57 PolarHBondContact O-N 3.18Å; D55-K57 VanDerWaalsContact O-N 3.13Å; K57-K61 WeakPolarHBondContact O-CG 3.27Å; K57-K61 PolarHBondContact O-N 3.47Å; K57-K61 VanDerWaalsContact O-N 3.17Å |
| 58 | K | 88.7 | Confident | 85.9 | Confident | 136 Ų | 136 | 76.3 Ų | 76.3 | 59% | 0.591 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -71.3 | -40.3 | 175.5 | -69.1 | 179.1 | -174.2 | 156.1 | 0 | 110.4 | D55 K56 V60 K61 A62 | D55-K58 HydrophobicContact CB-CB 3.93Å; D55-K58 HydrophobicContact CB-CD 3.75Å; D55-K58 HydrophobicContact CB-CG 3.87Å; D55-K58 WeakPolarHBondContact O-CB 3.46Å; D55-K58 PolarHBondContact O-N 3.45Å; D55-K58 WeakPolarHBondContact OD2-CD 3.41Å; D55-K58 VanDerWaalsContact OD2-CE 3.25Å; D55-K58 WeakPolarHBondContact OD2-CE 2.87Å; D55-K58 IonicContact OD2-NZ 2.69Å; D55-K58 PolarHBondContact OD2-NZ 2.77Å; K56-K58 PolarHBondContact O-N 3.33Å; K58-V60 PolarHBondContact O-N 3.07Å; K58-K61 WeakPolarHBondContact O-CB 3.36Å; K58-K61 PolarHBondContact O-N 3.21Å; K58-A62 PolarHBondContact O-N 3.17Å |
| 59 | L | 87.8 | Confident | 85.9 | Confident | 20 Ų | 20 | 76.8 Ų | 76.8 | 11% | 0.105 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -59.4 | -46.9 | 175.9 | -154.3 | 81.8 | 0 | 0 | 0 | 111.4 | I50 D55 K56 K61 A62 F63 I83 F96 I100 I102 | I50-L59 HydrophobicContact CD1-CD2 3.45Å; I50-L59 VanDerWaalsContact CD1-CD2 3.45Å; D55-L59 PolarHBondContact O-N 2.77Å; K56-L59 PolarHBondContact O-N 2.84Å; L59-K61 VanDerWaalsContact C-N 3.33Å; L59-K61 PolarHBondContact O-N 3.38Å; L59-A62 WeakPolarHBondContact O-CB 3.38Å; L59-A62 PolarHBondContact O-N 3.42Å; L59-A62 VanDerWaalsContact O-N 3.12Å; L59-F63 HydrophobicContact CB-CE2 4.41Å; L59-F63 HydrophobicContact CD2-CD2 4.41Å; L59-F63 HydrophobicContact CD2-CE2 3.41Å; L59-F63 VanDerWaalsContact CD2-CE2 3.41Å; L59-F63 HydrophobicContact CD2-CZ 3.59Å; L59-F63 HydrophobicContact CG-CD2 4.21Å; L59-F63 HydrophobicContact CG-CE1 4.49Å; L59-F63 HydrophobicContact CG-CE2 3.59Å; L59-F63 HydrophobicContact CG-CZ 3.76Å; L59-F63 VanDerWaalsContact O-CD2 3.32Å; L59-F63 WeakPolarHBondContact O-CD2 3.27Å; L59-F63 VanDerWaalsContact O-CG 3.29Å; L59-F63 WeakPolarHBondContact O-CG 3.49Å; L59-F63 PolarHBondContact O-N 3.48Å; L59-I83 HydrophobicContact CB-CD1 4.41Å; L59-I83 HydrophobicContact CD2-CD1 3.65Å; L59-F96 HydrophobicContact CD1-CE1 4.34Å; L59-I100 HydrophobicContact CD1-CD1 4.33Å; L59-I102 HydrophobicContact CD1-CD1 3.88Å |
| 60 | V | 90 | Very high | 86.3 | Confident | 7 Ų | 7 | 78.8 Ų | 78.8 | 4% | 0.042 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -61.4 | -38.9 | 175.6 | 171.4 | 0 | 0 | 0 | 0 | 112.2 | K56 K58 A62 F63 K64 V73 I83 | K56-V60 WeakPolarHBondContact O-CG2 3.37Å; K56-V60 PolarHBondContact O-N 3.39Å; K58-V60 PolarHBondContact O-N 3.07Å; V60-A62 VanDerWaalsContact C-N 3.35Å; V60-F63 PolarHBondContact O-N 2.92Å; V60-K64 HydrophobicContact CG1-CD 4.19Å; V60-K64 HydrophobicContact CG1-CG 4.48Å; V60-K64 WeakPolarHBondContact O-CB 3.34Å; V60-K64 VanDerWaalsContact O-CG 3.27Å; V60-K64 WeakPolarHBondContact O-CG 3.25Å; V60-K64 PolarHBondContact O-N 3.44Å; V60-V73 HydrophobicContact CG2-CG2 3.66Å; V60-I83 HydrophobicContact CG2-CB 4.48Å; V60-I83 HydrophobicContact CG2-CD1 4.04Å; V60-I83 HydrophobicContact CG2-CG1 4.07Å; V60-I83 HydrophobicContact CG2-CG2 3.68Å |
| 61 | K | 90.9 | Very high | 86.7 | Confident | 155 Ų | 155 | 78.3 Ų | 78.3 | 67% | 0.674 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -63.1 | -41.5 | 173.9 | -76.2 | 179.2 | 179.9 | -178.7 | 0 | 111.8 | K57 K58 L59 K64 K65 | K57-K61 WeakPolarHBondContact O-CG 3.27Å; K57-K61 PolarHBondContact O-N 3.47Å; K57-K61 VanDerWaalsContact O-N 3.17Å; K58-K61 WeakPolarHBondContact O-CB 3.36Å; K58-K61 PolarHBondContact O-N 3.21Å; L59-K61 VanDerWaalsContact C-N 3.33Å; L59-K61 PolarHBondContact O-N 3.38Å; K61-K64 PolarHBondContact O-N 2.85Å; K61-K65 PolarHBondContact O-N 3.19Å; K61-K65 VanDerWaalsContact O-N 3.07Å |
| 62 | A | 90.3 | Very high | 87.3 | Confident | 36 Ų | 36 | 79.7 Ų | 79.7 | 30% | 0.298 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -66.2 | -42.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | K58 L59 V60 K64 K65 K66 F96 | K58-A62 PolarHBondContact O-N 3.17Å; L59-A62 WeakPolarHBondContact O-CB 3.38Å; L59-A62 PolarHBondContact O-N 3.42Å; L59-A62 VanDerWaalsContact O-N 3.12Å; V60-A62 VanDerWaalsContact C-N 3.35Å; A62-K64 PolarHBondContact O-N 2.85Å; A62-K65 PolarHBondContact O-N 3.41Å; A62-K66 WeakPolarHBondContact O-CB 3.44Å; A62-K66 PolarHBondContact O-N 2.91Å; A62-F96 HydrophobicContact CB-CE1 4.41Å; A62-F96 HydrophobicContact CB-CZ 3.73Å |
| 63 | F | 89.5 | Confident | 88.1 | Confident | 0 Ų | 0 | 77.8 Ų | 77.8 | 0% | 0 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -59.5 | -45 | 173.4 | -67.9 | -37.4 | 0 | 0 | 0 | 112.5 | L59 V60 K65 K66 F67 I83 L85 I93 F96 | L59-F63 HydrophobicContact CB-CE2 4.41Å; L59-F63 HydrophobicContact CD2-CD2 4.41Å; L59-F63 HydrophobicContact CD2-CE2 3.41Å; L59-F63 VanDerWaalsContact CD2-CE2 3.41Å; L59-F63 HydrophobicContact CD2-CZ 3.59Å; L59-F63 HydrophobicContact CG-CD2 4.21Å; L59-F63 HydrophobicContact CG-CE1 4.49Å; L59-F63 HydrophobicContact CG-CE2 3.59Å; L59-F63 HydrophobicContact CG-CZ 3.76Å; L59-F63 VanDerWaalsContact O-CD2 3.32Å; L59-F63 WeakPolarHBondContact O-CD2 3.27Å; L59-F63 VanDerWaalsContact O-CG 3.29Å; L59-F63 WeakPolarHBondContact O-CG 3.49Å; L59-F63 PolarHBondContact O-N 3.48Å; V60-F63 PolarHBondContact O-N 2.92Å; F63-K65 VanDerWaalsContact C-N 3.3Å; F63-K65 PolarHBondContact O-N 3.42Å; F63-K66 PolarHBondContact O-N 2.88Å; F63-F67 HydrophobicContact CB-CD2 3.96Å; F63-F67 HydrophobicContact CB-CE2 4.08Å; F63-F67 AromaticContact CD1-CD2 3.97Å; F63-F67 HydrophobicContact CD1-CD2 3.97Å; F63-F67 AromaticContact CD1-CE2 3.2Å; F63-F67 HydrophobicContact CD1-CE2 3.2Å; F63-F67 AromaticContact CD1-CZ 3.82Å; F63-F67 HydrophobicContact CD1-CZ 3.82Å; F63-F67 AromaticContact CE1-CE2 3.76Å; F63-F67 HydrophobicContact CE1-CE2 3.76Å; F63-F67 HydrophobicContact CE1-CZ 4.18Å; F63-F67 HydrophobicContact CG-CD2 4.31Å; F63-F67 AromaticContact CG-CE2 3.93Å; F63-F67 HydrophobicContact CG-CE2 3.93Å; F63-F67 WeakPolarHBondContact O-CB 3.48Å; F63-F67 PolarHBondContact O-N 3.39Å; F63-I83 HydrophobicContact CD2-CG2 4.28Å; F63-I83 HydrophobicContact CE2-CD1 4.12Å; F63-I83 HydrophobicContact CE2-CG2 4.29Å; F63-L85 HydrophobicContact CB-CD1 4.47Å; F63-L85 HydrophobicContact CB-CD2 3.94Å; F63-L85 HydrophobicContact CD2-CD1 4.08Å; F63-L85 HydrophobicContact CD2-CD2 4.41Å; F63-L85 HydrophobicContact CE2-CD1 4.46Å; F63-L85 HydrophobicContact CG-CD1 4.28Å; F63-I93 HydrophobicContact CZ-CG2 4.48Å; F63-F96 AromaticContact CD1-CD1 3.7Å; F63-F96 HydrophobicContact CD1-CD1 3.7Å; F63-F96 AromaticContact CD1-CE1 3.62Å; F63-F96 HydrophobicContact CD1-CE1 3.62Å; F63-F96 HydrophobicContact CD1-CG 4.41Å; F63-F96 HydrophobicContact CD1-CZ 4.38Å; F63-F96 AromaticContact CE1-CD1 3.16Å; F63-F96 HydrophobicContact CE1-CD1 3.16Å; F63-F96 AromaticContact CE1-CE1 3.41Å; F63-F96 HydrophobicContact CE1-CE1 3.41Å; F63-F96 VanDerWaalsContact CE1-CE1 3.41Å; F63-F96 HydrophobicContact CE1-CG 4.06Å; F63-F96 HydrophobicContact CZ-CD1 4.11Å; F63-F96 HydrophobicContact CZ-CE1 4.25Å |
| 64 | K | 90.4 | Very high | 88.6 | Confident | 84 Ų | 84 | 72.9 Ų | 72.9 | 37% | 0.365 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -58 | -42.9 | 175.2 | -75.5 | 174.4 | 177.5 | -175.7 | 0 | 111.9 | V60 K61 A62 A68 C69 N70 G71 | V60-K64 HydrophobicContact CG1-CD 4.19Å; V60-K64 HydrophobicContact CG1-CG 4.48Å; V60-K64 WeakPolarHBondContact O-CB 3.34Å; V60-K64 VanDerWaalsContact O-CG 3.27Å; V60-K64 WeakPolarHBondContact O-CG 3.25Å; V60-K64 PolarHBondContact O-N 3.44Å; K61-K64 PolarHBondContact O-N 2.85Å; A62-K64 PolarHBondContact O-N 2.85Å; K64-A68 WeakPolarHBondContact O-CA 3.32Å; K64-A68 PolarHBondContact O-N 2.91Å; K64-A68 VanDerWaalsContact O-N 3.17Å; K64-C69 WeakPolarHBondContact CA-O 3.29Å; K64-C69 WeakPolarHBondContact CG-O 3.49Å; K64-N70 WeakPolarHBondContact CE-OD1 3.23Å; K64-N70 PolarHBondContact NZ-OD1 3.1Å; K64-G71 VanDerWaalsContact CE-N 3.34Å; K64-G71 WeakPolarHBondContact CE-O 3.31Å; K64-G71 PolarHBondContact NZ-O 3.3Å |
| 65 | K | 90.6 | Very high | 88.8 | Confident | 194 Ų | 194 | 74.9 Ų | 74.9 | 84% | 0.843 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -70.6 | -40.4 | -179.1 | -168.4 | 176.2 | -178.9 | -177.9 | 0 | 112.6 | K61 A62 F63 | K61-K65 PolarHBondContact O-N 3.19Å; K61-K65 VanDerWaalsContact O-N 3.07Å; A62-K65 PolarHBondContact O-N 3.41Å; F63-K65 VanDerWaalsContact C-N 3.3Å; F63-K65 PolarHBondContact O-N 3.42Å |
| 66 | K | 88.8 | Confident | 88.6 | Confident | 100 Ų | 100 | 73.7 Ų | 73.7 | 44% | 0.435 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -84.1 | -36.5 | -175.1 | -163.7 | 160.9 | -179.9 | 168.2 | 0 | 113.1 | A62 F63 F96 E99 | A62-K66 WeakPolarHBondContact O-CB 3.44Å; A62-K66 PolarHBondContact O-N 2.91Å; F63-K66 PolarHBondContact O-N 2.88Å; K66-F96 HydrophobicContact CD-CD2 3.48Å; K66-F96 VanDerWaalsContact CD-CD2 3.48Å; K66-F96 HydrophobicContact CD-CE2 3.61Å; K66-E99 IonicContact NZ-OE1 2.62Å; K66-E99 PolarHBondContact NZ-OE1 3.07Å; K66-E99 IonicContact NZ-OE2 2.67Å; K66-E99 PolarHBondContact NZ-OE2 3.42Å |
| 67 | F | 87 | Confident | 88.3 | Confident | 24 Ų | 24 | 79.4 Ų | 79.4 | 11% | 0.105 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -100.6 | -4.1 | -174.7 | -50 | -33.2 | 0 | 0 | 0 | 113.6 | F63 C69 N92 I93 F96 | F63-F67 HydrophobicContact CB-CD2 3.96Å; F63-F67 HydrophobicContact CB-CE2 4.08Å; F63-F67 AromaticContact CD1-CD2 3.97Å; F63-F67 HydrophobicContact CD1-CD2 3.97Å; F63-F67 AromaticContact CD1-CE2 3.2Å; F63-F67 HydrophobicContact CD1-CE2 3.2Å; F63-F67 AromaticContact CD1-CZ 3.82Å; F63-F67 HydrophobicContact CD1-CZ 3.82Å; F63-F67 AromaticContact CE1-CE2 3.76Å; F63-F67 HydrophobicContact CE1-CE2 3.76Å; F63-F67 HydrophobicContact CE1-CZ 4.18Å; F63-F67 HydrophobicContact CG-CD2 4.31Å; F63-F67 AromaticContact CG-CE2 3.93Å; F63-F67 HydrophobicContact CG-CE2 3.93Å; F63-F67 WeakPolarHBondContact O-CB 3.48Å; F63-F67 PolarHBondContact O-N 3.39Å; F67-C69 HydrophobicContact CB-CB 4.29Å; F67-C69 PolarHBondContact O-N 2.97Å; F67-C69 PolarHBondContact O-SG 3.08Å; F67-N92 HydrophobicContact CD1-CB 3.84Å; F67-N92 HydrophobicContact CE1-CB 3.58Å; F67-N92 HydrophobicContact CG-CB 4.48Å; F67-N92 HydrophobicContact CZ-CB 3.95Å; F67-N92 WeakPolarHBondContact CZ-O 3.48Å; F67-I93 HydrophobicContact CE2-CG1 3.85Å; F67-I93 HydrophobicContact CZ-CG1 4.43Å; F67-F96 HydrophobicContact CE1-CB 4.41Å; F67-F96 HydrophobicContact CZ-CB 3.79Å; F67-F96 HydrophobicContact CZ-CG 4.11Å |
| 68 | A | 88.8 | Confident | 87.9 | Confident | 97 Ų | 97 | 78.4 Ų | 78.4 | 80% | 0.802 | 41% | 0.407 | S | S | * | . | trans | 50.4 | 29.2 | -174.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | K64 | K64-A68 WeakPolarHBondContact O-CA 3.32Å; K64-A68 PolarHBondContact O-N 2.91Å; K64-A68 VanDerWaalsContact O-N 3.17Å | ||
| 69 | C | 89.3 | Confident | 86.9 | Confident | 28 Ų | 28 | 77.1 Ų | 77.1 | 19% | 0.189 | 40% | 0.399 | C | S | . | . | trans | -112.4 | 152.1 | -177.2 | -71.8 | 0 | 0 | 0 | 0 | 110.6 | K64 F67 Q86 Q89 | K64-C69 WeakPolarHBondContact CA-O 3.29Å; K64-C69 WeakPolarHBondContact CG-O 3.49Å; F67-C69 HydrophobicContact CB-CB 4.29Å; F67-C69 PolarHBondContact O-N 2.97Å; F67-C69 PolarHBondContact O-SG 3.08Å; C69-Q86 PolarHBondContact SG-O 3.34Å; C69-Q89 PolarHBondContact SG-NE2 2.62Å | ||
| 70 | N | 91.1 | Very high | 86.7 | Confident | 86 Ų | 86 | 77.7 Ų | 77.7 | 46% | 0.46 | 41% | 0.41 | S | S | . | . | trans | -78.7 | 147.3 | 170.6 | -161.2 | 7.2 | 0 | 0 | 0 | 110.5 | K64 Q86 | K64-N70 WeakPolarHBondContact CE-OD1 3.23Å; K64-N70 PolarHBondContact NZ-OD1 3.1Å; N70-Q86 HydrophobicContact CB-CG 4.25Å; N70-Q86 PolarHBondContact O-N 2.94Å | ||
| 71 | G | 91.6 | Very high | 86.4 | Confident | 5 Ų | 5 | 81.5 Ų | 81.5 | 5% | 0.052 | 43% | 0.427 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -151.4 | 150.1 | -177.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | K64 Q84 | K64-G71 VanDerWaalsContact CE-N 3.34Å; K64-G71 WeakPolarHBondContact CE-O 3.31Å; K64-G71 PolarHBondContact NZ-O 3.3Å; G71-Q84 CarbonylContact C-O 3.49Å; G71-Q84 WeakPolarHBondContact CA-O 3.45Å |
| 72 | T | 91.2 | Very high | 86.3 | Confident | 70 Ų | 70 | 74.2 Ų | 74.2 | 43% | 0.429 | 40% | 0.395 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.4 | 150.5 | 177.8 | -171.4 | 0 | 0 | 0 | 0 | 110.1 | I74 Q84 | T72-I74 HydrophobicContact CG2-CD1 3.44Å; T72-I74 VanDerWaalsContact CG2-CD1 3.44Å; T72-I74 HydrophobicContact CG2-CG1 3.75Å; T72-Q84 HydrophobicContact CG2-CB 4.16Å; T72-Q84 PolarHBondContact N-O 3.03Å; T72-Q84 PolarHBondContact O-N 3.26Å |
| 73 | V | 90.4 | Very high | 86.3 | Confident | 39 Ų | 39 | 72.6 Ų | 72.6 | 24% | 0.236 | 38% | 0.382 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.3 | 130.1 | 164.8 | -172.7 | 0 | 0 | 0 | 0 | 106.1 | K56 V60 E81 V82 I83 | K56-V73 HydrophobicContact CB-CG1 4.45Å; K56-V73 HydrophobicContact CB-CG2 4.04Å; V60-V73 HydrophobicContact CG2-CG2 3.66Å; V73-E81 HydrophobicContact CG1-CB 4.45Å; V73-V82 WeakPolarHBondContact CA-O 3.49Å; V73-I83 HydrophobicContact CG2-CG1 4.42Å |
| 74 | I | 89 | Confident | 86.4 | Confident | 54 Ų | 54 | 74.4 Ų | 74.4 | 28% | 0.277 | 39% | 0.39 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.4 | 136.8 | 176.8 | -75.6 | 162.8 | 0 | 0 | 0 | 107.3 | T72 V82 Q84 | T72-I74 HydrophobicContact CG2-CD1 3.44Å; T72-I74 VanDerWaalsContact CG2-CD1 3.44Å; T72-I74 HydrophobicContact CG2-CG1 3.75Å; I74-V82 HydrophobicContact CB-CG2 4.27Å; I74-V82 PolarHBondContact N-O 3.07Å; I74-V82 WeakPolarHBondContact O-CG2 3.32Å; I74-V82 PolarHBondContact O-N 2.86Å; I74-V82 VanDerWaalsContact O-O 3.07Å; I74-Q84 HydrophobicContact CB-CG 4.46Å; I74-Q84 HydrophobicContact CD1-CB 4.27Å; I74-Q84 HydrophobicContact CD1-CG 3.8Å |
| 75 | E | 85.6 | Confident | 86.5 | Confident | 155 Ų | 155 | 70.4 Ų | 70.4 | 72% | 0.724 | 37% | 0.373 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -89.4 | 121.8 | 171.7 | -166.4 | 174.9 | 178.5 | 0 | 0 | 109.1 | E81 | E75-E81 HydrophobicContact CG-CG 4.4Å |
| 76 | H | 78.8 | Confident | 86.6 | Confident | 69 Ų | 69 | 65.6 Ų | 65.6 | 32% | 0.319 | 35% | 0.353 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.9 | 139 | 170.9 | -91.5 | -66 | 0 | 0 | 0 | 110.1 | E78 Y79 G80 V82 | H76-E78 VanDerWaalsContact C-N 3.25Å; H76-E78 PolarHBondContact O-N 2.84Å; H76-Y79 HydrophobicContact CB-CD2 4.43Å; H76-G80 PolarHBondContact N-O 2.88Å; H76-G80 VanDerWaalsContact O-CA 3.26Å; H76-G80 WeakPolarHBondContact O-CA 3.48Å; H76-G80 PolarHBondContact O-N 2.87Å; H76-V82 VanDerWaalsContact CD2-CG2 3.48Å; H76-V82 WeakPolarHBondContact CD2-CG2 3.33Å |
| 77 | P | 78.8 | Confident | 86.7 | Confident | 139 Ų | 139 | 62 Ų | 62 | 90% | 0.903 | 35% | 0.345 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.6 | -25.9 | -178.2 | 25.4 | -34 | 0 | 0 | 0 | 113.7 | ||
| 78 | E | 76.6 | Confident | 86.8 | Confident | 149 Ų | 149 | 64 Ų | 64 | 70% | 0.696 | 36% | 0.357 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97 | -33.1 | -178.4 | -167.3 | -176.8 | 150.5 | 0 | 0 | 113 | H76 | H76-E78 VanDerWaalsContact C-N 3.25Å; H76-E78 PolarHBondContact O-N 2.84Å |
| 79 | Y | 69.4 | Low | 86.7 | Confident | 108 Ų | 108 | 60.6 Ų | 60.6 | 42% | 0.424 | 32% | 0.324 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -113.4 | 2.4 | -171.2 | -53 | -58 | 0 | 0 | 0 | 113.7 | H76 | H76-Y79 HydrophobicContact CB-CD2 4.43Š|
| 80 | G | 82.1 | Confident | 86.7 | Confident | 32 Ų | 32 | 63.6 Ų | 63.6 | 33% | 0.33 | 33% | 0.331 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 67.3 | -152.4 | -175 | 0 | 0 | 0 | 0 | 0 | 113.1 | H76 V82 | H76-G80 PolarHBondContact N-O 2.88Å; H76-G80 VanDerWaalsContact O-CA 3.26Å; H76-G80 WeakPolarHBondContact O-CA 3.48Å; H76-G80 PolarHBondContact O-N 2.87Å; G80-V82 PolarHBondContact O-N 2.96Å |
| 81 | E | 84 | Confident | 86.6 | Confident | 88 Ų | 88 | 66.9 Ų | 66.9 | 41% | 0.411 | 34% | 0.342 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.5 | 114 | 177.3 | -79.9 | -171.3 | 138.9 | 0 | 0 | 112 | K56 V73 E75 | K56-E81 HydrophobicContact CD-CB 4.04Å; K56-E81 WeakPolarHBondContact CD-OE2 3.12Å; K56-E81 WeakPolarHBondContact CE-OE2 3.5Å; K56-E81 VanDerWaalsContact NZ-CB 3.31Å; K56-E81 IonicContact NZ-OE2 2.91Å; K56-E81 PolarHBondContact NZ-OE2 2.82Å; V73-E81 HydrophobicContact CG1-CB 4.45Å; E75-E81 HydrophobicContact CG-CG 4.4Å |
| 82 | V | 88.7 | Confident | 86.5 | Confident | 1 Ų | 1 | 69.9 Ų | 69.9 | 1% | 0.006 | 36% | 0.357 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.8 | 156.1 | 174.7 | -53.9 | 0 | 0 | 0 | 0 | 111.2 | Q48 V73 I74 H76 G80 Q84 | Q48-V82 HydrophobicContact CB-CG1 4.39Å; Q48-V82 HydrophobicContact CG-CG1 3.89Å; V73-V82 WeakPolarHBondContact CA-O 3.49Å; I74-V82 HydrophobicContact CB-CG2 4.27Å; I74-V82 PolarHBondContact N-O 3.07Å; I74-V82 WeakPolarHBondContact O-CG2 3.32Å; I74-V82 PolarHBondContact O-N 2.86Å; I74-V82 VanDerWaalsContact O-O 3.07Å; H76-V82 VanDerWaalsContact CD2-CG2 3.48Å; H76-V82 WeakPolarHBondContact CD2-CG2 3.33Å; G80-V82 PolarHBondContact O-N 2.96Å; V82-Q84 HydrophobicContact CG2-CG 4.19Å |
| 83 | I | 90.9 | Very high | 86.3 | Confident | 2 Ų | 2 | 66.6 Ų | 66.6 | 1% | 0.01 | 34% | 0.336 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.7 | 125.4 | 170.3 | -63.3 | 174.4 | 0 | 0 | 0 | 108.7 | T46 V47 I50 K56 L59 V60 F63 V73 L85 | T46-I83 CarbonylContact C-O 3.56Å; T46-I83 WeakPolarHBondContact CA-O 3.48Å; V47-I83 HydrophobicContact CB-CB 4.43Å; V47-I83 PolarHBondContact N-O 2.98Å; V47-I83 PolarHBondContact O-N 2.86Å; V47-I83 VanDerWaalsContact O-N 3.07Å; I50-I83 HydrophobicContact CD1-CD1 4.06Å; K56-I83 HydrophobicContact CB-CD1 4.38Å; K56-I83 HydrophobicContact CG-CD1 4.47Å; L59-I83 HydrophobicContact CB-CD1 4.41Å; L59-I83 HydrophobicContact CD2-CD1 3.65Å; V60-I83 HydrophobicContact CG2-CB 4.48Å; V60-I83 HydrophobicContact CG2-CD1 4.04Å; V60-I83 HydrophobicContact CG2-CG1 4.07Å; V60-I83 HydrophobicContact CG2-CG2 3.68Å; F63-I83 HydrophobicContact CD2-CG2 4.28Å; F63-I83 HydrophobicContact CE2-CD1 4.12Å; F63-I83 HydrophobicContact CE2-CG2 4.29Å; V73-I83 HydrophobicContact CG2-CG1 4.42Å; I83-L85 HydrophobicContact CG2-CG 4.22Å |
| 84 | Q | 91.3 | Very high | 86.2 | Confident | 38 Ų | 38 | 66 Ų | 66 | 18% | 0.178 | 33% | 0.334 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.2 | 132.1 | 172.8 | -58.9 | -162.8 | -9.2 | 0 | 0 | 110.4 | T45 T46 G71 T72 I74 V82 | T45-Q84 WeakPolarHBondContact O-CA 3.34Å; T46-Q84 HydrophobicContact CG2-CG 3.96Å; G71-Q84 CarbonylContact C-O 3.49Å; G71-Q84 WeakPolarHBondContact CA-O 3.45Å; T72-Q84 HydrophobicContact CG2-CB 4.16Å; T72-Q84 PolarHBondContact N-O 3.03Å; T72-Q84 PolarHBondContact O-N 3.26Å; I74-Q84 HydrophobicContact CB-CG 4.46Å; I74-Q84 HydrophobicContact CD1-CB 4.27Å; I74-Q84 HydrophobicContact CD1-CG 3.8Å; V82-Q84 HydrophobicContact CG2-CG 4.19Å |
| 85 | L | 93.3 | Very high | 86.2 | Confident | 0 Ų | 0 | 69.4 Ų | 69.4 | 0% | 0 | 35% | 0.348 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.7 | 146.9 | 177.5 | -68.5 | 164.1 | 0 | 0 | 0 | 109.9 | L44 T45 F63 I83 I93 | L44-L85 CarbonylContact C-O 3.58Å; L44-L85 WeakPolarHBondContact CA-O 3.25Å; T45-L85 PolarHBondContact N-O 2.89Å; T45-L85 PolarHBondContact O-N 2.86Å; F63-L85 HydrophobicContact CB-CD1 4.47Å; F63-L85 HydrophobicContact CB-CD2 3.94Å; F63-L85 HydrophobicContact CD2-CD1 4.08Å; F63-L85 HydrophobicContact CD2-CD2 4.41Å; F63-L85 HydrophobicContact CE2-CD1 4.46Å; F63-L85 HydrophobicContact CG-CD1 4.28Å; I83-L85 HydrophobicContact CG2-CG 4.22Å; L85-I93 HydrophobicContact CD1-CD1 3.5Å; L85-I93 HydrophobicContact CD1-CG1 3.88Å |
| 86 | Q | 91.3 | Very high | 86.4 | Confident | 93 Ų | 93 | 62.8 Ų | 62.8 | 44% | 0.435 | 32% | 0.317 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.5 | 137.8 | 175 | -64.5 | -175.6 | -1 | 0 | 0 | 111.2 | L44 C69 N70 | L44-Q86 HydrophobicContact CD2-CG 4.3Å; C69-Q86 PolarHBondContact SG-O 3.34Å; N70-Q86 HydrophobicContact CB-CG 4.25Å; N70-Q86 PolarHBondContact O-N 2.94Å |
| 87 | G | 90.8 | Very high | 86.7 | Confident | 25 Ų | 25 | 59.5 Ų | 59.5 | 26% | 0.258 | 30% | 0.302 | S | S | . | . | S | Bend | trans | 86.8 | 175.4 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114 | T43 T45 Q89 | T43-G87 WeakPolarHBondContact O-CA 3.43Å; T43-G87 PolarHBondContact O-N 3.11Å; T43-G87 WeakPolarHBondContact OG1-CA 3.4Å; T45-G87 PolarHBondContact OG1-O 2.92Å; G87-Q89 PolarHBondContact O-N 2.86Å |
| 88 | D | 89.8 | Confident | 87 | Confident | 67 Ų | 67 | 56.8 Ų | 56.8 | 36% | 0.358 | 28% | 0.278 | S | S | . | . | trans | -82.2 | 107.6 | 169.2 | -177.9 | 3.5 | 0 | 0 | 0 | 108.4 | I35 T43 R90 | I35-D88 HydrophobicContact CD1-CB 3.63Å; T43-D88 PolarHBondContact OG1-N 2.95Å; D88-R90 WeakPolarHBondContact OD1-CB 3.39Å; D88-R90 WeakPolarHBondContact OD1-CD 3.42Å; D88-R90 WeakPolarHBondContact OD1-CG 3.45Å; D88-R90 PolarHBondContact OD1-N 3.11Å; D88-R90 IonicContact OD1-NE 3.53Å; D88-R90 IonicContact OD2-CZ 3.66Å; D88-R90 IonicContact OD2-NE 2.97Å; D88-R90 PolarHBondContact OD2-NE 3.15Å; D88-R90 IonicContact OD2-NH2 3.66Å | ||
| 89 | Q | 86.1 | Confident | 87.5 | Confident | 24 Ų | 24 | 55.6 Ų | 55.6 | 11% | 0.112 | 27% | 0.273 | C | S | . | . | trans | -118.9 | 17.3 | 179.2 | -62.4 | -61.6 | -27.7 | 0 | 0 | 111.6 | T45 C69 G87 K91 N92 I93 | T45-Q89 PolarHBondContact OG1-N 3.2Å; T45-Q89 VanDerWaalsContact OG1-N 3.15Å; C69-Q89 PolarHBondContact SG-NE2 2.62Å; G87-Q89 PolarHBondContact O-N 2.86Å; Q89-K91 VanDerWaalsContact C-N 3.32Å; Q89-K91 PolarHBondContact O-N 3.37Å; Q89-N92 PolarHBondContact O-N 3.26Å; Q89-N92 VanDerWaalsContact O-N 3.15Å; Q89-N92 PolarHBondContact OE1-ND2 2.98Å; Q89-I93 HydrophobicContact CB-CD1 3.74Å; Q89-I93 HydrophobicContact CB-CG1 4.01Å; Q89-I93 WeakPolarHBondContact O-CB 3.25Å; Q89-I93 WeakPolarHBondContact O-CD1 3.37Å; Q89-I93 VanDerWaalsContact O-CG1 3.25Å; Q89-I93 WeakPolarHBondContact O-CG1 3.49Å; Q89-I93 PolarHBondContact O-N 2.87Å | ||
| 90 | R | 89.5 | Confident | 88.1 | Confident | 91 Ų | 91 | 54.3 Ų | 54.3 | 34% | 0.343 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -56.6 | -43 | -171.8 | 69 | -166 | 158.8 | 149 | -0.8 | 113.6 | I33 D88 C94 V110 | I33-R90 HydrophobicContact CG2-CB 4.27Å; D88-R90 WeakPolarHBondContact OD1-CB 3.39Å; D88-R90 WeakPolarHBondContact OD1-CD 3.42Å; D88-R90 WeakPolarHBondContact OD1-CG 3.45Å; D88-R90 PolarHBondContact OD1-N 3.11Å; D88-R90 IonicContact OD1-NE 3.53Å; D88-R90 IonicContact OD2-CZ 3.66Å; D88-R90 IonicContact OD2-NE 2.97Å; D88-R90 PolarHBondContact OD2-NE 3.15Å; D88-R90 IonicContact OD2-NH2 3.66Å; R90-C94 VanDerWaalsContact O-CB 3.25Å; R90-C94 WeakPolarHBondContact O-CB 3.45Å; R90-C94 PolarHBondContact O-N 2.86Å; R90-C94 VanDerWaalsContact O-N 3.11Å; R90-V110 HydrophobicContact CB-CG1 3.98Å; R90-V110 HydrophobicContact CG-CG1 4.44Å |
| 91 | K | 88.7 | Confident | 87.9 | Confident | 156 Ų | 156 | 55.7 Ų | 55.7 | 68% | 0.678 | 29% | 0.287 | S | S | * | . | H | α-helix | trans | -69.4 | -44.1 | 179.2 | -64.2 | -174.8 | 178.7 | -176.5 | 0 | 111.5 | Q89 C94 Q95 | Q89-K91 VanDerWaalsContact C-N 3.32Å; Q89-K91 PolarHBondContact O-N 3.37Å; K91-C94 PolarHBondContact O-N 3.15Å; K91-Q95 WeakPolarHBondContact O-CB 3.17Å; K91-Q95 PolarHBondContact O-N 3.46Å |
| 92 | N | 89.5 | Confident | 87.3 | Confident | 68 Ų | 68 | 53.2 Ų | 53.2 | 36% | 0.364 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -68.7 | -40.4 | -176.7 | -66.6 | -16.7 | 0 | 0 | 0 | 111.8 | F67 Q89 F96 | F67-N92 HydrophobicContact CD1-CB 3.84Å; F67-N92 HydrophobicContact CE1-CB 3.58Å; F67-N92 HydrophobicContact CG-CB 4.48Å; F67-N92 HydrophobicContact CZ-CB 3.95Å; F67-N92 WeakPolarHBondContact CZ-O 3.48Å; Q89-N92 PolarHBondContact O-N 3.26Å; Q89-N92 VanDerWaalsContact O-N 3.15Å; Q89-N92 PolarHBondContact OE1-ND2 2.98Å; N92-F96 VanDerWaalsContact O-CB 3.23Å; N92-F96 WeakPolarHBondContact O-CB 3.47Å; N92-F96 PolarHBondContact O-N 3.2Å |
| 93 | I | 88.7 | Confident | 86.7 | Confident | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -66.7 | -44.2 | 175.2 | -64.4 | 161.3 | 0 | 0 | 0 | 110.1 | I33 T45 V47 F63 F67 L85 Q89 Q95 F96 L97 | I33-I93 HydrophobicContact CD1-CB 4.11Å; I33-I93 HydrophobicContact CD1-CG2 3.59Å; I33-I93 HydrophobicContact CG1-CG2 4.27Å; T45-I93 HydrophobicContact CG2-CD1 3.53Å; V47-I93 HydrophobicContact CG2-CD1 3.94Å; V47-I93 HydrophobicContact CG2-CG2 3.94Å; F63-I93 HydrophobicContact CZ-CG2 4.48Å; F67-I93 HydrophobicContact CE2-CG1 3.85Å; F67-I93 HydrophobicContact CZ-CG1 4.43Å; L85-I93 HydrophobicContact CD1-CD1 3.5Å; L85-I93 HydrophobicContact CD1-CG1 3.88Å; Q89-I93 HydrophobicContact CB-CD1 3.74Å; Q89-I93 HydrophobicContact CB-CG1 4.01Å; Q89-I93 WeakPolarHBondContact O-CB 3.25Å; Q89-I93 WeakPolarHBondContact O-CD1 3.37Å; Q89-I93 VanDerWaalsContact O-CG1 3.25Å; Q89-I93 WeakPolarHBondContact O-CG1 3.49Å; Q89-I93 PolarHBondContact O-N 2.87Å; I93-Q95 PolarHBondContact O-N 2.79Å; I93-F96 PolarHBondContact O-N 3.41Å; I93-L97 HydrophobicContact CG2-CD1 3.7Å; I93-L97 HydrophobicContact CG2-CG 4.14Å; I93-L97 WeakPolarHBondContact O-CB 3.44Å; I93-L97 VanDerWaalsContact O-CG 3.31Å; I93-L97 WeakPolarHBondContact O-CG 3.26Å; I93-L97 PolarHBondContact O-N 3.15Å |
| 94 | C | 87.7 | Confident | 86.1 | Confident | 27 Ų | 27 | 62.4 Ų | 62.4 | 18% | 0.182 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -56.2 | -51.2 | 177 | -173.4 | 0 | 0 | 0 | 0 | 111.1 | R90 K91 F96 L97 M98 L108 | R90-C94 VanDerWaalsContact O-CB 3.25Å; R90-C94 WeakPolarHBondContact O-CB 3.45Å; R90-C94 PolarHBondContact O-N 2.86Å; R90-C94 VanDerWaalsContact O-N 3.11Å; K91-C94 PolarHBondContact O-N 3.15Å; C94-F96 PolarHBondContact O-N 3.14Å; C94-L97 PolarHBondContact O-N 2.77Å; C94-M98 WeakPolarHBondContact O-CE 3.46Å; C94-M98 PolarHBondContact O-N 2.75Å; C94-L108 HydrophobicContact CB-CD1 4.29Å; C94-L108 HydrophobicContact CB-CD2 4.28Å |
| 95 | Q | 89.1 | Confident | 85.3 | Confident | 125 Ų | 125 | 67.8 Ų | 67.8 | 58% | 0.584 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -61.5 | -42.5 | 177.9 | -171.3 | 174.1 | 12.5 | 0 | 0 | 112.5 | K91 I93 M98 E99 | K91-Q95 WeakPolarHBondContact O-CB 3.17Å; K91-Q95 PolarHBondContact O-N 3.46Å; I93-Q95 PolarHBondContact O-N 2.79Å; Q95-M98 PolarHBondContact O-N 3.24Å; Q95-E99 WeakPolarHBondContact O-CB 3.5Å; Q95-E99 PolarHBondContact O-N 3.49Å |
| 96 | F | 89 | Confident | 84.5 | Confident | 17 Ų | 17 | 75.5 Ų | 75.5 | 8% | 0.075 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -67.8 | -38.9 | -178.7 | -175.5 | -102.4 | 0 | 0 | 0 | 113.3 | L59 A62 F63 K66 F67 N92 I93 C94 M98 E99 I100 | L59-F96 HydrophobicContact CD1-CE1 4.34Å; A62-F96 HydrophobicContact CB-CE1 4.41Å; A62-F96 HydrophobicContact CB-CZ 3.73Å; F63-F96 AromaticContact CD1-CD1 3.7Å; F63-F96 HydrophobicContact CD1-CD1 3.7Å; F63-F96 AromaticContact CD1-CE1 3.62Å; F63-F96 HydrophobicContact CD1-CE1 3.62Å; F63-F96 HydrophobicContact CD1-CG 4.41Å; F63-F96 HydrophobicContact CD1-CZ 4.38Å; F63-F96 AromaticContact CE1-CD1 3.16Å; F63-F96 HydrophobicContact CE1-CD1 3.16Å; F63-F96 AromaticContact CE1-CE1 3.41Å; F63-F96 HydrophobicContact CE1-CE1 3.41Å; F63-F96 VanDerWaalsContact CE1-CE1 3.41Å; F63-F96 HydrophobicContact CE1-CG 4.06Å; F63-F96 HydrophobicContact CZ-CD1 4.11Å; F63-F96 HydrophobicContact CZ-CE1 4.25Å; K66-F96 HydrophobicContact CD-CD2 3.48Å; K66-F96 VanDerWaalsContact CD-CD2 3.48Å; K66-F96 HydrophobicContact CD-CE2 3.61Å; F67-F96 HydrophobicContact CE1-CB 4.41Å; F67-F96 HydrophobicContact CZ-CB 3.79Å; F67-F96 HydrophobicContact CZ-CG 4.11Å; N92-F96 VanDerWaalsContact O-CB 3.23Å; N92-F96 WeakPolarHBondContact O-CB 3.47Å; N92-F96 PolarHBondContact O-N 3.2Å; I93-F96 PolarHBondContact O-N 3.41Å; C94-F96 PolarHBondContact O-N 3.14Å; F96-M98 VanDerWaalsContact C-N 3.32Å; F96-E99 PolarHBondContact O-N 2.69Å; F96-I100 HydrophobicContact CD1-CD1 3.47Å; F96-I100 VanDerWaalsContact CD1-CD1 3.47Å; F96-I100 HydrophobicContact CD1-CG1 4.4Å; F96-I100 HydrophobicContact CD2-CD1 4.33Å; F96-I100 HydrophobicContact CE1-CD1 3.05Å; F96-I100 HydrophobicContact CE1-CG1 4.22Å; F96-I100 HydrophobicContact CE2-CD1 3.94Å; F96-I100 HydrophobicContact CE2-CG1 4.38Å; F96-I100 HydrophobicContact CG-CD1 4.16Å; F96-I100 HydrophobicContact CZ-CD1 3.32Å; F96-I100 HydrophobicContact CZ-CG1 4.21Å; F96-I100 WeakPolarHBondContact O-CG1 3.5Å; F96-I100 PolarHBondContact O-N 3.43Å; F96-I100 VanDerWaalsContact O-N 3.1Å |
| 97 | L | 85.6 | Confident | 84 | Confident | 0 Ų | 0 | 73.9 Ų | 73.9 | 0% | 0 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -66.5 | -37.1 | 177.5 | -72 | 173.8 | 0 | 0 | 0 | 111.6 | I31 I33 I93 C94 G101 I102 V103 L108 | I31-L97 HydrophobicContact CG2-CD1 4.17Å; I33-L97 HydrophobicContact CD1-CD1 4.41Å; I93-L97 HydrophobicContact CG2-CD1 3.7Å; I93-L97 HydrophobicContact CG2-CG 4.14Å; I93-L97 WeakPolarHBondContact O-CB 3.44Å; I93-L97 VanDerWaalsContact O-CG 3.31Å; I93-L97 WeakPolarHBondContact O-CG 3.26Å; I93-L97 PolarHBondContact O-N 3.15Å; C94-L97 PolarHBondContact O-N 2.77Å; L97-G101 PolarHBondContact O-N 2.73Å; L97-I102 PolarHBondContact O-N 3.47Å; L97-V103 HydrophobicContact CB-CB 4.35Å; L97-V103 HydrophobicContact CB-CG2 3.95Å; L97-V103 HydrophobicContact CD1-CG2 4.32Å; L97-V103 HydrophobicContact CD2-CG2 4.06Å; L97-V103 HydrophobicContact CG-CG2 4.33Å; L97-L108 HydrophobicContact CB-CD1 4.3Å; L97-L108 HydrophobicContact CD1-CD1 3.99Å |
| 98 | M | 84.7 | Confident | 83.8 | Confident | 81 Ų | 81 | 73.5 Ų | 73.5 | 40% | 0.399 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -66.5 | -41.7 | 171.7 | -72.1 | -172.9 | -74.8 | 0 | 0 | 112 | C94 Q95 F96 I100 G101 E105 | C94-M98 WeakPolarHBondContact O-CE 3.46Å; C94-M98 PolarHBondContact O-N 2.75Å; Q95-M98 PolarHBondContact O-N 3.24Å; F96-M98 VanDerWaalsContact C-N 3.32Å; M98-I100 PolarHBondContact O-N 2.84Å; M98-G101 PolarHBondContact O-N 3Å; M98-G101 VanDerWaalsContact O-N 3.11Å; M98-E105 HydrophobicContact SD-CG 4.48Å |
| 99 | E | 86.7 | Confident | 83.7 | Confident | 125 Ų | 125 | 74.9 Ų | 74.9 | 58% | 0.584 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -65.1 | -37 | -178.4 | -171.7 | -176.7 | 148.5 | 0 | 0 | 113.1 | K66 Q95 F96 G101 | K66-E99 IonicContact NZ-OE1 2.62Å; K66-E99 PolarHBondContact NZ-OE1 3.07Å; K66-E99 IonicContact NZ-OE2 2.67Å; K66-E99 PolarHBondContact NZ-OE2 3.42Å; Q95-E99 WeakPolarHBondContact O-CB 3.5Å; Q95-E99 PolarHBondContact O-N 3.49Å; F96-E99 PolarHBondContact O-N 2.69Å; E99-G101 VanDerWaalsContact C-N 3.27Å |
| 100 | I | 82.1 | Confident | 83.9 | Confident | 81 Ų | 81 | 77 Ų | 77 | 42% | 0.415 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -78.3 | -15.8 | 176.4 | -53.9 | 163.5 | 0 | 0 | 0 | 111.4 | L59 F96 M98 I102 | L59-I100 HydrophobicContact CD1-CD1 4.33Å; F96-I100 HydrophobicContact CD1-CD1 3.47Å; F96-I100 VanDerWaalsContact CD1-CD1 3.47Å; F96-I100 HydrophobicContact CD1-CG1 4.4Å; F96-I100 HydrophobicContact CD2-CD1 4.33Å; F96-I100 HydrophobicContact CE1-CD1 3.05Å; F96-I100 HydrophobicContact CE1-CG1 4.22Å; F96-I100 HydrophobicContact CE2-CD1 3.94Å; F96-I100 HydrophobicContact CE2-CG1 4.38Å; F96-I100 HydrophobicContact CG-CD1 4.16Å; F96-I100 HydrophobicContact CZ-CD1 3.32Å; F96-I100 HydrophobicContact CZ-CG1 4.21Å; F96-I100 WeakPolarHBondContact O-CG1 3.5Å; F96-I100 PolarHBondContact O-N 3.43Å; F96-I100 VanDerWaalsContact O-N 3.1Å; M98-I100 PolarHBondContact O-N 2.84Å; I100-I102 HydrophobicContact CB-CD1 4.01Å; I100-I102 HydrophobicContact CB-CG1 3.94Å; I100-I102 HydrophobicContact CD1-CD1 4.09Å; I100-I102 HydrophobicContact CG2-CD1 3.66Å; I100-I102 HydrophobicContact CG2-CG1 3.61Å; I100-I102 PolarHBondContact O-N 2.79Å |
| 101 | G | 77.7 | Confident | 83.7 | Confident | 61 Ų | 61 | 76 Ų | 76 | 63% | 0.629 | 37% | 0.373 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 70.7 | 20.1 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | L97 M98 E99 V103 | L97-G101 PolarHBondContact O-N 2.73Å; M98-G101 PolarHBondContact O-N 3Å; M98-G101 VanDerWaalsContact O-N 3.11Å; E99-G101 VanDerWaalsContact C-N 3.27Å; G101-V103 VanDerWaalsContact C-N 3.28Å |
| 102 | I | 73.1 | Confident | 83.3 | Confident | 36 Ų | 36 | 70.5 Ų | 70.5 | 19% | 0.185 | 36% | 0.361 | C | S | . | . | S | Bend | trans | -71.6 | -29.9 | 176.3 | -63.6 | 174.1 | 0 | 0 | 0 | 110.3 | Y54 L59 L97 I100 | Y54-I102 HydrophobicContact CD2-CG2 4.37Å; Y54-I102 HydrophobicContact CE1-CG1 4.24Å; Y54-I102 HydrophobicContact CE1-CG2 4.15Å; Y54-I102 HydrophobicContact CE2-CG2 3.91Å; L59-I102 HydrophobicContact CD1-CD1 3.88Å; L97-I102 PolarHBondContact O-N 3.47Å; I100-I102 HydrophobicContact CB-CD1 4.01Å; I100-I102 HydrophobicContact CB-CG1 3.94Å; I100-I102 HydrophobicContact CD1-CD1 4.09Å; I100-I102 HydrophobicContact CG2-CD1 3.66Å; I100-I102 HydrophobicContact CG2-CG1 3.61Å; I100-I102 PolarHBondContact O-N 2.79Å |
| 103 | V | 74.5 | Confident | 82.1 | Confident | 10 Ų | 10 | 77.2 Ų | 77.2 | 6% | 0.061 | 39% | 0.387 | C | S | . | . | S | Bend | trans | -135.5 | 136.8 | -167.9 | -164.6 | 0 | 0 | 0 | 0 | 109.5 | I31 L97 G101 Q107 L108 | I31-V103 HydrophobicContact CD1-CB 4.18Å; I31-V103 HydrophobicContact CD1-CG1 3.8Å; I31-V103 HydrophobicContact CD1-CG2 3.23Å; L97-V103 HydrophobicContact CB-CB 4.35Å; L97-V103 HydrophobicContact CB-CG2 3.95Å; L97-V103 HydrophobicContact CD1-CG2 4.32Å; L97-V103 HydrophobicContact CD2-CG2 4.06Å; L97-V103 HydrophobicContact CG-CG2 4.33Å; G101-V103 VanDerWaalsContact C-N 3.28Å; V103-Q107 HydrophobicContact CG1-CB 3.78Å; V103-L108 HydrophobicContact CG1-CB 4.38Å |
| 104 | R | 78.7 | Confident | 81.7 | Confident | 185 Ų | 185 | 81.1 Ų | 81.1 | 70% | 0.698 | 41% | 0.407 | S | S | * | . | trans | -82.6 | 149.8 | 168.2 | -55.1 | -177.1 | -153.1 | 172.5 | 7.4 | 109.7 | E106 Q107 | R104-E106 PolarHBondContact O-N 2.97Å; R104-E106 VanDerWaalsContact O-N 3.08Å; R104-Q107 WeakPolarHBondContact O-CB 3.39Å; R104-Q107 PolarHBondContact O-N 3.18Å | ||
| 105 | E | 74.3 | Confident | 81.4 | Confident | 152 Ų | 152 | 83.9 Ų | 83.9 | 71% | 0.71 | 42% | 0.419 | S | S | * | . | G | 310 helix | trans | -54.7 | -34.2 | -177.9 | -168.4 | 171.3 | -170 | 0 | 0 | 112.7 | M98 Q107 L108 | M98-E105 HydrophobicContact SD-CG 4.48Å; E105-Q107 VanDerWaalsContact C-N 3.29Å; E105-Q107 PolarHBondContact O-N 2.79Å; E105-L108 PolarHBondContact O-N 2.78Å |
| 106 | E | 77.6 | Confident | 81 | Confident | 161 Ų | 161 | 81.7 Ų | 81.7 | 75% | 0.752 | 41% | 0.409 | S | S | * | . | G | 310 helix | trans | -64.8 | -29.3 | 178.8 | -61.9 | 172.6 | -174.4 | 0 | 0 | 114.1 | R104 L108 | R104-E106 PolarHBondContact O-N 2.97Å; R104-E106 VanDerWaalsContact O-N 3.08Å; E106-L108 VanDerWaalsContact C-N 3.34Å |
| 107 | Q | 80.9 | Confident | 80.5 | Confident | 59 Ų | 59 | 85.5 Ų | 85.5 | 28% | 0.276 | 43% | 0.429 | S | S | . | . | G | 310 helix | trans | -82.9 | -16 | -179.8 | -66.4 | 176.8 | -58.3 | 0 | 0 | 111.9 | K30 I31 V103 R104 E105 | K30-Q107 CarbonylContact C-O 3.48Å; K30-Q107 VanDerWaalsContact CA-O 3.25Å; K30-Q107 WeakPolarHBondContact CA-O 3.46Å; I31-Q107 PolarHBondContact N-O 2.78Å; V103-Q107 HydrophobicContact CG1-CB 3.78Å; R104-Q107 WeakPolarHBondContact O-CB 3.39Å; R104-Q107 PolarHBondContact O-N 3.18Å; E105-Q107 VanDerWaalsContact C-N 3.29Å; E105-Q107 PolarHBondContact O-N 2.79Å |
| 108 | L | 85.9 | Confident | 80.2 | Confident | 18 Ų | 18 | 90.8 Ų | 90.8 | 9% | 0.094 | 46% | 0.456 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.8 | 122.6 | -174.9 | -162.1 | 148.5 | 0 | 0 | 0 | 110.7 | I33 C94 L97 V103 E105 E106 V110 | I33-L108 HydrophobicContact CD1-CD1 4.1Å; I33-L108 HydrophobicContact CD1-CD2 3.93Å; I33-L108 HydrophobicContact CD1-CG 4.14Å; C94-L108 HydrophobicContact CB-CD1 4.29Å; C94-L108 HydrophobicContact CB-CD2 4.28Å; L97-L108 HydrophobicContact CB-CD1 4.3Å; L97-L108 HydrophobicContact CD1-CD1 3.99Å; V103-L108 HydrophobicContact CG1-CB 4.38Å; E105-L108 PolarHBondContact O-N 2.78Å; E106-L108 VanDerWaalsContact C-N 3.34Å; L108-V110 HydrophobicContact CD2-CG2 3.35Å |
| 109 | K | 88.4 | Confident | 79.9 | Confident | 95 Ų | 95 | 91.5 Ų | 91.5 | 41% | 0.413 | 46% | 0.46 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.6 | 106.6 | 177.1 | -67.5 | -63.4 | 179.4 | -170.5 | 0 | 109.9 | K30 I31 H32 I33 | K30-K109 HydrophobicContact CB-CG 4.47Å; K30-K109 HydrophobicContact CD-CG 4.35Å; I31-K109 PolarHBondContact O-N 2.88Å; H32-K109 WeakPolarHBondContact CA-O 3.5Å; H32-K109 WeakPolarHBondContact ND1-CB 3.44Å; I33-K109 PolarHBondContact N-O 2.71Å |
| 110 | V | 89.3 | Confident | 79.4 | Confident | 68 Ų | 68 | 89.1 Ų | 89.1 | 41% | 0.412 | 45% | 0.451 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.8 | 114.9 | 173.9 | -171.4 | 0 | 0 | 0 | 0 | 109.2 | I33 R90 L108 | I33-V110 HydrophobicContact CD1-CG2 4.47Å; R90-V110 HydrophobicContact CB-CG1 3.98Å; R90-V110 HydrophobicContact CG-CG1 4.44Å; L108-V110 HydrophobicContact CD2-CG2 3.35Å |
| 111 | H | 86.5 | Confident | 79.2 | Confident | 70 Ų | 70 | 89.7 Ų | 89.7 | 32% | 0.324 | 45% | 0.454 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97 | 106.6 | 169.6 | -58.9 | -81.5 | 0 | 0 | 0 | 108.1 | H32 I33 R34 I35 | H32-H111 AromaticContact CE1-NE2 3.76Å; H32-H111 AromaticContact CG-NE2 3.71Å; H32-H111 AromaticContact ND1-CD2 3.72Å; H32-H111 AromaticContact ND1-CE1 3.98Å; H32-H111 AromaticContact ND1-NE2 2.92Å; H32-H111 PolarHBondContact ND1-NE2 3.02Å; I33-H111 PolarHBondContact O-N 2.75Å; R34-H111 HydrophobicContact CB-CB 4.44Å; R34-H111 HydrophobicContact CG-CB 4.02Å; I35-H111 PolarHBondContact N-O 2.67Å |
| 112 | G | 79.8 | Confident | 79.4 | Confident | 41 Ų | 41 | 92.1 Ų | 92.1 | 42% | 0.423 | 44% | 0.439 | S | S | . | . | trans | -91.1 | 172.5 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 113 | F | 63.4 | Low | 79.9 | Confident | 210 Ų | 210 | 97.2 Ų | 97.2 | 92% | 0.921 | 46% | 0.462 | S | S | * | . | trans | -62.2 | 0 | 157.9 | -110.9 | -88.9 | 0 | 0 | 0 | 110.7 | I35 Q37 | I35-F113 HydrophobicContact CG2-CD2 4.24Å; Q37-F113 HydrophobicContact CB-CE2 4.09Å; Q37-F113 HydrophobicContact CB-CZ 4.34Å |
Retrieved 113 of 113 residues in 91.9 ms
(Link to these results)