A0A093I0A4_STRCA Loading...

E3 ubiquitin-protein ligase RNF182

AlphaFold DB , UniProt , Accession A0A093I0A4, Species STRCA (Struthio camelus australis), Gene n/a, Length 245 aa.

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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
1M36.6Very low39.7Very low248 Ų248156.9 Ų156.9100%1.22284%0.842SS**  0125.70-94.2162.4166.800107.4
2T34.4Very low40.2Very low130 Ų130149.1 Ų149.180%0.79881%0.808SS**  trans-64.7130.4-158.3-49.30000113.2Q4T2-Q4 PolarHBondContact O-N 3.21Å
3S38.4Very low40.9Very low117 Ų117149.8 Ų149.882%0.81880%0.803SS**  trans-69.9113.9162.740.80000109.7
4Q37.7Very low42.2Very low190 Ų190144.3 Ų144.389%0.88878%0.782SS**PPolyproline II helixtrans-92.1117.1170-93.3168.7-41.900109.7T2T2-Q4 PolarHBondContact O-N 3.21Å
5L33.4Very low43.8Very low160 Ų160136.1 Ų136.184%0.83874%0.74SS**PPolyproline II helixtrans-74.8145.3163.4-140.192.1000108.4
6P46Very low45.8Very low111 Ų111133.1 Ų133.172%0.72172%0.723SS**PPolyproline II helixtrans-74.5126.9168.6-4.622.3000109.4E8P6-E8 PolarHBondContact O-N 3.33Å; P6-E8 VanDerWaalsContact O-N 3.08Å
7E40.2Very low48.1Very low201 Ų201133.4 Ų133.494%0.93972%0.718SS**  trans-71.293.8166.2-64.6-167.8122.600108.7
8E38.3Very low50.4Low181 Ų181127.8 Ų127.885%0.84669%0.688SS**  trans-71.7125.4166.5-97.6-174.8113.300110P6 V10P6-E8 PolarHBondContact O-N 3.33Å; P6-E8 VanDerWaalsContact O-N 3.08Å; E8-V10 PolarHBondContact O-N 3.49Å
9S39.7Very low52.7Low86 Ų86123.1 Ų123.160%0.60166%0.661SS**  trans-53.3115.4179.451.50000113.9E11 S12S9-E11 VanDerWaalsContact C-N 3.3Å; S9-S12 PolarHBondContact O-OG 3.47Å
10V45.9Very low54.7Low129 Ų129116.9 Ų116.978%0.78263%0.628SS**THydrogen-bonded Turntrans-81.9-5.4174.7-177.40000112.6E8E8-V10 PolarHBondContact O-N 3.49Å
11E45.6Very low56.6Low173 Ų173115.8 Ų115.881%0.80862%0.618SS**THydrogen-bonded Turntrans-80.3-19.8-177.1-71.5-175.5149.900114.6S9 S14S9-E11 VanDerWaalsContact C-N 3.3Å; E11-S14 PolarHBondContact O-OG 2.86Å
12S46.5Very low59.3Low63 Ų63107 Ų10744%0.44158%0.575SS.*Hα-helixtrans-82-19-173.156.40000115.3S9 S15S9-S12 PolarHBondContact O-OG 3.47Å; S12-S15 PolarHBondContact O-OG 3.3Å
13Q49.4Very low62.1Low158 Ų158102.5 Ų102.574%0.73855%0.548SS*.Hα-helixtrans-77.8-30.3-179.1-73.2-178.4-4.900112.8S15Q13-S15 VanDerWaalsContact C-N 3.32Å; Q13-S15 PolarHBondContact O-N 3.49Å
14S59.1Low64.7Low73 Ų73105 Ų10551%0.5154%0.541SS..Hα-helixtrans-71.6-26179.771.10000113.2E11 L18E11-S14 PolarHBondContact O-OG 2.86Å; S14-L18 WeakPolarHBondContact O-CG 3.32Å
15S65.6Low67.3Low21 Ų2198.9 Ų98.915%0.14751%0.514CS..Hα-helixtrans-72.5-40.6179.249.40000112.4S12 Q13 E17 L18 E19S12-S15 PolarHBondContact O-OG 3.3Å; Q13-S15 VanDerWaalsContact C-N 3.32Å; Q13-S15 PolarHBondContact O-N 3.49Å; S15-E17 VanDerWaalsContact C-N 3.28Å; S15-E17 PolarHBondContact O-N 3.04Å; S15-L18 PolarHBondContact O-N 3.33Å; S15-L18 VanDerWaalsContact O-N 3.14Å; S15-E19 WeakPolarHBondContact O-CG 3.28Å
16D76.2Confident70.1Confident88 Ų8897.6 Ų97.647%0.47150%0.498SS..Hα-helixtrans-66.9-30.8-175.4-84.618.3000112.4L18 K21D16-L18 VanDerWaalsContact C-N 3.33Å; D16-K21 PolarHBondContact O-NZ 3.17Å
17E84.3Confident72.3Confident138 Ų13892.8 Ų92.865%0.64547%0.466SS*.Hα-helixtrans-72.9-27.6176.9-168.7172.9-175.600112.2S15 E19S15-E17 VanDerWaalsContact C-N 3.28Å; S15-E17 PolarHBondContact O-N 3.04Å; E17-E19 VanDerWaalsContact C-N 3.25Å; E17-E19 PolarHBondContact O-N 3.08Å
18L89.7Confident74.7Confident33 Ų3386 Ų8617%0.17344%0.436CS..THydrogen-bonded Turntrans-89.316.5179.6-61.8174.8000113.1S14 S15 D16 R26 Y27 I87 N90S14-L18 WeakPolarHBondContact O-CG 3.32Å; S15-L18 PolarHBondContact O-N 3.33Å; S15-L18 VanDerWaalsContact O-N 3.14Å; D16-L18 VanDerWaalsContact C-N 3.33Å; L18-R26 WeakPolarHBondContact O-CA 3.31Å; L18-Y27 WeakPolarHBondContact O-CD2 3.4Å; L18-Y27 PolarHBondContact O-N 2.95Å; L18-I87 HydrophobicContact CD2-CG2 3.86Å; L18-N90 HydrophobicContact CD2-CB 4.08Å
19E93.6Very high77.2Confident38 Ų3881.8 Ų81.818%0.17842%0.419CS..BIsolated β-bridgetrans-122.7140.2-177.4-72.5176.4-177.900112.6S15 E17 K21 R26 Y27S15-E19 WeakPolarHBondContact O-CG 3.28Å; E17-E19 VanDerWaalsContact C-N 3.25Å; E17-E19 PolarHBondContact O-N 3.08Å; E19-K21 PolarHBondContact O-N 2.97Å; E19-R26 HydrophobicContact CG-CB 4.35Å; E19-R26 HydrophobicContact CG-CG 3.6Å; E19-R26 WeakPolarHBondContact OE1-CG 3.14Å; E19-R26 IonicContact OE1-CZ 3.74Å; E19-R26 IonicContact OE1-NH1 3.39Å; E19-R26 PolarHBondContact OE1-NH1 3.32Å; E19-Y27 VanDerWaalsContact C-CE2 3.48Å
20C94.4Very high79.5Confident0 Ų086.9 Ų86.90%043%0.425CS..  trans-72.9121.8177177.20000110.8I22 C23 Y24 N25 Y27 C44C20-I22 PolarHBondContact O-N 2.92Å; C20-C23 PolarHBondContact O-N 3.47Å; C20-Y24 VanDerWaalsContact O-CA 3.23Å; C20-Y24 WeakPolarHBondContact O-CA 3.44Å; C20-Y24 PolarHBondContact O-N 2.71Å; C20-N25 PolarHBondContact N-O 2.91Å; C20-Y27 WeakPolarHBondContact CA-OH 3.31Å; C20-Y27 HydrophobicContact CB-CD1 4.41Å; C20-Y27 HydrophobicContact CB-CE1 3.75Å; C20-C44 HydrophobicContact CB-CB 3.91Å; C20-C44 PolarHBondContact SG-N 3.4Å
21K93.6Very high81.5Confident94 Ų9484.1 Ų84.141%0.40940%0.403SS..THydrogen-bonded Turntrans-70.3-0.8-178.2-56.9-52.1-170.1-1710115.8D16 E19 F66D16-K21 PolarHBondContact O-NZ 3.17Å; E19-K21 PolarHBondContact O-N 2.97Å; K21-F66 HydrophobicContact CB-CE1 4.15Å; K21-F66 HydrophobicContact CB-CZ 4.13Å
22I93.9Very high83.7Confident63 Ų6378 Ų7832%0.32337%0.373SS..THydrogen-bonded Turntrans-94.9-46.2173.6-55.3-172.7000111.4C20 V43 C47 I51 P65 F66C20-I22 PolarHBondContact O-N 2.92Å; I22-V43 HydrophobicContact CD1-CB 4.3Å; I22-V43 HydrophobicContact CD1-CG1 3.37Å; I22-V43 HydrophobicContact CD1-CG2 3.88Å; I22-V43 HydrophobicContact CG1-CG1 4.26Å; I22-C47 HydrophobicContact CB-CB 4.36Å; I22-C47 HydrophobicContact CD1-CB 4.26Å; I22-C47 HydrophobicContact CG2-CB 4.37Å; I22-I51 HydrophobicContact CD1-CD1 4.02Å; I22-P65 HydrophobicContact CD1-CB 4.17Å; I22-P65 HydrophobicContact CD1-CG 3.43Å; I22-P65 VanDerWaalsContact CD1-CG 3.43Å; I22-P65 HydrophobicContact CG1-CG 4.4Å; I22-F66 HydrophobicContact CD1-CZ 4.38Å; I22-F66 HydrophobicContact CG1-CE1 4.42Å; I22-F66 HydrophobicContact CG1-CZ 3.88Å
23C93.3Very high86Confident35 Ų3578.2 Ų78.224%0.23637%0.366CS..THydrogen-bonded Turntrans-108.8-1.8-175.563.40000113.8C20 N25 R32 C47C20-C23 PolarHBondContact O-N 3.47Å; C23-N25 PolarHBondContact O-N 3.03Å; C23-N25 PolarHBondContact O-ND2 3.37Å; C23-R32 PolarHBondContact SG-NH1 2.93Å; C23-C47 VanDerWaalsContact CB-SG 3.56Å
24Y92.9Very high88.2Confident171 Ų17170.7 Ų70.767%0.67133%0.331SS*.  trans50.732.3-179.1-56.8-84.2000113.6C20C20-Y24 VanDerWaalsContact O-CA 3.23Å; C20-Y24 WeakPolarHBondContact O-CA 3.44Å; C20-Y24 PolarHBondContact O-N 2.71Å
25N92.3Very high90Very high60 Ų6067.9 Ų67.932%0.32131%0.309SS..  trans-111.5147.6176.8-74.2-84.9000109.4C20 C23 R32C20-N25 PolarHBondContact N-O 2.91Å; C23-N25 PolarHBondContact O-N 3.03Å; C23-N25 PolarHBondContact O-ND2 3.37Å; N25-R32 VanDerWaalsContact CB-CZ 3.48Å; N25-R32 VanDerWaalsContact CB-NH1 3.3Å; N25-R32 VanDerWaalsContact CG-CZ 3.47Å; N25-R32 PolarHBondContact ND2-NH1 3.49Å; N25-R32 PolarHBondContact ND2-NH2 3.28Å
26R91.9Very high91.4Very high133 Ų13368.3 Ų68.350%0.50231%0.311SS..BIsolated β-bridgetrans-59140175-77-176.5135.485.1-14.8112.4L18 E19 R32L18-R26 WeakPolarHBondContact O-CA 3.31Å; E19-R26 HydrophobicContact CG-CB 4.35Å; E19-R26 HydrophobicContact CG-CG 3.6Å; E19-R26 WeakPolarHBondContact OE1-CG 3.14Å; E19-R26 IonicContact OE1-CZ 3.74Å; E19-R26 IonicContact OE1-NH1 3.39Å; E19-R26 PolarHBondContact OE1-NH1 3.32Å; R26-R32 WeakPolarHBondContact O-CD 3.39Å
27Y92.3Very high92.3Very high11 Ų1164.4 Ų64.44%0.04329%0.29CS..  trans-64.9150.8169.9-66.2-64.9000110.2L18 E19 C20 R32 P34 C44 I87 L91L18-Y27 WeakPolarHBondContact O-CD2 3.4Å; L18-Y27 PolarHBondContact O-N 2.95Å; E19-Y27 VanDerWaalsContact C-CE2 3.48Å; C20-Y27 WeakPolarHBondContact CA-OH 3.31Å; C20-Y27 HydrophobicContact CB-CD1 4.41Å; C20-Y27 HydrophobicContact CB-CE1 3.75Å; Y27-R32 VanDerWaalsContact CA-O 3.31Å; Y27-R32 WeakPolarHBondContact CA-O 3.23Å; Y27-R32 WeakPolarHBondContact CD1-O 3.43Å; Y27-P34 HydrophobicContact CD1-CB 3.7Å; Y27-P34 HydrophobicContact CD1-CG 4.39Å; Y27-P34 HydrophobicContact CD2-CB 4.33Å; Y27-P34 HydrophobicContact CE1-CB 3.67Å; Y27-P34 HydrophobicContact CE2-CB 4.35Å; Y27-P34 HydrophobicContact CG-CB 4.04Å; Y27-P34 HydrophobicContact CG-CG 4.42Å; Y27-C44 HydrophobicContact CD1-CB 3.82Å; Y27-C44 HydrophobicContact CE1-CB 3.67Å; Y27-I87 HydrophobicContact CD2-CD1 4.24Å; Y27-I87 HydrophobicContact CD2-CG2 3.72Å; Y27-I87 HydrophobicContact CE2-CD1 4.01Å; Y27-I87 HydrophobicContact CG-CG2 4.11Å; Y27-L91 VanDerWaalsContact O-CD2 3.31Å; Y27-L91 WeakPolarHBondContact O-CD2 3.46Å
28N90.3Very high92.7Very high59 Ų5963 Ų6332%0.31628%0.283SS..  trans-145.4162.5175.666.748.3000111.2R30 Q31 R32 K33N28-R30 PolarHBondContact O-N 3.2Å; N28-R30 PolarHBondContact OD1-N 2.91Å; N28-Q31 PolarHBondContact OD1-N 3.48Å; N28-R32 PolarHBondContact N-O 3.37Å; N28-R32 CarbonylContact O-C 3.29Å; N28-R32 VanDerWaalsContact O-C 3.29Å; N28-R32 PolarHBondContact OD1-N 3.27Å; N28-K33 WeakPolarHBondContact O-CA 3.39Å; N28-K33 WeakPolarHBondContact O-CG 3.48Å; N28-K33 PolarHBondContact O-N 3.13Å
29L90.1Very high93Very high92 Ų9262.9 Ų62.948%0.48229%0.285SS..SBendtrans-72.7-3.3-177.4-56179.5000113.8K33 L88 L91L29-K33 WeakPolarHBondContact O-CE 3.39Å; L29-L88 HydrophobicContact CD2-CB 4.18Å; L29-L88 HydrophobicContact CD2-CD2 3.51Å; L29-L88 HydrophobicContact CD2-CG 4.42Å; L29-L91 HydrophobicContact CD2-CB 4.22Å
30R88.3Confident93Very high192 Ų19265.5 Ų65.573%0.72531%0.307SS*.SBendtrans-108.7-93.8-174.8-64.5-176.3-175.6-101.28.2110.9N28N28-R30 PolarHBondContact O-N 3.2Å; N28-R30 PolarHBondContact OD1-N 2.91Å
31Q87.6Confident93.1Very high72 Ų7268.9 Ų68.934%0.33632%0.322SS..SBendtrans-92.7-20.9-169.6-63.4179.10.100113.6N28 K46 W171N28-Q31 PolarHBondContact OD1-N 3.48Å; Q31-K46 PolarHBondContact O-N 3.43Å; Q31-W171 VanDerWaalsContact NE2-CZ3 3.26Å
32R92.8Very high93.2Very high44 Ų4470.3 Ų70.317%0.16633%0.325CS..SBendtrans-112.745.9179.2-60.3-178-173.5-104.815110.5C23 N25 R26 Y27 N28 C44 K46C23-R32 PolarHBondContact SG-NH1 2.93Å; N25-R32 VanDerWaalsContact CB-CZ 3.48Å; N25-R32 VanDerWaalsContact CB-NH1 3.3Å; N25-R32 VanDerWaalsContact CG-CZ 3.47Å; N25-R32 PolarHBondContact ND2-NH1 3.49Å; N25-R32 PolarHBondContact ND2-NH2 3.28Å; R26-R32 WeakPolarHBondContact O-CD 3.39Å; Y27-R32 VanDerWaalsContact CA-O 3.31Å; Y27-R32 WeakPolarHBondContact CA-O 3.23Å; Y27-R32 WeakPolarHBondContact CD1-O 3.43Å; N28-R32 PolarHBondContact N-O 3.37Å; N28-R32 CarbonylContact O-C 3.29Å; N28-R32 VanDerWaalsContact O-C 3.29Å; N28-R32 PolarHBondContact OD1-N 3.27Å; R32-C44 HydrophobicContact CB-CB 4.09Å; R32-K46 HydrophobicContact CG-CB 4.36Å
33K95Very high93.3Very high68 Ų6867.3 Ų67.330%0.29631%0.31SS..  trans-64.2137171.7-70.4178.9170.7-163.50110.2N28 L29 K35 C44 A45 D83 L88N28-K33 WeakPolarHBondContact O-CA 3.39Å; N28-K33 WeakPolarHBondContact O-CG 3.48Å; N28-K33 PolarHBondContact O-N 3.13Å; L29-K33 WeakPolarHBondContact O-CE 3.39Å; K33-K35 PolarHBondContact O-N 3Å; K33-C44 CarbonylContact O-C 3.49Å; K33-C44 VanDerWaalsContact O-CA 3.27Å; K33-C44 WeakPolarHBondContact O-CA 3.38Å; K33-A45 PolarHBondContact O-N 3.47Å; K33-D83 IonicContact NZ-OD2 3.22Å; K33-L88 HydrophobicContact CG-CD2 4.38Å
34P95.9Very high93.4Very high0 Ų065.7 Ų65.70%030%0.298CS..EExtended strand (participates in β ladder)trans-72.7106.2176.430-32000109.4Y27 D83 D84 I87 L88Y27-P34 HydrophobicContact CD1-CB 3.7Å; Y27-P34 HydrophobicContact CD1-CG 4.39Å; Y27-P34 HydrophobicContact CD2-CB 4.33Å; Y27-P34 HydrophobicContact CE1-CB 3.67Å; Y27-P34 HydrophobicContact CE2-CB 4.35Å; Y27-P34 HydrophobicContact CG-CB 4.04Å; Y27-P34 HydrophobicContact CG-CG 4.42Å; P34-D83 CarbonylContact O-C 3.51Å; P34-D83 WeakPolarHBondContact O-CA 3.31Å; P34-D84 HydrophobicContact CB-CB 4.08Å; P34-D84 HydrophobicContact CG-CB 3.99Å; P34-D84 PolarHBondContact O-N 3.43Å; P34-I87 HydrophobicContact CB-CB 4.43Å; P34-I87 HydrophobicContact CB-CD1 4.03Å; P34-I87 HydrophobicContact CB-CG2 4.29Å; P34-I87 HydrophobicContact CG-CB 3.83Å; P34-I87 HydrophobicContact CG-CD1 4.37Å; P34-I87 HydrophobicContact CG-CG2 3.74Å; P34-L88 HydrophobicContact CG-CD2 4.32Å; P34-L88 HydrophobicContact CG-CG 4.28Å
35K95.9Very high93.5Very high14 Ų1458.3 Ų58.36%0.06127%0.273CS..EExtended strand (participates in β ladder)trans-90.2140.8175.3-66.9-64-169.8-178.60110.3K33 R42 V43 A45 L48 V78 S79 L81 P82 D83K33-K35 PolarHBondContact O-N 3Å; K35-R42 WeakPolarHBondContact O-CA 3.17Å; K35-V43 WeakPolarHBondContact CA-O 3.4Å; K35-V43 WeakPolarHBondContact CB-O 3.5Å; K35-V43 PolarHBondContact N-O 2.91Å; K35-V43 PolarHBondContact O-N 2.95Å; K35-A45 HydrophobicContact CG-CB 3.97Å; K35-L48 HydrophobicContact CB-CD1 3.43Å; K35-L48 VanDerWaalsContact CB-CD1 3.43Å; K35-L48 HydrophobicContact CG-CD1 3.98Å; K35-V78 VanDerWaalsContact CE-O 3.24Å; K35-V78 WeakPolarHBondContact CE-O 3.35Å; K35-V78 HydrophobicContact CG-CG1 4.14Å; K35-S79 PolarHBondContact NZ-O 3.16Å; K35-S79 VanDerWaalsContact NZ-O 3.17Å; K35-L81 HydrophobicContact CB-CB 4.34Å; K35-L81 HydrophobicContact CD-CB 3.98Å; K35-L81 WeakPolarHBondContact CD-O 3.17Å; K35-L81 HydrophobicContact CG-CB 4.49Å; K35-L81 PolarHBondContact NZ-O 3.12Å; K35-P82 WeakPolarHBondContact CA-O 3.15Å; K35-D83 WeakPolarHBondContact CD-OD1 3.36Å; K35-D83 WeakPolarHBondContact CE-OD1 3.47Å; K35-D83 IonicContact NZ-OD1 2.83Å; K35-D83 PolarHBondContact NZ-OD1 3.05Å
36V95.4Very high93.5Very high30 Ų3058.4 Ų58.418%0.18227%0.27CS..EExtended strand (participates in β ladder)trans-105.5122.7178.3-173.50000108.9R42 P82 D84V36-R42 HydrophobicContact CG2-CG 4.42Å; V36-P82 HydrophobicContact CB-CG 4.33Å; V36-P82 PolarHBondContact N-O 3.35Å; V36-D84 HydrophobicContact CG2-CB 3.87Å
37L95.1Very high93.7Very high5 Ų552.6 Ų52.63%0.02625%0.25CS..  trans-78.9167.5173.6-64.3171000110.7C39 C40 H41 V43 L48 I62 C64 T71 L81L37-C39 PolarHBondContact O-N 3.24Å; L37-C40 WeakPolarHBondContact O-CA 3.1Å; L37-C40 PolarHBondContact O-N 3.19Å; L37-H41 PolarHBondContact N-O 3.46Å; L37-V43 HydrophobicContact CD1-CG2 4.42Å; L37-L48 HydrophobicContact CD1-CD2 4.49Å; L37-L48 HydrophobicContact CD2-CD1 4.36Å; L37-L48 HydrophobicContact CD2-CD2 4.14Å; L37-I62 HydrophobicContact CD2-CD1 4.5Å; L37-I62 HydrophobicContact CD2-CG2 4.13Å; L37-C64 HydrophobicContact CD1-CB 3.76Å; L37-T71 HydrophobicContact CD2-CG2 4.14Å; L37-L81 HydrophobicContact CD2-CD1 3.92Å
38E93.3Very high93.7Very high109 Ų10952 Ų5251%0.50925%0.248SC..THydrogen-bonded Turntrans-59-31.7177.4-79.1171-149.900112.8C40 F69 T71 C72E38-C40 PolarHBondContact O-N 3.21Å; E38-C40 VanDerWaalsContact O-N 3.14Å; E38-F69 HydrophobicContact CB-CD1 4.18Å; E38-F69 HydrophobicContact CB-CE1 3.53Å; E38-F69 HydrophobicContact CB-CZ 4.44Å; E38-F69 WeakPolarHBondContact OE2-CE1 3.32Å; E38-T71 HydrophobicContact CB-CG2 4.22Å; E38-T71 HydrophobicContact CG-CG2 3.82Å; E38-T71 PolarHBondContact N-OG1 2.95Å; E38-C72 PolarHBondContact OE1-N 3.17Å
39C94.9Very high93.7Very high31 Ų3151.3 Ų51.321%0.20925%0.247CC..THydrogen-bonded Turntrans-74.79.2172.663.60000114.6L37 H41 C67 F69L37-C39 PolarHBondContact O-N 3.24Å; C39-H41 PolarHBondContact O-N 2.85Å; C39-H41 VanDerWaalsContact O-N 3.11Å; C39-H41 PolarHBondContact SG-ND1 3.39Å; C39-H41 VanDerWaalsContact SG-ND1 3.38Å; C39-C67 PolarHBondContact SG-SG 3.38Å; C39-F69 HydrophobicContact CB-CB 3.63Å; C39-F69 HydrophobicContact CB-CD1 3.78Å; C39-F69 HydrophobicContact CB-CG 3.73Å
40C94.5Very high93.7Very high93 Ų9351.4 Ų51.463%0.62824%0.243SC*.  trans639.2-178.1-58.90000115.5L37 E38L37-C40 WeakPolarHBondContact O-CA 3.1Å; L37-C40 PolarHBondContact O-N 3.19Å; E38-C40 PolarHBondContact O-N 3.21Å; E38-C40 VanDerWaalsContact O-N 3.14Å
41H95.8Very high93.8Very high70 Ų7044.5 Ų44.532%0.32422%0.221SC..  trans-76.4145.2170.7-74.8106.4000111.6L37 C39 F66 C67L37-H41 PolarHBondContact N-O 3.46Å; C39-H41 PolarHBondContact O-N 2.85Å; C39-H41 VanDerWaalsContact O-N 3.11Å; C39-H41 PolarHBondContact SG-ND1 3.39Å; C39-H41 VanDerWaalsContact SG-ND1 3.38Å; H41-F66 HydrophobicContact CB-CD2 3.75Å; H41-F66 HydrophobicContact CB-CE2 4.34Å; H41-F66 AromaticContact CD2-CD2 3.88Å; H41-F66 AromaticContact CG-CD2 3.85Å; H41-C67 PolarHBondContact ND1-SG 3.14Å
42R95.2Very high93.7Very high125 Ų12543.2 Ų43.247%0.47222%0.216SC..EExtended strand (participates in β ladder)trans-102.8129.9-176.9-61.3172-178.297.51110.9K35 V36 D84K35-R42 WeakPolarHBondContact O-CA 3.17Å; V36-R42 HydrophobicContact CG2-CG 4.42Å; R42-D84 IonicContact CZ-OD2 2.83Å; R42-D84 IonicContact NE-OD2 3.65Å; R42-D84 PolarHBondContact NE-OD2 3.48Å; R42-D84 IonicContact NH2-OD2 2.72Å; R42-D84 PolarHBondContact NH2-OD2 3.08Å
43V95.8Very high93.2Very high0 Ų045.7 Ų45.70%023%0.232CC..EExtended strand (participates in β ladder)trans-140.9142.5175-177.30000108.5I22 K35 L37 C47 L48 P65 F66I22-V43 HydrophobicContact CD1-CB 4.3Å; I22-V43 HydrophobicContact CD1-CG1 3.37Å; I22-V43 HydrophobicContact CD1-CG2 3.88Å; I22-V43 HydrophobicContact CG1-CG1 4.26Å; K35-V43 WeakPolarHBondContact CA-O 3.4Å; K35-V43 WeakPolarHBondContact CB-O 3.5Å; K35-V43 PolarHBondContact N-O 2.91Å; K35-V43 PolarHBondContact O-N 2.95Å; L37-V43 HydrophobicContact CD1-CG2 4.42Å; V43-C47 HydrophobicContact CG1-CB 3.56Å; V43-L48 HydrophobicContact CB-CD1 4.31Å; V43-L48 HydrophobicContact CB-CD2 3.72Å; V43-L48 HydrophobicContact CB-CG 3.81Å; V43-L48 HydrophobicContact CG1-CD2 3.72Å; V43-L48 HydrophobicContact CG1-CG 3.71Å; V43-L48 HydrophobicContact CG2-CD2 4.17Å; V43-P65 HydrophobicContact CG2-CG 4.15Å; V43-F66 HydrophobicContact CG2-CD2 4.39Å; V43-F66 HydrophobicContact CG2-CE2 3.56Å; V43-F66 HydrophobicContact CG2-CZ 4.3Å
44C96Very high92.5Very high0 Ų047 Ų470%024%0.238CC..EExtended strand (participates in β ladder)trans-69.6146.9176.673.90000111.6C20 Y27 R32 K33 K46 C47 L48C20-C44 HydrophobicContact CB-CB 3.91Å; C20-C44 PolarHBondContact SG-N 3.4Å; Y27-C44 HydrophobicContact CD1-CB 3.82Å; Y27-C44 HydrophobicContact CE1-CB 3.67Å; R32-C44 HydrophobicContact CB-CB 4.09Å; K33-C44 CarbonylContact O-C 3.49Å; K33-C44 VanDerWaalsContact O-CA 3.27Å; K33-C44 WeakPolarHBondContact O-CA 3.38Å; C44-K46 VanDerWaalsContact C-N 3.28Å; C44-K46 PolarHBondContact O-N 3.14Å; C44-C47 WeakPolarHBondContact O-CB 3.48Å; C44-C47 PolarHBondContact O-N 3.29Å; C44-C47 PolarHBondContact SG-SG 3.1Å; C44-L48 PolarHBondContact O-N 2.88Å; C44-L48 VanDerWaalsContact O-N 3.08Å
45A95Very high91.4Very high16 Ų1648.6 Ų48.613%0.13225%0.254CS..Hα-helixtrans-51.2-45.2-179.300000112.6K33 K35 C47 L48 C49 V78K33-A45 PolarHBondContact O-N 3.47Å; K35-A45 HydrophobicContact CG-CB 3.97Å; A45-C47 VanDerWaalsContact C-N 3.29Å; A45-C47 PolarHBondContact O-N 2.72Å; A45-L48 PolarHBondContact O-N 3.41Å; A45-L48 VanDerWaalsContact O-N 3.14Å; A45-C49 PolarHBondContact O-N 3.22Å; A45-C49 PolarHBondContact O-SG 2.86Å; A45-V78 HydrophobicContact CB-CG1 4.14Å
46K93.7Very high90.1Very high62 Ų6256.3 Ų56.327%0.2730%0.296SS..Hα-helixtrans-56.6-36.7175.6-170.7170.7-174167.90113.8Q31 R32 C44 K50Q31-K46 PolarHBondContact O-N 3.43Å; R32-K46 HydrophobicContact CG-CB 4.36Å; C44-K46 VanDerWaalsContact C-N 3.28Å; C44-K46 PolarHBondContact O-N 3.14Å; K46-K50 WeakPolarHBondContact O-CG 3.45Å; K46-K50 PolarHBondContact O-N 3.36Å
47C94.4Very high88.7Confident11 Ų1156.6 Ų56.67%0.07430%0.299CS..Hα-helixtrans-74.7-40.2176.7-79.40000111.7I22 C23 V43 C44 A45 K50 I51I22-C47 HydrophobicContact CB-CB 4.36Å; I22-C47 HydrophobicContact CD1-CB 4.26Å; I22-C47 HydrophobicContact CG2-CB 4.37Å; C23-C47 VanDerWaalsContact CB-SG 3.56Å; V43-C47 HydrophobicContact CG1-CB 3.56Å; C44-C47 WeakPolarHBondContact O-CB 3.48Å; C44-C47 PolarHBondContact O-N 3.29Å; C44-C47 PolarHBondContact SG-SG 3.1Å; A45-C47 VanDerWaalsContact C-N 3.29Å; A45-C47 PolarHBondContact O-N 2.72Å; C47-K50 PolarHBondContact O-N 3.37Å; C47-I51 WeakPolarHBondContact O-CG1 3.47Å; C47-I51 PolarHBondContact O-N 3.25Å
48L93.4Very high87.4Confident0 Ų060.9 Ų60.90%033%0.327CS..Hα-helixtrans-63-42.4176.1-70-179.5000112K35 L37 V43 C44 A45 K50 I51 I52 I62 V78 L81K35-L48 HydrophobicContact CB-CD1 3.43Å; K35-L48 VanDerWaalsContact CB-CD1 3.43Å; K35-L48 HydrophobicContact CG-CD1 3.98Å; L37-L48 HydrophobicContact CD1-CD2 4.49Å; L37-L48 HydrophobicContact CD2-CD1 4.36Å; L37-L48 HydrophobicContact CD2-CD2 4.14Å; V43-L48 HydrophobicContact CB-CD1 4.31Å; V43-L48 HydrophobicContact CB-CD2 3.72Å; V43-L48 HydrophobicContact CB-CG 3.81Å; V43-L48 HydrophobicContact CG1-CD2 3.72Å; V43-L48 HydrophobicContact CG1-CG 3.71Å; V43-L48 HydrophobicContact CG2-CD2 4.17Å; C44-L48 PolarHBondContact O-N 2.88Å; C44-L48 VanDerWaalsContact O-N 3.08Å; A45-L48 PolarHBondContact O-N 3.41Å; A45-L48 VanDerWaalsContact O-N 3.14Å; L48-K50 VanDerWaalsContact C-N 3.32Å; L48-K50 PolarHBondContact O-N 2.9Å; L48-I51 HydrophobicContact CD2-CD1 4.36Å; L48-I51 PolarHBondContact O-N 3.34Å; L48-I51 VanDerWaalsContact O-N 3.1Å; L48-I52 WeakPolarHBondContact O-CG1 3.46Å; L48-I52 PolarHBondContact O-N 3.16Å; L48-I52 VanDerWaalsContact O-N 3.09Å; L48-I62 HydrophobicContact CB-CD1 4.46Å; L48-I62 HydrophobicContact CD2-CD1 4.34Å; L48-I62 HydrophobicContact CD2-CG2 4.12Å; L48-V78 HydrophobicContact CB-CG1 3.72Å; L48-V78 HydrophobicContact CB-CG2 3.96Å; L48-V78 HydrophobicContact CD1-CG1 4.03Å; L48-L81 HydrophobicContact CD1-CD1 3.68Å
49C90.8Very high86.5Confident44 Ų4464.2 Ų64.230%0.29734%0.343SS..Hα-helixtrans-56.1-48.1174.9-65.60000111A45 I51 I52 D53A45-C49 PolarHBondContact O-N 3.22Å; A45-C49 PolarHBondContact O-SG 2.86Å; C49-I51 VanDerWaalsContact C-N 3.3Å; C49-I51 PolarHBondContact O-N 2.68Å; C49-I52 PolarHBondContact O-N 2.83Å; C49-I52 VanDerWaalsContact O-N 3.16Å; C49-D53 PolarHBondContact O-N 3Å
50K89.5Confident85.8Confident93 Ų9363.2 Ų63.240%0.40434%0.338SS..Hα-helixtrans-60.3-38.7176.6-71.1-178.5178-164.60112.9K46 C47 L48 I52 D53 F54K46-K50 WeakPolarHBondContact O-CG 3.45Å; K46-K50 PolarHBondContact O-N 3.36Å; C47-K50 PolarHBondContact O-N 3.37Å; L48-K50 VanDerWaalsContact C-N 3.32Å; L48-K50 PolarHBondContact O-N 2.9Å; K50-I52 VanDerWaalsContact C-N 3.28Å; K50-I52 PolarHBondContact O-N 2.96Å; K50-D53 PolarHBondContact O-N 2.81Å; K50-F54 HydrophobicContact CB-CD2 4.13Å; K50-F54 HydrophobicContact CB-CE2 4.23Å; K50-F54 HydrophobicContact CG-CE2 4.29Å; K50-F54 WeakPolarHBondContact O-CB 3.47Å; K50-F54 WeakPolarHBondContact O-CD2 2.89Å; K50-F54 PolarHBondContact O-N 2.72Å
51I89.1Confident85.5Confident48 Ų4860.1 Ų60.125%0.24632%0.316CS..Hα-helixtrans-63.5-38.9179-70.9163.6000110.5I22 C47 L48 C49 G55 I62 P65I22-I51 HydrophobicContact CD1-CD1 4.02Å; C47-I51 WeakPolarHBondContact O-CG1 3.47Å; C47-I51 PolarHBondContact O-N 3.25Å; L48-I51 HydrophobicContact CD2-CD1 4.36Å; L48-I51 PolarHBondContact O-N 3.34Å; L48-I51 VanDerWaalsContact O-N 3.1Å; C49-I51 VanDerWaalsContact C-N 3.3Å; C49-I51 PolarHBondContact O-N 2.68Å; I51-G55 VanDerWaalsContact O-CA 3.29Å; I51-G55 WeakPolarHBondContact O-CA 3.36Å; I51-G55 PolarHBondContact O-N 2.96Å; I51-I62 HydrophobicContact CG2-CG2 4.37Å; I51-P65 HydrophobicContact CD1-CG 4.11Å
52I86Confident85.3Confident45 Ų4556.8 Ų56.823%0.23130%0.301CS..Hα-helixtrans-69.1-47.3174.8-61.3169.1000110.5L48 C49 K50 F54 G55 I62 L73 V78L48-I52 WeakPolarHBondContact O-CG1 3.46Å; L48-I52 PolarHBondContact O-N 3.16Å; L48-I52 VanDerWaalsContact O-N 3.09Å; C49-I52 PolarHBondContact O-N 2.83Å; C49-I52 VanDerWaalsContact O-N 3.16Å; K50-I52 VanDerWaalsContact C-N 3.28Å; K50-I52 PolarHBondContact O-N 2.96Å; I52-F54 VanDerWaalsContact C-N 3.3Å; I52-F54 PolarHBondContact O-N 3.37Å; I52-G55 PolarHBondContact O-N 2.81Å; I52-I62 HydrophobicContact CD1-CD1 3.75Å; I52-I62 HydrophobicContact CD1-CG1 3.91Å; I52-I62 HydrophobicContact CG1-CD1 4.03Å; I52-I62 HydrophobicContact CG1-CG1 3.78Å; I52-L73 HydrophobicContact CD1-CD1 3.64Å; I52-V78 HydrophobicContact CD1-CG2 3.35Å
53D83.6Confident85.2Confident96 Ų9653.7 Ų53.751%0.51330%0.295SS..Hα-helixtrans-64.2-32.5-175.4-64.5-28.6000113.2C49 K50C49-D53 PolarHBondContact O-N 3Å; K50-D53 PolarHBondContact O-N 2.81Å
54F79.3Confident85.1Confident96 Ų9653.7 Ų53.742%0.42130%0.295SS..Hα-helixtrans-104-6.4-179.8-63.6-63000114K50 I52 L176 Q179K50-F54 HydrophobicContact CB-CD2 4.13Å; K50-F54 HydrophobicContact CB-CE2 4.23Å; K50-F54 HydrophobicContact CG-CE2 4.29Å; K50-F54 WeakPolarHBondContact O-CB 3.47Å; K50-F54 WeakPolarHBondContact O-CD2 2.89Å; K50-F54 PolarHBondContact O-N 2.72Å; I52-F54 VanDerWaalsContact C-N 3.3Å; I52-F54 PolarHBondContact O-N 3.37Å; F54-L176 HydrophobicContact CE1-CD1 4.3Å; F54-L176 HydrophobicContact CZ-CD1 4.35Å; F54-Q179 HydrophobicContact CE1-CG 4.36Å; F54-Q179 VanDerWaalsContact CE1-NE2 3.3Å; F54-Q179 HydrophobicContact CZ-CG 4.19Å
55G73Confident85Confident32 Ų3256.8 Ų56.833%0.3332%0.315SS..  trans-78.2139.2-178.800000111I51 I52 S57I51-G55 VanDerWaalsContact O-CA 3.29Å; I51-G55 WeakPolarHBondContact O-CA 3.36Å; I51-G55 PolarHBondContact O-N 2.96Å; I52-G55 PolarHBondContact O-N 2.81Å; G55-S57 PolarHBondContact O-N 2.89Å
56D67.7Low84.9Confident177 Ų17760.1 Ų60.195%0.94733%0.327SS*.  trans-76.412.2164.3-65.4-40.2000111.7
57S66.9Low84.9Confident36 Ų3660 Ų6025%0.25233%0.333SS..SBendtrans-69.9144.7-178.649.30000110.8G55 V61G55-S57 PolarHBondContact O-N 2.89Å; S57-V61 PolarHBondContact OG-O 3.19Å
58P68.4Low84.9Confident94 Ų9469.5 Ų69.561%0.6137%0.368SS*.PPolyproline II helixtrans-54.5146.1171.621.9-30.5000110.6G60 V61P58-G60 PolarHBondContact O-N 3Å; P58-V61 HydrophobicContact CG-CB 4.37Å; P58-V61 HydrophobicContact CG-CG2 4.3Å; P58-V61 PolarHBondContact O-N 3.11Å
59Q73.9Confident84.9Confident179 Ų17974.2 Ų74.284%0.83639%0.388SS*.THydrogen-bonded Turntrans-50.3130.8176.6-67169.77.500109.1
60G80.4Confident85Confident10 Ų1078.1 Ų78.110%0.10340%0.402CS..THydrogen-bonded Turntrans87.45.917800000116.9P58 C72 L73 D76P58-G60 PolarHBondContact O-N 3Å; G60-C72 CarbonylContact O-C 3.59Å; G60-C72 WeakPolarHBondContact O-CA 3.46Å; G60-L73 PolarHBondContact O-N 3.22Å; G60-D76 WeakPolarHBondContact CA-OD1 3.43Å; G60-D76 PolarHBondContact N-OD1 3.06Å
61V88.3Confident85.1Confident28 Ų2873.7 Ų73.717%0.1738%0.383CS..EExtended strand (participates in β ladder)trans-123.9127.4175.6-176.20000111.3S57 P58 E70S57-V61 PolarHBondContact OG-O 3.19Å; P58-V61 HydrophobicContact CG-CB 4.37Å; P58-V61 HydrophobicContact CG-CG2 4.3Å; P58-V61 PolarHBondContact O-N 3.11Å; V61-E70 HydrophobicContact CG1-CB 3.9Å; V61-E70 HydrophobicContact CG1-CG 4.05Å
62I90.7Very high85.1Confident1 Ų175 Ų751%0.00540%0.396CS..EExtended strand (participates in β ladder)trans-106126171.4-57.7-177000109.6L37 L48 I51 I52 E70 T71 L73 L81L37-I62 HydrophobicContact CD2-CD1 4.5Å; L37-I62 HydrophobicContact CD2-CG2 4.13Å; L48-I62 HydrophobicContact CB-CD1 4.46Å; L48-I62 HydrophobicContact CD2-CD1 4.34Å; L48-I62 HydrophobicContact CD2-CG2 4.12Å; I51-I62 HydrophobicContact CG2-CG2 4.37Å; I52-I62 HydrophobicContact CD1-CD1 3.75Å; I52-I62 HydrophobicContact CD1-CG1 3.91Å; I52-I62 HydrophobicContact CG1-CD1 4.03Å; I52-I62 HydrophobicContact CG1-CG1 3.78Å; I62-E70 CarbonylContact O-C 3.57Å; I62-E70 WeakPolarHBondContact O-CA 3.23Å; I62-T71 PolarHBondContact N-O 3.05Å; I62-T71 PolarHBondContact O-N 2.93Å; I62-L73 HydrophobicContact CD1-CD1 3.91Å; I62-L73 HydrophobicContact CD1-CD2 3.91Å; I62-L73 HydrophobicContact CD1-CG 4.19Å; I62-L73 HydrophobicContact CG1-CD1 3.85Å; I62-L73 HydrophobicContact CG1-CD2 4.34Å; I62-L73 HydrophobicContact CG1-CG 4.12Å; I62-L81 HydrophobicContact CD1-CD1 3.96Å
63V92.4Very high85.1Confident59 Ų5973.4 Ų73.436%0.35839%0.388SS..EExtended strand (participates in β ladder)trans-87.4123.6168.5-178.90000109.6R68 E70V63-R68 HydrophobicContact CG1-CB 4.14Å; V63-E70 HydrophobicContact CG2-CG 4.15Å
64C94Very high84.5Confident0 Ų073.8 Ų73.80%040%0.395CS..  trans-61.4126.9177.8178.40000111.2L37 F66 C67 R68 F69L37-C64 HydrophobicContact CD1-CB 3.76Å; C64-F66 PolarHBondContact O-N 3.34Å; C64-F66 PolarHBondContact SG-N 3.49Å; C64-C67 PolarHBondContact SG-SG 3.29Å; C64-R68 WeakPolarHBondContact O-CA 3.27Å; C64-R68 PolarHBondContact O-N 2.84Å; C64-F69 HydrophobicContact CB-CB 4.41Å; C64-F69 WeakPolarHBondContact CB-O 3.24Å; C64-F69 PolarHBondContact N-O 2.88Å
65P93.6Very high84.2Confident65 Ų6574.9 Ų74.942%0.42241%0.405SS..THydrogen-bonded Turntrans-71.3-15.1-177.825.3-31000113.8I22 V43 I51I22-P65 HydrophobicContact CD1-CB 4.17Å; I22-P65 HydrophobicContact CD1-CG 3.43Å; I22-P65 VanDerWaalsContact CD1-CG 3.43Å; I22-P65 HydrophobicContact CG1-CG 4.4Å; V43-P65 HydrophobicContact CG2-CG 4.15Å; I51-P65 HydrophobicContact CD1-CG 4.11Å
66F94.2Very high84.1Confident86 Ų8677.5 Ų77.538%0.37741%0.412SS..THydrogen-bonded Turntrans-95.3-42.7-179-52-69.4000112.6K21 I22 H41 V43 C64K21-F66 HydrophobicContact CB-CE1 4.15Å; K21-F66 HydrophobicContact CB-CZ 4.13Å; I22-F66 HydrophobicContact CD1-CZ 4.38Å; I22-F66 HydrophobicContact CG1-CE1 4.42Å; I22-F66 HydrophobicContact CG1-CZ 3.88Å; H41-F66 HydrophobicContact CB-CD2 3.75Å; H41-F66 HydrophobicContact CB-CE2 4.34Å; H41-F66 AromaticContact CD2-CD2 3.88Å; H41-F66 AromaticContact CG-CD2 3.85Å; V43-F66 HydrophobicContact CG2-CD2 4.39Å; V43-F66 HydrophobicContact CG2-CE2 3.56Å; V43-F66 HydrophobicContact CG2-CZ 4.3Å; C64-F66 PolarHBondContact O-N 3.34Å; C64-F66 PolarHBondContact SG-N 3.49Å
67C93.9Very high84.8Confident59 Ų5974.5 Ų74.540%0.39939%0.392SS..THydrogen-bonded Turntrans-124.50.6-173.467.70000114.9C39 H41 C64 F69C39-C67 PolarHBondContact SG-SG 3.38Å; H41-C67 PolarHBondContact ND1-SG 3.14Å; C64-C67 PolarHBondContact SG-SG 3.29Å; C67-F69 PolarHBondContact O-N 3.49Å; C67-F69 VanDerWaalsContact O-N 3.11Å; C67-F69 VanDerWaalsContact SG-CB 3.58Å
68R93.1Very high85.7Confident212 Ų21273.3 Ų73.380%0.838%0.383SS*.  trans60.813.1-179.1-51.9-176179.1-156.9-0.8115.7V63 C64V63-R68 HydrophobicContact CG1-CB 4.14Å; C64-R68 WeakPolarHBondContact O-CA 3.27Å; C64-R68 PolarHBondContact O-N 2.84Å
69F93.8Very high86.5Confident98 Ų9872.1 Ų72.143%0.4338%0.377SS..  trans-66.7135.5172-172.2-89.9000110.6E38 C39 C64 C67E38-F69 HydrophobicContact CB-CD1 4.18Å; E38-F69 HydrophobicContact CB-CE1 3.53Å; E38-F69 HydrophobicContact CB-CZ 4.44Å; E38-F69 WeakPolarHBondContact OE2-CE1 3.32Å; C39-F69 HydrophobicContact CB-CB 3.63Å; C39-F69 HydrophobicContact CB-CD1 3.78Å; C39-F69 HydrophobicContact CB-CG 3.73Å; C64-F69 HydrophobicContact CB-CB 4.41Å; C64-F69 WeakPolarHBondContact CB-O 3.24Å; C64-F69 PolarHBondContact N-O 2.88Å; C67-F69 PolarHBondContact O-N 3.49Å; C67-F69 VanDerWaalsContact O-N 3.11Å; C67-F69 VanDerWaalsContact SG-CB 3.58Å
70E92.6Very high87.2Confident126 Ų12665.6 Ų65.659%0.58935%0.351SS*.EExtended strand (participates in β ladder)trans-85.2131.1178.8-71.2176.1-173.300110.4V61 I62 V63V61-E70 HydrophobicContact CG1-CB 3.9Å; V61-E70 HydrophobicContact CG1-CG 4.05Å; I62-E70 CarbonylContact O-C 3.57Å; I62-E70 WeakPolarHBondContact O-CA 3.23Å; V63-E70 HydrophobicContact CG2-CG 4.15Å
71T92.7Very high87.7Confident0 Ų065.7 Ų65.70%035%0.349CS..EExtended strand (participates in β ladder)trans-119.8123.2177.2-64.90000108.5L37 E38 I62 L81L37-T71 HydrophobicContact CD2-CG2 4.14Å; E38-T71 HydrophobicContact CB-CG2 4.22Å; E38-T71 HydrophobicContact CG-CG2 3.82Å; E38-T71 PolarHBondContact N-OG1 2.95Å; I62-T71 PolarHBondContact N-O 3.05Å; I62-T71 PolarHBondContact O-N 2.93Å; T71-L81 HydrophobicContact CG2-CD2 3.75Å
72C89.5Confident87.9Confident77 Ų7768.3 Ų68.352%0.5237%0.367SS..EExtended strand (participates in β ladder)trans-83.6134.6-179.8-660000110E38 G60E38-C72 PolarHBondContact OE1-N 3.17Å; G60-C72 CarbonylContact O-C 3.59Å; G60-C72 WeakPolarHBondContact O-CA 3.46Å
73L84.8Confident88.1Confident11 Ų1170.1 Ų70.16%0.05838%0.377CS..  trans-96.8117.7175.6-62.6176000109I52 G60 I62 D75 D76 L81I52-L73 HydrophobicContact CD1-CD1 3.64Å; G60-L73 PolarHBondContact O-N 3.22Å; I62-L73 HydrophobicContact CD1-CD1 3.91Å; I62-L73 HydrophobicContact CD1-CD2 3.91Å; I62-L73 HydrophobicContact CD1-CG 4.19Å; I62-L73 HydrophobicContact CG1-CD1 3.85Å; I62-L73 HydrophobicContact CG1-CD2 4.34Å; I62-L73 HydrophobicContact CG1-CG 4.12Å; L73-D75 VanDerWaalsContact C-N 3.25Å; L73-D75 PolarHBondContact O-N 2.75Å; L73-D76 PolarHBondContact O-N 3.2Å; L73-L81 HydrophobicContact CD2-CD1 3.88Å; L73-L81 HydrophobicContact CD2-CD2 4.01Å; L73-L81 HydrophobicContact CD2-CG 3.7Å
74P70.6Confident88.1Confident104 Ų10468.2 Ų68.268%0.67536%0.364SS*.THydrogen-bonded Turntrans-66-25.7-178.222.7-31.6000113.9
75D73.3Confident88Confident118 Ų11873.4 Ų73.463%0.63139%0.392SS*.THydrogen-bonded Turntrans-122.217.8-179.7-62.3-49.6000112.6L73 E77L73-D75 VanDerWaalsContact C-N 3.25Å; L73-D75 PolarHBondContact O-N 2.75Å; D75-E77 PolarHBondContact O-N 2.74Å
76D71.6Confident87.8Confident88 Ų8875.1 Ų75.147%0.47140%0.398SS..SBendtrans55.17.7-170.9-63.9-20000115.4G60 L73G60-D76 WeakPolarHBondContact CA-OD1 3.43Å; G60-D76 PolarHBondContact N-OD1 3.06Å; L73-D76 PolarHBondContact O-N 3.2Å
77E82.4Confident87.6Confident114 Ų11471.5 Ų71.553%0.53338%0.382SS..  trans-108.6137.3-177.5-69.1-171-175.800112.6D75 S79 S80D75-E77 PolarHBondContact O-N 2.74Å; E77-S79 WeakPolarHBondContact CB-OG 3.39Å; E77-S79 PolarHBondContact O-N 2.84Å; E77-S79 VanDerWaalsContact O-N 3.16Å; E77-S79 PolarHBondContact OE2-OG 2.76Å; E77-S80 WeakPolarHBondContact O-CB 3.4Å; E77-S80 PolarHBondContact O-N 3.17Å; E77-S80 VanDerWaalsContact O-N 3.16Å; E77-S80 PolarHBondContact O-OG 3.39Å
78V86.1Confident87.4Confident10 Ų1069.7 Ų69.76%0.06137%0.369CS..G310 helixtrans-59.5-24.9170.3178.10000112.3K35 A45 L48 I52 S80 L81K35-V78 VanDerWaalsContact CE-O 3.24Å; K35-V78 WeakPolarHBondContact CE-O 3.35Å; K35-V78 HydrophobicContact CG-CG1 4.14Å; A45-V78 HydrophobicContact CB-CG1 4.14Å; L48-V78 HydrophobicContact CB-CG1 3.72Å; L48-V78 HydrophobicContact CB-CG2 3.96Å; L48-V78 HydrophobicContact CD1-CG1 4.03Å; I52-V78 HydrophobicContact CD1-CG2 3.35Å; V78-S80 PolarHBondContact O-N 3.15Å; V78-L81 PolarHBondContact O-N 3.46Å
79S85.7Confident87.2Confident70 Ų7064.8 Ų64.849%0.4936%0.358SS..G310 helixtrans-58.2-33.7178.164.10000111.9K35 E77 L81K35-S79 PolarHBondContact NZ-O 3.16Å; K35-S79 VanDerWaalsContact NZ-O 3.17Å; E77-S79 WeakPolarHBondContact CB-OG 3.39Å; E77-S79 PolarHBondContact O-N 2.84Å; E77-S79 VanDerWaalsContact O-N 3.16Å; E77-S79 PolarHBondContact OE2-OG 2.76Å; S79-L81 VanDerWaalsContact C-N 3.3Å; S79-L81 PolarHBondContact O-N 3.22Å
80S86.8Confident86.8Confident41 Ų4164 Ų6429%0.28736%0.358SS..G310 helixtrans-68.2-23.9-178.169.20000114E77 V78E77-S80 WeakPolarHBondContact O-CB 3.4Å; E77-S80 PolarHBondContact O-N 3.17Å; E77-S80 VanDerWaalsContact O-N 3.16Å; E77-S80 PolarHBondContact O-OG 3.39Å; V78-S80 PolarHBondContact O-N 3.15Å
81L90.9Very high86.6Confident12 Ų1260.2 Ų60.26%0.06334%0.341CS..SBendtrans-69.5143.4179.1-71.9171.1000111.4K35 L37 L48 I62 T71 L73 V78 S79K35-L81 HydrophobicContact CB-CB 4.34Å; K35-L81 HydrophobicContact CD-CB 3.98Å; K35-L81 WeakPolarHBondContact CD-O 3.17Å; K35-L81 HydrophobicContact CG-CB 4.49Å; K35-L81 PolarHBondContact NZ-O 3.12Å; L37-L81 HydrophobicContact CD2-CD1 3.92Å; L48-L81 HydrophobicContact CD1-CD1 3.68Å; I62-L81 HydrophobicContact CD1-CD1 3.96Å; T71-L81 HydrophobicContact CG2-CD2 3.75Å; L73-L81 HydrophobicContact CD2-CD1 3.88Å; L73-L81 HydrophobicContact CD2-CD2 4.01Å; L73-L81 HydrophobicContact CD2-CG 3.7Å; V78-L81 PolarHBondContact O-N 3.46Å; S79-L81 VanDerWaalsContact C-N 3.3Å; S79-L81 PolarHBondContact O-N 3.22Å
82P92.9Very high86.1Confident83 Ų8363.1 Ų63.154%0.53937%0.365SS..PPolyproline II helixtrans-64.5141.1178.425.7-32.6000111.7K35 V36K35-P82 WeakPolarHBondContact CA-O 3.15Å; V36-P82 HydrophobicContact CB-CG 4.33Å; V36-P82 PolarHBondContact N-O 3.35Å
83D94.7Very high85.3Confident39 Ų3962.3 Ų62.321%0.20936%0.36CS..BIsolated β-bridgetrans-83.1146171.1-66.8-26.2000110.4K33 P34 K35 N85 L88K33-D83 IonicContact NZ-OD2 3.22Å; P34-D83 CarbonylContact O-C 3.51Å; P34-D83 WeakPolarHBondContact O-CA 3.31Å; K35-D83 WeakPolarHBondContact CD-OD1 3.36Å; K35-D83 WeakPolarHBondContact CE-OD1 3.47Å; K35-D83 IonicContact NZ-OD1 2.83Å; K35-D83 PolarHBondContact NZ-OD1 3.05Å; D83-N85 PolarHBondContact O-N 2.92Å; D83-N85 VanDerWaalsContact O-N 3.16Å; D83-L88 HydrophobicContact CB-CD1 3.61Å
84D93.9Very high84.4Confident19 Ų1965.1 Ų65.110%0.10239%0.392CS..  trans-76.699.9168-168.1-45.7000110.3P34 V36 R42 N86 I87 L88P34-D84 HydrophobicContact CB-CB 4.08Å; P34-D84 HydrophobicContact CG-CB 3.99Å; P34-D84 PolarHBondContact O-N 3.43Å; V36-D84 HydrophobicContact CG2-CB 3.87Å; R42-D84 IonicContact CZ-OD2 2.83Å; R42-D84 IonicContact NE-OD2 3.65Å; R42-D84 PolarHBondContact NE-OD2 3.48Å; R42-D84 IonicContact NH2-OD2 2.72Å; R42-D84 PolarHBondContact NH2-OD2 3.08Å; D84-N86 VanDerWaalsContact C-N 3.28Å; D84-N86 PolarHBondContact O-N 3.28Å; D84-N86 VanDerWaalsContact OD1-CB 3.31Å; D84-N86 WeakPolarHBondContact OD1-CB 3.46Å; D84-N86 PolarHBondContact OD1-N 3.29Å; D84-I87 HydrophobicContact CB-CB 4.47Å; D84-I87 HydrophobicContact CB-CD1 4.26Å; D84-I87 HydrophobicContact CB-CG1 4.43Å; D84-I87 PolarHBondContact O-N 3.16Å; D84-I87 PolarHBondContact OD1-N 3.49Å; D84-L88 WeakPolarHBondContact O-CG 3.2Å; D84-L88 PolarHBondContact O-N 3.22Å; D84-L88 VanDerWaalsContact O-N 3.1Å
85N91Very high83.7Confident109 Ų10963 Ų6358%0.58339%0.388SS*.Hα-helixtrans-65.1-26.7-178.6-69.1-31.8000113.6D83 L88 L89D83-N85 PolarHBondContact O-N 2.92Å; D83-N85 VanDerWaalsContact O-N 3.16Å; N85-L88 PolarHBondContact O-N 2.83Å; N85-L89 VanDerWaalsContact O-CB 3.32Å; N85-L89 WeakPolarHBondContact O-CB 3.32Å; N85-L89 WeakPolarHBondContact O-CG 3.41Å; N85-L89 PolarHBondContact O-N 3.29Å
86N89.3Confident82.5Confident102 Ų10266.6 Ų66.655%0.54540%0.399SS..Hα-helixtrans-66.2-48.2178.9-174.1-30.1000109.7D84 L88 L89 N90D84-N86 VanDerWaalsContact C-N 3.28Å; D84-N86 PolarHBondContact O-N 3.28Å; D84-N86 VanDerWaalsContact OD1-CB 3.31Å; D84-N86 WeakPolarHBondContact OD1-CB 3.46Å; D84-N86 PolarHBondContact OD1-N 3.29Å; N86-L88 PolarHBondContact O-N 2.82Å; N86-L89 PolarHBondContact O-N 2.81Å; N86-N90 PolarHBondContact O-N 3Å; N86-N90 PolarHBondContact O-ND2 3.34Å; N86-N90 VanDerWaalsContact O-ND2 3.16Å; N86-N90 PolarHBondContact OD1-ND2 2.88Å
87I90Very high81.6Confident9 Ų966.6 Ų66.65%0.04642%0.419CS..Hα-helixtrans-62.6-44.3175.5-63.1176.5000110.5L18 Y27 P34 D84 L89 N90 L91L18-I87 HydrophobicContact CD2-CG2 3.86Å; Y27-I87 HydrophobicContact CD2-CD1 4.24Å; Y27-I87 HydrophobicContact CD2-CG2 3.72Å; Y27-I87 HydrophobicContact CE2-CD1 4.01Å; Y27-I87 HydrophobicContact CG-CG2 4.11Å; P34-I87 HydrophobicContact CB-CB 4.43Å; P34-I87 HydrophobicContact CB-CD1 4.03Å; P34-I87 HydrophobicContact CB-CG2 4.29Å; P34-I87 HydrophobicContact CG-CB 3.83Å; P34-I87 HydrophobicContact CG-CD1 4.37Å; P34-I87 HydrophobicContact CG-CG2 3.74Å; D84-I87 HydrophobicContact CB-CB 4.47Å; D84-I87 HydrophobicContact CB-CD1 4.26Å; D84-I87 HydrophobicContact CB-CG1 4.43Å; D84-I87 PolarHBondContact O-N 3.16Å; D84-I87 PolarHBondContact OD1-N 3.49Å; I87-L89 VanDerWaalsContact C-N 3.32Å; I87-L89 PolarHBondContact O-N 3.11Å; I87-N90 PolarHBondContact O-N 3.39Å; I87-L91 HydrophobicContact CG2-CD1 3.98Å; I87-L91 HydrophobicContact CG2-CG 4.39Å; I87-L91 VanDerWaalsContact O-CG 3.23Å; I87-L91 WeakPolarHBondContact O-CG 3.49Å; I87-L91 PolarHBondContact O-N 3.45Å
88L90.5Very high79.9Confident22 Ų2269.7 Ų69.712%0.11543%0.431CS..Hα-helixtrans-60.9-39.3177.9-69178.8000112.8L29 K33 P34 D83 D84 N85 N86 L91 A92L29-L88 HydrophobicContact CD2-CB 4.18Å; L29-L88 HydrophobicContact CD2-CD2 3.51Å; L29-L88 HydrophobicContact CD2-CG 4.42Å; K33-L88 HydrophobicContact CG-CD2 4.38Å; P34-L88 HydrophobicContact CG-CD2 4.32Å; P34-L88 HydrophobicContact CG-CG 4.28Å; D83-L88 HydrophobicContact CB-CD1 3.61Å; D84-L88 WeakPolarHBondContact O-CG 3.2Å; D84-L88 PolarHBondContact O-N 3.22Å; D84-L88 VanDerWaalsContact O-N 3.1Å; N85-L88 PolarHBondContact O-N 2.83Å; N86-L88 PolarHBondContact O-N 2.82Å; L88-L91 HydrophobicContact CD2-CD1 4.43Å; L88-L91 PolarHBondContact O-N 3.34Å; L88-A92 WeakPolarHBondContact O-CB 3.49Å; L88-A92 PolarHBondContact O-N 3.09Å
89L88.3Confident77.7Confident109 Ų10978.8 Ų78.857%0.57147%0.47SS*.Hα-helixtrans-66.8-42.4176.5-74.2170.4000111.7N85 N86 I87 L91 A92 C93N85-L89 VanDerWaalsContact O-CB 3.32Å; N85-L89 WeakPolarHBondContact O-CB 3.32Å; N85-L89 WeakPolarHBondContact O-CG 3.41Å; N85-L89 PolarHBondContact O-N 3.29Å; N86-L89 PolarHBondContact O-N 2.81Å; I87-L89 VanDerWaalsContact C-N 3.32Å; I87-L89 PolarHBondContact O-N 3.11Å; L89-L91 VanDerWaalsContact C-N 3.29Å; L89-L91 PolarHBondContact O-N 3.32Å; L89-A92 PolarHBondContact O-N 3.5Å; L89-C93 WeakPolarHBondContact O-CB 3.5Å; L89-C93 PolarHBondContact O-N 3.33Å; L89-C93 PolarHBondContact O-SG 3.33Å
90N86.4Confident75.7Confident80 Ų8080.6 Ų80.643%0.42848%0.481SS..Hα-helixtrans-60.8-40.7174.8-71.1-34.9000111.5L18 N86 I87 C93 G94L18-N90 HydrophobicContact CD2-CB 4.08Å; N86-N90 PolarHBondContact O-N 3Å; N86-N90 PolarHBondContact O-ND2 3.34Å; N86-N90 VanDerWaalsContact O-ND2 3.16Å; N86-N90 PolarHBondContact OD1-ND2 2.88Å; I87-N90 PolarHBondContact O-N 3.39Å; N90-C93 PolarHBondContact O-N 3.05Å; N90-G94 PolarHBondContact O-N 3.29Å; N90-G94 VanDerWaalsContact O-N 3.13Å
91L86.3Confident73.4Confident47 Ų4784.2 Ų84.225%0.24650%0.497CS..Hα-helixtrans-64.8-40.7175-67.9167000112.3Y27 L29 I87 L88 L89Y27-L91 VanDerWaalsContact O-CD2 3.31Å; Y27-L91 WeakPolarHBondContact O-CD2 3.46Å; L29-L91 HydrophobicContact CD2-CB 4.22Å; I87-L91 HydrophobicContact CG2-CD1 3.98Å; I87-L91 HydrophobicContact CG2-CG 4.39Å; I87-L91 VanDerWaalsContact O-CG 3.23Å; I87-L91 WeakPolarHBondContact O-CG 3.49Å; I87-L91 PolarHBondContact O-N 3.45Å; L88-L91 HydrophobicContact CD2-CD1 4.43Å; L88-L91 PolarHBondContact O-N 3.34Å; L89-L91 VanDerWaalsContact C-N 3.29Å; L89-L91 PolarHBondContact O-N 3.32Å
92A83.6Confident71Confident61 Ų6189 Ų8950%0.50453%0.528SS..Hα-helixtrans-70.9-33.8179.400000112.8L88 L89L88-A92 WeakPolarHBondContact O-CB 3.49Å; L88-A92 PolarHBondContact O-N 3.09Å; L89-A92 PolarHBondContact O-N 3.5Å
93C73.4Confident68.4Low60 Ų6092 Ų9241%0.40554%0.54SS..Hα-helixtrans-86.2-11.9-178.2-61.90000113.8L89 N90 G95L89-C93 WeakPolarHBondContact O-CB 3.5Å; L89-C93 PolarHBondContact O-N 3.33Å; L89-C93 PolarHBondContact O-SG 3.33Å; N90-C93 PolarHBondContact O-N 3.05Å; C93-G95 PolarHBondContact O-N 3.22Å
94G64.2Low65.5Low70 Ų7095.6 Ų95.672%0.72256%0.559SS**THydrogen-bonded Turntrans-67.8-9.6-179.600000115.2N90N90-G94 PolarHBondContact O-N 3.29Å; N90-G94 VanDerWaalsContact O-N 3.13Å
95G56.2Low63.2Low59 Ų59100.6 Ų100.661%0.60859%0.593SS**SBendtrans-102.1104.2174.500000111.7C93C93-G95 PolarHBondContact O-N 3.22Å
96K47.8Very low61.1Low194 Ų194100 Ų10084%0.84359%0.594SS**SBendtrans67.397.9178.9-71.4172167.91690115.3K98K96-K98 PolarHBondContact O-N 2.66Å
97G52.6Low58.7Low88 Ų88102.9 Ų102.991%0.90760%0.603SS**SBend45.332.1121.900000119.1
98K47.7Very low56.4Low179 Ų179110.5 Ų110.578%0.77864%0.643SS**  trans-138.2103.5167.1-74.6-173.9177.7179.50106.9K96 C100K96-K98 PolarHBondContact O-N 2.66Å; K98-C100 PolarHBondContact O-N 3.44Å
99K39.4Very low53.8Low202 Ų202115.8 Ų115.888%0.87867%0.671SS**  trans-52.4106.5158.8-66.9175.4179178.80106.1L101K99-L101 PolarHBondContact O-N 3.01Å
100C43.3Very low51.4Low108 Ų108117.2 Ų117.273%0.7368%0.679SS**  trans-80.271159.6-153.40000105.9K98 P102K98-C100 PolarHBondContact O-N 3.44Å; C100-P102 VanDerWaalsContact O-CD 3.28Å; C100-P102 WeakPolarHBondContact O-CD 3.33Å
101L39.6Very low49.4Very low116 Ų116117.8 Ų117.861%0.60769%0.685SS**  trans-75.8116.9163.3-176.967.8000105.2K99 D103K99-L101 PolarHBondContact O-N 3.01Å; L101-D103 VanDerWaalsContact C-N 3.28Å; L101-D103 PolarHBondContact O-N 3.32Å
102P39.3Very low47.3Very low112 Ų112120.9 Ų120.973%0.72771%0.708SS**  trans-65.3103.7152.527.5-26.9000105.5C100 N104C100-P102 VanDerWaalsContact O-CD 3.28Å; C100-P102 WeakPolarHBondContact O-CD 3.33Å; P102-N104 PolarHBondContact O-N 3.27Å
103D39.1Very low45.3Very low146 Ų146127.3 Ų127.378%0.78172%0.724SS**SBendtrans-72.975.3178.3-14913.8000108.3L101L101-D103 VanDerWaalsContact C-N 3.28Å; L101-D103 PolarHBondContact O-N 3.32Å
104N33.9Very low43.8Very low115 Ų115134.5 Ų134.562%0.61574%0.743SS**  trans-169.2116.4154.5-151.6-33.3000111.8P102 T106P102-N104 PolarHBondContact O-N 3.27Å; N104-T106 VanDerWaalsContact C-N 3.32Å; N104-T106 PolarHBondContact O-N 3.41Å; N104-T106 PolarHBondContact OD1-N 3.29Å; N104-T106 PolarHBondContact OD1-OG1 2.92Å
105P45.8Very low42.8Very low124 Ų124136.1 Ų136.181%0.80574%0.735SS**  trans-92.157.4170.438.2-30.9000109.9
106T46.3Very low42.3Very low98 Ų98137.2 Ų137.260%0.60174%0.738SS**SBendtrans-159.2129.1168.5-22.60000110.9N104N104-T106 VanDerWaalsContact C-N 3.32Å; N104-T106 PolarHBondContact O-N 3.41Å; N104-T106 PolarHBondContact OD1-N 3.29Å; N104-T106 PolarHBondContact OD1-OG1 2.92Å
107E38.5Very low42Very low161 Ų161133.4 Ų133.475%0.75274%0.736SS**  trans84.687.9162.3-46.4-151160.400117.9L109E107-L109 PolarHBondContact O-N 3.09Å
108L41.5Very low41.6Very low169 Ų169135.8 Ų135.889%0.88573%0.727SS**  trans-63.384.5148.6-86156.6000108.7L110L108-L110 VanDerWaalsContact C-N 3.29Å; L108-L110 PolarHBondContact O-N 3.39Å
109L37.5Very low41.7Very low133 Ų133132.5 Ų132.570%0.69672%0.722SS**  trans-7387.9173.3-149.7164.4000108.4E107 T111E107-L109 PolarHBondContact O-N 3.09Å; L109-T111 HydrophobicContact CD2-CG2 4.26Å; L109-T111 PolarHBondContact O-N 3.1Å
110L37Very low41.6Very low140 Ų140128.5 Ų128.573%0.73372%0.719SS**  trans-61.5100.9171-73.5160.8000108.3L108L108-L110 VanDerWaalsContact C-N 3.29Å; L108-L110 PolarHBondContact O-N 3.39Å
111T45Very low41.6Very low92 Ų92128.7 Ų128.756%0.56472%0.719SS**  trans-71.6135.9172.132.40000109.9L109 K113 R114L109-T111 HydrophobicContact CD2-CG2 4.26Å; L109-T111 PolarHBondContact O-N 3.1Å; T111-K113 PolarHBondContact O-N 3.14Å; T111-R114 PolarHBondContact O-N 3.16Å
112P42.3Very low41.2Very low111 Ų111128.3 Ų128.372%0.72173%0.726SS**G310 helixtrans-65.8-9.8-166.622.4-32.3000114.9R114P112-R114 VanDerWaalsContact C-N 3.29Å; P112-R114 PolarHBondContact O-N 2.63Å
113K41.2Very low41.3Very low196 Ų196131.4 Ų131.485%0.85273%0.73SS**G310 helixtrans-71.2-17.5178.3-92.4-179.8174.4174.60114.5T111T111-K113 PolarHBondContact O-N 3.14Å
114R42.3Very low41.1Very low212 Ų212130.4 Ų130.480%0.873%0.73SS**G310 helixtrans-97.3-12.1179-68-149.1139.6-145.5-6.7114.7T111 P112T111-R114 PolarHBondContact O-N 3.16Å; P112-R114 VanDerWaalsContact C-N 3.29Å; P112-R114 PolarHBondContact O-N 2.63Å
115L42.6Very low41.5Very low103 Ų103130.3 Ų130.354%0.53974%0.738SS.*THydrogen-bonded Turntrans-82.6-25.2178.8-138.979.7000112.9S117 L118L115-S117 PolarHBondContact O-N 2.88Å; L115-L118 PolarHBondContact O-N 3.5Å; L115-L118 VanDerWaalsContact O-N 3.12Å
116A44.8Very low41.3Very low82 Ų82129 Ų12968%0.67873%0.732SS**THydrogen-bonded Turntrans-65.4-21.6178.500000113.5L118A116-L118 VanDerWaalsContact C-N 3.34Å
117S41.9Very low41.4Very low114 Ų114132 Ų13280%0.79774%0.744SS**THydrogen-bonded Turntrans-81.9-11.4176.1-173.10000113.6L115L115-S117 PolarHBondContact O-N 2.88Å
118L45.3Very low41.9Very low139 Ų139130.3 Ų130.373%0.72875%0.749SS**SBendtrans-98.3-4.8-179-76.1154.9000112.6L115 A116L115-L118 PolarHBondContact O-N 3.5Å; L115-L118 VanDerWaalsContact O-N 3.12Å; A116-L118 VanDerWaalsContact C-N 3.34Å
119V49.8Very low42.1Very low110 Ų110129.8 Ų129.867%0.66775%0.746SS**  trans-123.590.4-176.2-173.90000109.8
120S36.3Very low42.6Very low118 Ų118128.9 Ų128.983%0.82575%0.746SS**  trans-161.2152.2145-87.90000110.7
121P43.7Very low42.7Very low111 Ų111128.8 Ų128.872%0.72174%0.744SS**  -117.5143.7-123.536.4-26.3000113
122S31.1Very low42.7Very low108 Ų108129.6 Ų129.676%0.75575%0.75SS**  trans-161.7110.9153.3-62.70000111.9
123H41.3Very low42.9Very low178 Ų178131.9 Ų131.982%0.82475%0.754SS**  trans21.8113.2140.1-45-80.7000116.2
124T35.8Very low43Very low125 Ų125130.1 Ų130.177%0.76775%0.751SS**  -163.9132.455.553.30000111.2
125S41.2Very low43Very low112 Ų112128.2 Ų128.278%0.78375%0.751SS**  trans51.5124157.174.80000119.2
126S42.8Very low42.8Very low98 Ų98129.6 Ų129.669%0.68576%0.763SS**  cis-164.6138.622.3-54.40000111.7
127N47.1Very low42Very low160 Ų160134.1 Ų134.186%0.85677%0.77SS**  trans62.670.4153.4-53.4-39.4000120.7
128C48.8Very low41.3Very low125 Ų125138.1 Ų138.185%0.84577%0.768SS**  trans-101.3113.9154.7-66.60000109.6V130C128-V130 PolarHBondContact O-N 3.31Å
129L45.9Very low40.2Very low158 Ų158139.5 Ų139.583%0.82777%0.771SS**  trans-88.1103.1175.4-137.8160.2000108I131L129-I131 HydrophobicContact CD2-CG1 3.93Å
130V49.5Very low39Very low115 Ų115139.6 Ų139.670%0.69778%0.776SS**  trans-88.1108.1176.3178.50000108.2C128 T132C128-V130 PolarHBondContact O-N 3.31Å; V130-T132 HydrophobicContact CG1-CG2 4.37Å
131I37.8Very low39Very low137 Ų137139.1 Ų139.170%0.70377%0.77SS**  trans-93.1101.3173.9-56.1173.2000107.6L129 I133L129-I131 HydrophobicContact CD2-CG1 3.93Å; I131-I133 HydrophobicContact CG2-CG1 4.3Å
132T44.5Very low38.2Very low110 Ų110142.6 Ų142.668%0.67578%0.777SS**  trans-86.1108.6165.839.20000109V130 M134V130-T132 HydrophobicContact CG1-CG2 4.37Å; T132-M134 PolarHBondContact O-N 2.78Å; T132-M134 VanDerWaalsContact O-N 3.17Å
133I48.2Very low37.8Very low158 Ų158143.2 Ų143.281%0.8178%0.777SS**  trans-74.7102.7168.5-56.9173.3000106.6I131 E135I131-I133 HydrophobicContact CG2-CG1 4.3Å; I133-E135 PolarHBondContact O-N 2.89Å
134M41.6Very low37.1Very low160 Ų160141.8 Ų141.879%0.78877%0.774SS**  trans-80.9111.7169.7-67.4-178.967.600108T132 V136T132-M134 PolarHBondContact O-N 2.78Å; T132-M134 VanDerWaalsContact O-N 3.17Å; M134-V136 PolarHBondContact O-N 3.3Å
135E42.1Very low36.6Very low171 Ų171142.2 Ų142.280%0.79977%0.772SS**  trans-70.9118.2167.4-167.6170.4-17700108.5I133 Q137I133-E135 PolarHBondContact O-N 2.89Å; E135-Q137 PolarHBondContact O-N 3.2Å
136V38.7Very low35.9Very low132 Ų132142 Ų14280%0.877%0.77SS**  trans-74.8104.4177.1174.20000108.1M134M134-V136 PolarHBondContact O-N 3.3Å
137Q28.6Very low35.4Very low177 Ų177143.8 Ų143.883%0.82778%0.777SS**  trans-119.2133.2162.6-91.9-96.50.900109.2E135E135-Q137 PolarHBondContact O-N 3.2Å
138R27.8Very low34.6Very low199 Ų199142 Ų14275%0.75177%0.774SS**  trans-96.2145.7-156.3-176.4-174.8-77153.4-5.6109.6
139E22.8Very low33.6Very low167 Ų167142 Ų14278%0.7877%0.77SS**  trans69.9109.9163.7-71.7154.7-16300118.1
140S23.8Very low32.9Very low112 Ų112140.4 Ų140.478%0.78377%0.766SS**  116.4168.465.886.70000110.2
141P37.1Very low31.7Very low108 Ų108142.4 Ų142.470%0.70177%0.768SS**  -129.7163-102.237.8-20000116.6
142Q25.8Very low31.2Very low185 Ų185145.1 Ų145.186%0.86478%0.775SS**  trans166.3146.1149.4-97.2161.433.400109
143T23.5Very low30.3Very low121 Ų121149.3 Ų149.374%0.74278%0.78SS**  cis-176.7141.3-16.418.90000105.7
144L26.8Very low29.4Very low147 Ų147152.4 Ų152.477%0.7778%0.782SS**  trans78.1106.5141.8-139.474.2000122.9
145N24.8Very low28.7Very low135 Ų135149.1 Ų149.172%0.72277%0.773SS**  76.7139.5128.5-63.7-0.2000126.2
146S27.1Very low27.9Very low106 Ų106146 Ų14674%0.74177%0.765SS**  trans90.1100.6141.234.90000122.4
147T30.8Very low27.6Very low137 Ų137144.8 Ų144.884%0.8476%0.763SS**  28.2149.9127.745.40000124
148P30.8Very low27.9Very low121 Ų121145.7 Ų145.779%0.78676%0.764SS**  trans-94.8145.4-160.237.9-33.1000115
149V27.5Very low28.1Very low125 Ų125143 Ų14376%0.75877%0.765SS**  trans-105.6123.7168.6164.20000109.4
150V30.6Very low28.6Very low125 Ų125140.3 Ų140.376%0.75876%0.764SS**  trans-74.1115.7167.2172.10000107.5F152V150-F152 HydrophobicContact CG1-CD2 4.08Å; V150-F152 HydrophobicContact CG1-CE2 4.29Å
151E25.1Very low29.3Very low157 Ų157141 Ų14173%0.73476%0.763SS**  trans-118.3102.9173.5-163.9142.4-173.600109.7Y153E151-Y153 PolarHBondContact O-N 2.95Å
152F27.2Very low29.1Very low195 Ų195139.7 Ų139.786%0.85576%0.762SS**  trans-66118.2164.7-93.3-98.2000108.5V150V150-F152 HydrophobicContact CG1-CD2 4.08Å; V150-F152 HydrophobicContact CG1-CE2 4.29Å
153Y26.5Very low29.7Very low197 Ų197136.5 Ų136.577%0.77376%0.755SS**  trans-130.6112165.2-134.9-93.5000111E151 P155E151-Y153 PolarHBondContact O-N 2.95Å; Y153-P155 HydrophobicContact CD1-CG 4.11Å; Y153-P155 HydrophobicContact CE1-CG 4.24Å
154R28.9Very low30.4Very low223 Ų223135.7 Ų135.784%0.84275%0.75SS**  trans-110.3128.8163.9177.6-166.5-178.3102.3-0.4107
155P26.8Very low31Very low92 Ų92132.1 Ų132.160%0.59774%0.737SS**  trans-125.8115.1143.620-0.9000109.4Y153Y153-P155 HydrophobicContact CD1-CG 4.11Å; Y153-P155 HydrophobicContact CE1-CG 4.24Å
156T25.3Very low31.5Very low106 Ų106132.1 Ų132.165%0.6573%0.732SS**  56.310890.852.90000115.9
157S32.2Very low32Very low106 Ų106132 Ų13274%0.74172%0.723SS**  trans58.4112.8148.356.40000119.3
158F34.8Very low32.1Very low196 Ų196133.1 Ų133.186%0.8671%0.712SS**  61.5101.389.2-97.5-90.7000113.7
159D31.5Very low32.8Very low142 Ų142131 Ų13176%0.75970%0.697SS**  178.7148.8104.6-88.7-31.2000110.9
160S33.9Very low33.6Very low110 Ų110128.2 Ų128.277%0.76968%0.68SS**  trans95.269.2164.9-44.40000118.9
161V38Very low34.2Very low126 Ų126127 Ų12776%0.76466%0.662SS**  trans-149.176.2130.9179.30000107.3
162A34.1Very low35.4Very low82 Ų82123.6 Ų123.668%0.67865%0.649SS**  trans-124.357174.100000109.9
163T36.7Very low36.2Very low117 Ų117117.9 Ų117.972%0.71863%0.633SS**SBendtrans-140.33.2170.7260000113.9
164V39.8Very low37.3Very low105 Ų105112.1 Ų112.164%0.63662%0.618SS**SBendtrans-115.1-19.5173.3-178.60000112.3
165S39.3Very low38.7Very low71 Ų71104.2 Ų104.250%0.49760%0.597SS.*Hα-helixtrans-78.7-25.1-179.158.30000114.2N167 W168 T169S165-N167 PolarHBondContact O-N 3.35Å; S165-W168 PolarHBondContact O-N 2.9Å; S165-T169 PolarHBondContact O-N 3.23Å; S165-T169 PolarHBondContact O-OG1 3.46Å
166H34.1Very low40.1Very low135 Ų135103.9 Ų103.963%0.62559%0.59SS**Hα-helixtrans-72.3-20.1-177.9-150.7-81.2000112.8V170H166-V170 WeakPolarHBondContact O-CB 3.37Å; H166-V170 WeakPolarHBondContact O-CG2 3.45Å
167N38.8Very low41.7Very low103 Ų103104.4 Ų104.455%0.55159%0.588SS**Hα-helixtrans-85.1-33.7-175.9-3510.8000109.7S165 W171S165-N167 PolarHBondContact O-N 3.35Å; N167-W171 PolarHBondContact O-N 2.92Å
168W32.5Very low43.3Very low161 Ų161102.9 Ų102.961%0.6157%0.568SS**Hα-helixtrans-78.4-41.6-178.7-171.8-71.3000112S165 N172S165-W168 PolarHBondContact O-N 2.9Å; W168-N172 PolarHBondContact O-N 3.01Å
169T46.2Very low44.7Very low77 Ų7797.3 Ų97.347%0.47255%0.545SS..Hα-helixtrans-70.7-37.5178.853.30000112.4S165 N172 C173S165-T169 PolarHBondContact O-N 3.23Å; S165-T169 PolarHBondContact O-OG1 3.46Å; T169-N172 PolarHBondContact O-N 3.28Å; T169-C173 PolarHBondContact O-N 3.32Å
170V43Very low46.6Very low66 Ų6693.9 Ų93.940%0.453%0.529SS..Hα-helixtrans-68.5-34.5177.1174.30000111.9H166 T174H166-V170 WeakPolarHBondContact O-CB 3.37Å; H166-V170 WeakPolarHBondContact O-CG2 3.45Å; V170-T174 HydrophobicContact CG1-CG2 4.32Å; V170-T174 WeakPolarHBondContact O-CB 3.09Å; V170-T174 VanDerWaalsContact O-CG2 3.3Å; V170-T174 WeakPolarHBondContact O-CG2 3.46Å; V170-T174 PolarHBondContact O-N 2.83Å; V170-T174 PolarHBondContact O-OG1 3.06Å
171W42.9Very low48.5Very low100 Ų10091 Ų9138%0.37951%0.508SS..Hα-helixtrans-66.5-39.3173.6-10425000113.1Q31 N167 T174 S175 D241Q31-W171 VanDerWaalsContact NE2-CZ3 3.26Å; N167-W171 PolarHBondContact O-N 2.92Å; W171-T174 WeakPolarHBondContact CA-OG1 3.29Å; W171-T174 PolarHBondContact O-OG1 2.89Å; W171-T174 VanDerWaalsContact O-OG1 3.06Å; W171-S175 WeakPolarHBondContact O-CB 3.36Å; W171-S175 PolarHBondContact O-N 2.96Å; W171-D241 VanDerWaalsContact CH2-OD1 3.26Å; W171-D241 WeakPolarHBondContact CH2-OD1 3.17Å
172N52Low50.4Low86 Ų8688.7 Ų88.746%0.4649%0.491SS..Hα-helixtrans-70.5-40.2176.5-72.6-10.5000111.9W168 T169 S175 L176W168-N172 PolarHBondContact O-N 3.01Å; T169-N172 PolarHBondContact O-N 3.28Å; N172-S175 PolarHBondContact O-N 3.33Å; N172-L176 WeakPolarHBondContact O-CB 3.41Å; N172-L176 PolarHBondContact O-N 3.34Å
173C42.5Very low52.5Low75 Ų7593.3 Ų93.351%0.50749%0.491SS..Hα-helixtrans-65.1-42.7174.3-800000112.6T169 L176 L177T169-C173 PolarHBondContact O-N 3.32Å; C173-L176 PolarHBondContact O-N 3.36Å; C173-L177 VanDerWaalsContact O-CB 3.29Å; C173-L177 WeakPolarHBondContact O-CB 3.31Å; C173-L177 WeakPolarHBondContact O-CG 3.26Å; C173-L177 PolarHBondContact O-N 2.94Å
174T50.3Low54.7Low75 Ų7591.8 Ų91.846%0.4648%0.481SS..Hα-helixtrans-67.2-38.2178.346.90000111.7V170 W171 F178V170-T174 HydrophobicContact CG1-CG2 4.32Å; V170-T174 WeakPolarHBondContact O-CB 3.09Å; V170-T174 VanDerWaalsContact O-CG2 3.3Å; V170-T174 WeakPolarHBondContact O-CG2 3.46Å; V170-T174 PolarHBondContact O-N 2.83Å; V170-T174 PolarHBondContact O-OG1 3.06Å; W171-T174 WeakPolarHBondContact CA-OG1 3.29Å; W171-T174 PolarHBondContact O-OG1 2.89Å; W171-T174 VanDerWaalsContact O-OG1 3.06Å; T174-F178 WeakPolarHBondContact O-CB 3.4Å; T174-F178 PolarHBondContact O-N 3.37Å
175S57.5Low56.7Low58 Ų5890.1 Ų90.141%0.40647%0.469SS..Hα-helixtrans-66.7-37.2174-1730000112.8W171 N172 F178 Q179W171-S175 WeakPolarHBondContact O-CB 3.36Å; W171-S175 PolarHBondContact O-N 2.96Å; N172-S175 PolarHBondContact O-N 3.33Å; S175-F178 PolarHBondContact O-N 2.89Å; S175-Q179 WeakPolarHBondContact O-CB 2.87Å; S175-Q179 PolarHBondContact O-N 3.16Å
176L57.3Low58.9Low85 Ų8591.3 Ų91.345%0.44547%0.473SS..Hα-helixtrans-72.3-43.8177.6-165.676.1000111.8F54 N172 C173 F178 Q179 T180F54-L176 HydrophobicContact CE1-CD1 4.3Å; F54-L176 HydrophobicContact CZ-CD1 4.35Å; N172-L176 WeakPolarHBondContact O-CB 3.41Å; N172-L176 PolarHBondContact O-N 3.34Å; C173-L176 PolarHBondContact O-N 3.36Å; L176-F178 VanDerWaalsContact C-N 3.26Å; L176-F178 PolarHBondContact O-N 3.47Å; L176-Q179 PolarHBondContact O-N 3.32Å; L176-T180 WeakPolarHBondContact O-CB 3.44Å; L176-T180 VanDerWaalsContact O-CG2 3.26Å; L176-T180 WeakPolarHBondContact O-CG2 3.49Å; L176-T180 PolarHBondContact O-N 3.22Å; L176-T180 PolarHBondContact O-OG1 3.3Å
177L58.3Low61.4Low117 Ų11793.4 Ų93.461%0.61348%0.475SS*.Hα-helixtrans-63.1-34.5172.4-69.8175.8000111.5C173 T180 S181C173-L177 VanDerWaalsContact O-CB 3.29Å; C173-L177 WeakPolarHBondContact O-CB 3.31Å; C173-L177 WeakPolarHBondContact O-CG 3.26Å; C173-L177 PolarHBondContact O-N 2.94Å; L177-T180 VanDerWaalsContact C-OG1 3.31Å; L177-T180 VanDerWaalsContact CA-OG1 3.23Å; L177-T180 WeakPolarHBondContact CA-OG1 3.41Å; L177-T180 PolarHBondContact O-OG1 2.98Å; L177-S181 WeakPolarHBondContact O-CB 3.08Å; L177-S181 PolarHBondContact O-N 3.16Å; L177-S181 PolarHBondContact O-OG 3.18Å
178F65.1Low63.6Low74 Ų7493.4 Ų93.433%0.32548%0.475SS..Hα-helixtrans-70.6-47.2177-177.9-115.2000112T174 S175 L176 T180 S181 I182 Q233T174-F178 WeakPolarHBondContact O-CB 3.4Å; T174-F178 PolarHBondContact O-N 3.37Å; S175-F178 PolarHBondContact O-N 2.89Å; L176-F178 VanDerWaalsContact C-N 3.26Å; L176-F178 PolarHBondContact O-N 3.47Å; F178-T180 VanDerWaalsContact C-N 3.33Å; F178-T180 PolarHBondContact O-N 3.32Å; F178-S181 WeakPolarHBondContact CA-OG 3.36Å; F178-S181 PolarHBondContact O-N 3.3Å; F178-S181 VanDerWaalsContact O-N 3.14Å; F178-S181 PolarHBondContact O-OG 3.34Å; F178-I182 HydrophobicContact CD1-CD1 3.83Å; F178-I182 HydrophobicContact CD2-CD1 4.42Å; F178-I182 HydrophobicContact CE1-CD1 3.34Å; F178-I182 HydrophobicContact CE1-CG1 4.41Å; F178-I182 HydrophobicContact CE2-CD1 3.95Å; F178-I182 HydrophobicContact CE2-CG1 4.19Å; F178-I182 HydrophobicContact CG-CD1 4.35Å; F178-I182 HydrophobicContact CZ-CD1 3.41Å; F178-I182 VanDerWaalsContact CZ-CD1 3.41Å; F178-I182 HydrophobicContact CZ-CG1 4.1Å; F178-I182 WeakPolarHBondContact O-CG1 3.35Å; F178-I182 PolarHBondContact O-N 3.5Å; F178-Q233 VanDerWaalsContact CE2-CD 3.5Å
179Q64.9Low66.1Low79 Ų7987.5 Ų87.537%0.36946%0.455SS..Hα-helixtrans-66.4-36.1178.3-168.3164.9-22.200112.2F54 S175 L176 R183F54-Q179 HydrophobicContact CE1-CG 4.36Å; F54-Q179 VanDerWaalsContact CE1-NE2 3.3Å; F54-Q179 HydrophobicContact CZ-CG 4.19Å; S175-Q179 WeakPolarHBondContact O-CB 2.87Å; S175-Q179 PolarHBondContact O-N 3.16Å; L176-Q179 PolarHBondContact O-N 3.32Å; Q179-R183 WeakPolarHBondContact O-CB 3.37Å; Q179-R183 PolarHBondContact O-N 3.32Å; Q179-R183 VanDerWaalsContact O-N 3.15Å
180T71.4Confident67.9Low69 Ų6985.7 Ų85.742%0.42345%0.452SS..Hα-helixtrans-68.2-39.6170.452.30000111.6L176 L177 F178 I182 R183 V184L176-T180 WeakPolarHBondContact O-CB 3.44Å; L176-T180 VanDerWaalsContact O-CG2 3.26Å; L176-T180 WeakPolarHBondContact O-CG2 3.49Å; L176-T180 PolarHBondContact O-N 3.22Å; L176-T180 PolarHBondContact O-OG1 3.3Å; L177-T180 VanDerWaalsContact C-OG1 3.31Å; L177-T180 VanDerWaalsContact CA-OG1 3.23Å; L177-T180 WeakPolarHBondContact CA-OG1 3.41Å; L177-T180 PolarHBondContact O-OG1 2.98Å; F178-T180 VanDerWaalsContact C-N 3.33Å; F178-T180 PolarHBondContact O-N 3.32Å; T180-I182 PolarHBondContact O-N 3.32Å; T180-R183 PolarHBondContact O-N 3.41Å; T180-V184 WeakPolarHBondContact O-CB 3.36Å; T180-V184 VanDerWaalsContact O-CG2 3.27Å; T180-V184 WeakPolarHBondContact O-CG2 3.27Å; T180-V184 PolarHBondContact O-N 2.98Å
181S74.9Confident69.9Low49 Ų4987.3 Ų87.334%0.34346%0.458SS..Hα-helixtrans-62.9-40.917776.20000112.7L177 F178 V184 L185L177-S181 WeakPolarHBondContact O-CB 3.08Å; L177-S181 PolarHBondContact O-N 3.16Å; L177-S181 PolarHBondContact O-OG 3.18Å; F178-S181 WeakPolarHBondContact CA-OG 3.36Å; F178-S181 PolarHBondContact O-N 3.3Å; F178-S181 VanDerWaalsContact O-N 3.14Å; F178-S181 PolarHBondContact O-OG 3.34Å; S181-V184 PolarHBondContact O-N 2.87Å; S181-L185 VanDerWaalsContact O-CB 3.28Å; S181-L185 WeakPolarHBondContact O-CB 3.34Å; S181-L185 PolarHBondContact O-N 3.38Å
182I76.2Confident71.9Confident79 Ų7986.3 Ų86.341%0.40546%0.459SS..Hα-helixtrans-63.4-45.6174.7-69.4163.2000109.8F178 T180 V184 L185 V186F178-I182 HydrophobicContact CD1-CD1 3.83Å; F178-I182 HydrophobicContact CD2-CD1 4.42Å; F178-I182 HydrophobicContact CE1-CD1 3.34Å; F178-I182 HydrophobicContact CE1-CG1 4.41Å; F178-I182 HydrophobicContact CE2-CD1 3.95Å; F178-I182 HydrophobicContact CE2-CG1 4.19Å; F178-I182 HydrophobicContact CG-CD1 4.35Å; F178-I182 HydrophobicContact CZ-CD1 3.41Å; F178-I182 VanDerWaalsContact CZ-CD1 3.41Å; F178-I182 HydrophobicContact CZ-CG1 4.1Å; F178-I182 WeakPolarHBondContact O-CG1 3.35Å; F178-I182 PolarHBondContact O-N 3.5Å; T180-I182 PolarHBondContact O-N 3.32Å; I182-V184 PolarHBondContact O-N 3.4Å; I182-L185 PolarHBondContact O-N 2.85Å; I182-V186 HydrophobicContact CG2-CG2 4.4Å; I182-V186 VanDerWaalsContact O-CG2 3.27Å; I182-V186 WeakPolarHBondContact O-CG2 3.3Å; I182-V186 PolarHBondContact O-N 2.94Å
183R79Confident73.4Confident179 Ų17988.3 Ų88.368%0.67546%0.461SS*.Hα-helixtrans-62.5-43.9-179.9-157.6173.7-174.3-1760.3111.1Q179 T180 V186 W187Q179-R183 WeakPolarHBondContact O-CB 3.37Å; Q179-R183 PolarHBondContact O-N 3.32Å; Q179-R183 VanDerWaalsContact O-N 3.15Å; T180-R183 PolarHBondContact O-N 3.41Å; R183-V186 PolarHBondContact O-N 2.72Å; R183-W187 VanDerWaalsContact O-CD1 3.24Å; R183-W187 PolarHBondContact O-N 3.33Å
184V82.4Confident75.5Confident84 Ų8492.3 Ų92.351%0.50947%0.47SS..Hα-helixtrans-64.7-42.2175.1171.50000111.4T180 S181 I182 V186 W187 L188T180-V184 WeakPolarHBondContact O-CB 3.36Å; T180-V184 VanDerWaalsContact O-CG2 3.27Å; T180-V184 WeakPolarHBondContact O-CG2 3.27Å; T180-V184 PolarHBondContact O-N 2.98Å; S181-V184 PolarHBondContact O-N 2.87Å; I182-V184 PolarHBondContact O-N 3.4Å; V184-V186 VanDerWaalsContact C-N 3.35Å; V184-V186 PolarHBondContact O-N 3.06Å; V184-W187 WeakPolarHBondContact O-CB 3.29Å; V184-W187 PolarHBondContact O-N 3.48Å; V184-L188 HydrophobicContact CG1-CD1 4.17Å; V184-L188 HydrophobicContact CG1-CG 4.38Å; V184-L188 WeakPolarHBondContact O-CG 3.32Å; V184-L188 PolarHBondContact O-N 3.27Å
185L82.8Confident77.1Confident71 Ų7192.2 Ų92.237%0.37247%0.473SS..Hα-helixtrans-59.9-43.7174.9-99.2158.4000111.7S181 I182 W187 L188 L189 L226S181-L185 VanDerWaalsContact O-CB 3.28Å; S181-L185 WeakPolarHBondContact O-CB 3.34Å; S181-L185 PolarHBondContact O-N 3.38Å; I182-L185 PolarHBondContact O-N 2.85Å; L185-W187 VanDerWaalsContact C-N 3.34Å; L185-W187 PolarHBondContact O-N 3.46Å; L185-L188 PolarHBondContact O-N 2.97Å; L185-L189 VanDerWaalsContact O-CB 3.3Å; L185-L189 WeakPolarHBondContact O-CB 3.38Å; L185-L189 PolarHBondContact O-N 3Å; L185-L226 HydrophobicContact CD1-CD2 4.33Å; L185-L226 HydrophobicContact CD2-CD2 4.06Å
186V84.3Confident78.4Confident96 Ų9689.9 Ų89.958%0.58246%0.456SS*.Hα-helixtrans-62.1-42.3176.1171.20000111I182 R183 V184 L189 G190I182-V186 HydrophobicContact CG2-CG2 4.4Å; I182-V186 VanDerWaalsContact O-CG2 3.27Å; I182-V186 WeakPolarHBondContact O-CG2 3.3Å; I182-V186 PolarHBondContact O-N 2.94Å; R183-V186 PolarHBondContact O-N 2.72Å; V184-V186 VanDerWaalsContact C-N 3.35Å; V184-V186 PolarHBondContact O-N 3.06Å; V186-L189 PolarHBondContact O-N 3.31Å; V186-G190 PolarHBondContact O-N 3.37Å
187W87Confident79.7Confident179 Ų17988.1 Ų88.168%0.67845%0.447SS*.Hα-helixtrans-62.8-46.7174.3-88.8100.2000112.5R183 V184 L185 L189 G190 L191R183-W187 VanDerWaalsContact O-CD1 3.24Å; R183-W187 PolarHBondContact O-N 3.33Å; V184-W187 WeakPolarHBondContact O-CB 3.29Å; V184-W187 PolarHBondContact O-N 3.48Å; L185-W187 VanDerWaalsContact C-N 3.34Å; L185-W187 PolarHBondContact O-N 3.46Å; W187-L189 VanDerWaalsContact C-N 3.34Å; W187-L189 PolarHBondContact O-N 3.49Å; W187-G190 PolarHBondContact O-N 3.49Å; W187-L191 WeakPolarHBondContact O-CG 3.15Å; W187-L191 PolarHBondContact O-N 2.94Å
188L85.4Confident81Confident103 Ų10386 Ų8654%0.53944%0.441SS..Hα-helixtrans-63.4-40177-74.7179000111.9V184 L185 G190 L191 L192V184-L188 HydrophobicContact CG1-CD1 4.17Å; V184-L188 HydrophobicContact CG1-CG 4.38Å; V184-L188 WeakPolarHBondContact O-CG 3.32Å; V184-L188 PolarHBondContact O-N 3.27Å; L185-L188 PolarHBondContact O-N 2.97Å; L188-G190 VanDerWaalsContact C-N 3.34Å; L188-L191 PolarHBondContact O-N 3Å; L188-L192 VanDerWaalsContact O-CB 3.24Å; L188-L192 WeakPolarHBondContact O-CB 3.29Å; L188-L192 PolarHBondContact O-N 3.15Å
189L84.6Confident82Confident37 Ų3786.4 Ų86.419%0.19445%0.445CS..Hα-helixtrans-65.2-40.2176.1-145.185.5000111.1L185 V186 W187 L192 Y193 L223 L226L185-L189 VanDerWaalsContact O-CB 3.3Å; L185-L189 WeakPolarHBondContact O-CB 3.38Å; L185-L189 PolarHBondContact O-N 3Å; V186-L189 PolarHBondContact O-N 3.31Å; W187-L189 VanDerWaalsContact C-N 3.34Å; W187-L189 PolarHBondContact O-N 3.49Å; L189-L192 PolarHBondContact O-N 3.36Å; L189-Y193 WeakPolarHBondContact O-CB 3.45Å; L189-Y193 PolarHBondContact O-N 2.99Å; L189-L223 HydrophobicContact CD2-CD2 3.26Å; L189-L223 HydrophobicContact CD2-CG 3.87Å; L189-L226 HydrophobicContact CD1-CD1 3.69Å; L189-L226 HydrophobicContact CD2-CD1 3.87Å; L189-L226 HydrophobicContact CG-CD1 4.33Å
190G85.1Confident83Confident39 Ų3982.6 Ų82.640%0.40243%0.428SS..Hα-helixtrans-63.3-42.9174.900000112.7V186 W187 L188 Y193 F194V186-G190 PolarHBondContact O-N 3.37Å; W187-G190 PolarHBondContact O-N 3.49Å; L188-G190 VanDerWaalsContact C-N 3.34Å; G190-Y193 WeakPolarHBondContact O-CB 3.44Å; G190-Y193 PolarHBondContact O-N 3.45Å; G190-F194 WeakPolarHBondContact O-CB 3.41Å; G190-F194 PolarHBondContact O-N 2.92Å
191L84.5Confident83.8Confident100 Ų10084 Ų8452%0.52443%0.432SS..Hα-helixtrans-66.4-42.6174.9-71171.8000112.1W187 L188 Y193 F194 S195W187-L191 WeakPolarHBondContact O-CG 3.15Å; W187-L191 PolarHBondContact O-N 2.94Å; L188-L191 PolarHBondContact O-N 3Å; L191-Y193 VanDerWaalsContact C-N 3.33Å; L191-F194 PolarHBondContact O-N 3.44Å; L191-S195 WeakPolarHBondContact O-CB 3.04Å; L191-S195 PolarHBondContact O-N 2.88Å; L191-S195 PolarHBondContact O-OG 3.48Å
192L84.5Confident84.5Confident79 Ų7989 Ų8941%0.41444%0.444SS..Hα-helixtrans-65.3-38.7176.1-167.1150000110.7L188 L189 S195 S196L188-L192 VanDerWaalsContact O-CB 3.24Å; L188-L192 WeakPolarHBondContact O-CB 3.29Å; L188-L192 PolarHBondContact O-N 3.15Å; L189-L192 PolarHBondContact O-N 3.36Å; L192-S195 PolarHBondContact O-N 2.94Å; L192-S196 WeakPolarHBondContact CD2-OG 3.27Å; L192-S196 WeakPolarHBondContact O-CA 3.23Å; L192-S196 WeakPolarHBondContact O-CB 3.19Å; L192-S196 PolarHBondContact O-N 3.45Å; L192-S196 PolarHBondContact O-OG 3.03Å
193Y84.5Confident85Confident128 Ų12886.1 Ų86.150%0.50243%0.429SS..Hα-helixtrans-61.2-49.8173.6175.9-99.8000111.6L189 G190 L191 S195 S196 L197 V219L189-Y193 WeakPolarHBondContact O-CB 3.45Å; L189-Y193 PolarHBondContact O-N 2.99Å; G190-Y193 WeakPolarHBondContact O-CB 3.44Å; G190-Y193 PolarHBondContact O-N 3.45Å; L191-Y193 VanDerWaalsContact C-N 3.33Å; Y193-S195 PolarHBondContact O-N 3.28Å; Y193-S196 PolarHBondContact O-N 3.4Å; Y193-L197 HydrophobicContact CD1-CD1 4.16Å; Y193-L197 HydrophobicContact CD2-CD1 3.84Å; Y193-L197 HydrophobicContact CD2-CG 4.28Å; Y193-L197 HydrophobicContact CE1-CD1 3.63Å; Y193-L197 HydrophobicContact CE2-CD1 3.28Å; Y193-L197 HydrophobicContact CE2-CG 4.07Å; Y193-L197 HydrophobicContact CG-CD1 4.25Å; Y193-L197 PolarHBondContact O-N 3.08Å; Y193-L197 VanDerWaalsContact O-N 3.16Å; Y193-L197 WeakPolarHBondContact OH-CD1 3.26Å; Y193-V219 HydrophobicContact CD2-CG1 3.65Å; Y193-V219 HydrophobicContact CD2-CG2 4.4Å; Y193-V219 HydrophobicContact CE2-CG1 4Å
194F85.3Confident85.4Confident158 Ų15881 Ų8169%0.69342%0.415SS*.Hα-helixtrans-63.1-30.3179.1-169.6-98.6000112.4G190 L191 P198G190-F194 WeakPolarHBondContact O-CB 3.41Å; G190-F194 PolarHBondContact O-N 2.92Å; L191-F194 PolarHBondContact O-N 3.44Å; F194-P198 WeakPolarHBondContact O-CD 3.44Å; F194-P198 WeakPolarHBondContact O-CG 3.4Å
195S83.2Confident85.7Confident74 Ų7482.5 Ų82.552%0.51742%0.424SS..Hα-helixtrans-87.9-34.4179.6-52.60000113.3L191 L192 Y193 L199L191-S195 WeakPolarHBondContact O-CB 3.04Å; L191-S195 PolarHBondContact O-N 2.88Å; L191-S195 PolarHBondContact O-OG 3.48Å; L192-S195 PolarHBondContact O-N 2.94Å; Y193-S195 PolarHBondContact O-N 3.28Å; S195-L199 VanDerWaalsContact O-CB 3.3Å; S195-L199 WeakPolarHBondContact O-CB 3.29Å; S195-L199 PolarHBondContact O-N 2.94Å
196S85.4Confident86Confident9 Ų981.3 Ų81.36%0.06342%0.422CS..Hα-helixtrans-83.1-31-173-59.40000113.2L192 Y193 G200L192-S196 WeakPolarHBondContact CD2-OG 3.27Å; L192-S196 WeakPolarHBondContact O-CA 3.23Å; L192-S196 WeakPolarHBondContact O-CB 3.19Å; L192-S196 PolarHBondContact O-N 3.45Å; L192-S196 PolarHBondContact O-OG 3.03Å; Y193-S196 PolarHBondContact O-N 3.4Å; S196-G200 WeakPolarHBondContact O-CA 3.21Å; S196-G200 PolarHBondContact O-N 2.98Å
197L83.9Confident86.1Confident48 Ų4886 Ų8625%0.25143%0.434SS..Hα-helixtrans-66.9-50.3177-78.8176.7000112.9Y193 L199 G200 I201Y193-L197 HydrophobicContact CD1-CD1 4.16Å; Y193-L197 HydrophobicContact CD2-CD1 3.84Å; Y193-L197 HydrophobicContact CD2-CG 4.28Å; Y193-L197 HydrophobicContact CE1-CD1 3.63Å; Y193-L197 HydrophobicContact CE2-CD1 3.28Å; Y193-L197 HydrophobicContact CE2-CG 4.07Å; Y193-L197 HydrophobicContact CG-CD1 4.25Å; Y193-L197 PolarHBondContact O-N 3.08Å; Y193-L197 VanDerWaalsContact O-N 3.16Å; Y193-L197 WeakPolarHBondContact OH-CD1 3.26Å; L197-L199 VanDerWaalsContact C-N 3.3Å; L197-L199 PolarHBondContact O-N 3.34Å; L197-G200 PolarHBondContact O-N 2.93Å; L197-I201 WeakPolarHBondContact O-CB 3.37Å; L197-I201 WeakPolarHBondContact O-CD1 3.28Å; L197-I201 WeakPolarHBondContact O-CG1 3.32Å; L197-I201 PolarHBondContact O-N 3.46Å
198P87.7Confident86Confident73 Ų7383.4 Ų83.447%0.47443%0.428SS..Hα-helixtrans-62.9-39.5176.9-19.431.8000111.7F194 Y202F194-P198 WeakPolarHBondContact O-CD 3.44Å; F194-P198 WeakPolarHBondContact O-CG 3.4Å; P198-Y202 WeakPolarHBondContact O-CB 3.28Å; P198-Y202 PolarHBondContact O-N 3.14Å
199L84.9Confident86.1Confident81 Ų8182.3 Ų82.342%0.42443%0.425SS..Hα-helixtrans-68.7-41.5179-168.865.3000111.8S195 L197 Y202 L203 F215S195-L199 VanDerWaalsContact O-CB 3.3Å; S195-L199 WeakPolarHBondContact O-CB 3.29Å; S195-L199 PolarHBondContact O-N 2.94Å; L197-L199 VanDerWaalsContact C-N 3.3Å; L197-L199 PolarHBondContact O-N 3.34Å; L199-Y202 PolarHBondContact O-N 2.82Å; L199-L203 HydrophobicContact CG-CD1 4.13Å; L199-L203 WeakPolarHBondContact O-CB 3.3Å; L199-L203 WeakPolarHBondContact O-CD1 3.5Å; L199-L203 WeakPolarHBondContact O-CG 3.45Å; L199-L203 PolarHBondContact O-N 3.44Å; L199-F215 HydrophobicContact CD2-CE1 4.32Å; L199-F215 HydrophobicContact CD2-CZ 4.21Å
200G86.1Confident86.2Confident0 Ų086.1 Ų86.10%045%0.45CS..Hα-helixtrans-62.2-46.4175.500000112S196 L197 L203 L204S196-G200 WeakPolarHBondContact O-CA 3.21Å; S196-G200 PolarHBondContact O-N 2.98Å; L197-G200 PolarHBondContact O-N 2.93Å; G200-L203 PolarHBondContact O-N 3.06Å; G200-L204 WeakPolarHBondContact O-CG 3.44Å; G200-L204 PolarHBondContact O-N 2.91Å
201I87.6Confident86.3Confident99 Ų9988 Ų8851%0.50845%0.451SS..Hα-helixtrans-63.4-44175.5-64.1163.2000110.7L197 L203 L204 V205L197-I201 WeakPolarHBondContact O-CB 3.37Å; L197-I201 WeakPolarHBondContact O-CD1 3.28Å; L197-I201 WeakPolarHBondContact O-CG1 3.32Å; L197-I201 PolarHBondContact O-N 3.46Å; I201-L203 VanDerWaalsContact C-N 3.31Å; I201-L203 PolarHBondContact O-N 2.68Å; I201-L204 WeakPolarHBondContact O-CB 3.27Å; I201-L204 PolarHBondContact O-N 3.43Å; I201-V205 WeakPolarHBondContact O-CG2 3.4Å; I201-V205 PolarHBondContact O-N 3.37Å
202Y89.7Confident86.3Confident152 Ų15283.3 Ų83.360%0.59643%0.426SS*.Hα-helixtrans-60.4-39.5176.7177.6-96.8000112.6P198 L199 V205 S206P198-Y202 WeakPolarHBondContact O-CB 3.28Å; P198-Y202 PolarHBondContact O-N 3.14Å; L199-Y202 PolarHBondContact O-N 2.82Å; Y202-V205 PolarHBondContact O-N 2.93Å; Y202-S206 WeakPolarHBondContact O-CB 3.15Å; Y202-S206 PolarHBondContact O-N 2.87Å; Y202-S206 PolarHBondContact O-OG 3.45Å
203L87.8Confident86.4Confident19 Ų1983.3 Ų83.310%0.09943%0.429CS..Hα-helixtrans-71.9-34.2177.7-71.9168.6000112.8L199 G200 I201 V205 S206 K208 L211 F215L199-L203 HydrophobicContact CG-CD1 4.13Å; L199-L203 WeakPolarHBondContact O-CB 3.3Å; L199-L203 WeakPolarHBondContact O-CD1 3.5Å; L199-L203 WeakPolarHBondContact O-CG 3.45Å; L199-L203 PolarHBondContact O-N 3.44Å; G200-L203 PolarHBondContact O-N 3.06Å; I201-L203 VanDerWaalsContact C-N 3.31Å; I201-L203 PolarHBondContact O-N 2.68Å; L203-V205 VanDerWaalsContact C-N 3.32Å; L203-S206 PolarHBondContact O-N 2.85Å; L203-K208 HydrophobicContact CD2-CB 4.31Å; L203-K208 HydrophobicContact CD2-CD 4.24Å; L203-K208 CarbonylContact O-C 3.54Å; L203-K208 PolarHBondContact O-N 3.15Å; L203-L211 HydrophobicContact CD1-CB 4.37Å; L203-L211 HydrophobicContact CD1-CD2 3.63Å; L203-L211 HydrophobicContact CD1-CG 3.81Å; L203-L211 HydrophobicContact CD2-CD2 4.11Å; L203-L211 HydrophobicContact CG-CD2 4.48Å; L203-F215 HydrophobicContact CD1-CD2 3.97Å; L203-F215 HydrophobicContact CD1-CE2 4.18Å
204L86.3Confident86.6Confident72 Ų7280.9 Ų80.938%0.37743%0.428SS..Hα-helixtrans-61-42170.5-73.7167.6000111.1G200 I201 V209 V213 V216G200-L204 WeakPolarHBondContact O-CG 3.44Å; G200-L204 PolarHBondContact O-N 2.91Å; I201-L204 WeakPolarHBondContact O-CB 3.27Å; I201-L204 PolarHBondContact O-N 3.43Å; L204-V209 HydrophobicContact CD2-CG1 4Å; L204-V213 HydrophobicContact CD2-CG2 4.26Å; L204-V216 HydrophobicContact CD1-CG2 4.46Å
205V89.9Confident86.6Confident116 Ų11676 Ų7670%0.70341%0.406SS*.Hα-helixtrans-67.8-37.1175.1174.50000111.6I201 Y202 L203 K207I201-V205 WeakPolarHBondContact O-CG2 3.4Å; I201-V205 PolarHBondContact O-N 3.37Å; Y202-V205 PolarHBondContact O-N 2.93Å; L203-V205 VanDerWaalsContact C-N 3.32Å; V205-K207 PolarHBondContact O-N 3.22Å
206S87.6Confident86.7Confident45 Ų4575.3 Ų75.332%0.31540%0.399SS..THydrogen-bonded Turntrans-78.518.9-178.2-57.30000114.5Y202 L203 K208Y202-S206 WeakPolarHBondContact O-CB 3.15Å; Y202-S206 PolarHBondContact O-N 2.87Å; Y202-S206 PolarHBondContact O-OG 3.45Å; L203-S206 PolarHBondContact O-N 2.85Å; S206-K208 PolarHBondContact O-N 2.88Å; S206-K208 VanDerWaalsContact O-N 3.09Å
207K86.6Confident86.7Confident194 Ų19477.3 Ų77.384%0.84341%0.413SS*.THydrogen-bonded Turntrans57.315.7-176.9-61-169.2175.4-179.30115.4V205 V209V205-K207 PolarHBondContact O-N 3.22Å; K207-V209 VanDerWaalsContact C-N 3.34Å; K207-V209 PolarHBondContact O-N 3.26Å
208K86.1Confident86.7Confident126 Ų12678.9 Ų78.955%0.54842%0.421SS..  trans-96.661172.5-68.6-165.7178.482.90110.2L203 S206 T210 L211 G212L203-K208 HydrophobicContact CD2-CB 4.31Å; L203-K208 HydrophobicContact CD2-CD 4.24Å; L203-K208 CarbonylContact O-C 3.54Å; L203-K208 PolarHBondContact O-N 3.15Å; S206-K208 PolarHBondContact O-N 2.88Å; S206-K208 VanDerWaalsContact O-N 3.09Å; K208-T210 PolarHBondContact O-N 2.79Å; K208-L211 PolarHBondContact O-N 3.47Å; K208-G212 PolarHBondContact O-N 3.37Å; K208-G212 VanDerWaalsContact O-N 3.11Å
209V86.6Confident86.3Confident80 Ų8076.2 Ų76.249%0.48540%0.403SS..Hα-helixtrans-59.6-42.5-168.4-1730000112.3L204 K207 L211 G212 V213L204-V209 HydrophobicContact CD2-CG1 4Å; K207-V209 VanDerWaalsContact C-N 3.34Å; K207-V209 PolarHBondContact O-N 3.26Å; V209-L211 PolarHBondContact O-N 3.46Å; V209-G212 PolarHBondContact O-N 2.93Å; V209-V213 HydrophobicContact CG1-CG2 4.19Å; V209-V213 VanDerWaalsContact O-CG2 3.31Å; V209-V213 WeakPolarHBondContact O-CG2 3.45Å; V209-V213 PolarHBondContact O-N 2.78Å
210T87.7Confident86.1Confident117 Ų11775.6 Ų75.672%0.71840%0.404SS*.Hα-helixtrans-59.4-44.9-179.9-45.80000112.4K208 V214K208-T210 PolarHBondContact O-N 2.79Å; T210-V214 VanDerWaalsContact O-CG2 3.28Å; T210-V214 WeakPolarHBondContact O-CG2 3.48Å; T210-V214 PolarHBondContact O-N 3.3Å; T210-V214 VanDerWaalsContact O-N 3.11Å
211L85.5Confident86.1Confident79 Ų7978.6 Ų78.641%0.41443%0.425SS..Hα-helixtrans-70.2-40180-168.566.8000110.9L203 K208 V209 V214 F215L203-L211 HydrophobicContact CD1-CB 4.37Å; L203-L211 HydrophobicContact CD1-CD2 3.63Å; L203-L211 HydrophobicContact CD1-CG 3.81Å; L203-L211 HydrophobicContact CD2-CD2 4.11Å; L203-L211 HydrophobicContact CG-CD2 4.48Å; K208-L211 PolarHBondContact O-N 3.47Å; V209-L211 PolarHBondContact O-N 3.46Å; L211-V214 PolarHBondContact O-N 3.43Å; L211-F215 HydrophobicContact CD1-CD2 4.29Å; L211-F215 HydrophobicContact CD1-CE2 3.91Å; L211-F215 HydrophobicContact CD2-CE2 4.39Å; L211-F215 HydrophobicContact CG-CD2 4.03Å; L211-F215 HydrophobicContact CG-CE2 3.88Å; L211-F215 VanDerWaalsContact O-CD2 3.32Å; L211-F215 WeakPolarHBondContact O-CD2 3.39Å; L211-F215 PolarHBondContact O-N 3.25Å
212G85.8Confident85.9Confident0 Ų075.1 Ų75.10%041%0.41CS..Hα-helixtrans-59.8-45.7174.900000112.8K208 V209 V214 F215 V216K208-G212 PolarHBondContact O-N 3.37Å; K208-G212 VanDerWaalsContact O-N 3.11Å; V209-G212 PolarHBondContact O-N 2.93Å; G212-V214 VanDerWaalsContact C-N 3.33Å; G212-V214 PolarHBondContact O-N 3.18Å; G212-F215 PolarHBondContact O-N 3.32Å; G212-V216 VanDerWaalsContact O-CG2 3.3Å; G212-V216 WeakPolarHBondContact O-CG2 3.33Å; G212-V216 PolarHBondContact O-N 2.88Å
213V87.3Confident85.6Confident79 Ų7972.1 Ų72.148%0.47940%0.404SS..Hα-helixtrans-63.1-38.9176.6172.50000111.6L204 V209 V216 S217L204-V213 HydrophobicContact CD2-CG2 4.26Å; V209-V213 HydrophobicContact CG1-CG2 4.19Å; V209-V213 VanDerWaalsContact O-CG2 3.31Å; V209-V213 WeakPolarHBondContact O-CG2 3.45Å; V209-V213 PolarHBondContact O-N 2.78Å; V213-V216 PolarHBondContact O-N 3.31Å; V213-S217 WeakPolarHBondContact O-CB 3.28Å; V213-S217 PolarHBondContact O-N 2.82Å; V213-S217 PolarHBondContact O-OG 2.78Å
214V88.6Confident85.5Confident78 Ų7875.6 Ų75.647%0.47343%0.425SS..Hα-helixtrans-62.5-47.2175.4170.20000111.2T210 L211 G212 V216 S217 L218T210-V214 VanDerWaalsContact O-CG2 3.28Å; T210-V214 WeakPolarHBondContact O-CG2 3.48Å; T210-V214 PolarHBondContact O-N 3.3Å; T210-V214 VanDerWaalsContact O-N 3.11Å; L211-V214 PolarHBondContact O-N 3.43Å; G212-V214 VanDerWaalsContact C-N 3.33Å; G212-V214 PolarHBondContact O-N 3.18Å; V214-V216 VanDerWaalsContact C-N 3.33Å; V214-V216 PolarHBondContact O-N 2.79Å; V214-S217 WeakPolarHBondContact CA-OG 3.3Å; V214-S217 PolarHBondContact O-N 3.44Å; V214-S217 PolarHBondContact O-OG 3.44Å; V214-L218 VanDerWaalsContact O-CB 3.28Å; V214-L218 WeakPolarHBondContact O-CB 3.34Å; V214-L218 PolarHBondContact O-N 3.45Å
215F85.3Confident85.5Confident54 Ų5477.7 Ų77.724%0.23744%0.436CS..Hα-helixtrans-63.9-36.7178-86.6-78000113.2L199 L203 L211 G212L199-F215 HydrophobicContact CD2-CE1 4.32Å; L199-F215 HydrophobicContact CD2-CZ 4.21Å; L203-F215 HydrophobicContact CD1-CD2 3.97Å; L203-F215 HydrophobicContact CD1-CE2 4.18Å; L211-F215 HydrophobicContact CD1-CD2 4.29Å; L211-F215 HydrophobicContact CD1-CE2 3.91Å; L211-F215 HydrophobicContact CD2-CE2 4.39Å; L211-F215 HydrophobicContact CG-CD2 4.03Å; L211-F215 HydrophobicContact CG-CE2 3.88Å; L211-F215 VanDerWaalsContact O-CD2 3.32Å; L211-F215 WeakPolarHBondContact O-CD2 3.39Å; L211-F215 PolarHBondContact O-N 3.25Å; G212-F215 PolarHBondContact O-N 3.32Å
216V85.3Confident85.1Confident60 Ų6074.8 Ų74.836%0.36442%0.416SS..Hα-helixtrans-71.2-36.1177.6173.70000111.8L204 G212 V213 V214 P220L204-V216 HydrophobicContact CD1-CG2 4.46Å; G212-V216 VanDerWaalsContact O-CG2 3.3Å; G212-V216 WeakPolarHBondContact O-CG2 3.33Å; G212-V216 PolarHBondContact O-N 2.88Å; V213-V216 PolarHBondContact O-N 3.31Å; V214-V216 VanDerWaalsContact C-N 3.33Å; V214-V216 PolarHBondContact O-N 2.79Å; V216-P220 WeakPolarHBondContact O-CD 3.5Å
217S84.8Confident84.9Confident52 Ų5279.5 Ų79.536%0.36444%0.435SS..Hα-helixtrans-85.6-20.6-179.557.30000114.6V213 V214 V219 P220 S221V213-S217 WeakPolarHBondContact O-CB 3.28Å; V213-S217 PolarHBondContact O-N 2.82Å; V213-S217 PolarHBondContact O-OG 2.78Å; V214-S217 WeakPolarHBondContact CA-OG 3.3Å; V214-S217 PolarHBondContact O-N 3.44Å; V214-S217 PolarHBondContact O-OG 3.44Å; S217-V219 PolarHBondContact O-N 2.8Å; S217-P220 VanDerWaalsContact O-CD 3.29Å; S217-P220 WeakPolarHBondContact O-CD 3.24Å; S217-P220 WeakPolarHBondContact O-CG 3.09Å; S217-S221 WeakPolarHBondContact O-CB 3.39Å; S217-S221 PolarHBondContact O-N 2.84Å; S217-S221 PolarHBondContact O-OG 2.84Å
218L83.3Confident84.9Confident81 Ų8174.1 Ų74.142%0.42442%0.418SS..Hα-helixtrans-60.5-34.4173.5-173.267000111.5V214 S222V214-L218 VanDerWaalsContact O-CB 3.28Å; V214-L218 WeakPolarHBondContact O-CB 3.34Å; V214-L218 PolarHBondContact O-N 3.45Å; L218-S222 VanDerWaalsContact O-CB 3.32Å; L218-S222 WeakPolarHBondContact O-CB 3.2Å; L218-S222 PolarHBondContact O-N 3.06Å; L218-S222 PolarHBondContact O-OG 3.26Å
219V79.3Confident84.7Confident16 Ų1674.3 Ų74.310%0.09742%0.416CS..Hα-helixtrans-60.9-62.2-179.9174.40000112.5Y193 S217 S221 S222 L223Y193-V219 HydrophobicContact CD2-CG1 3.65Å; Y193-V219 HydrophobicContact CD2-CG2 4.4Å; Y193-V219 HydrophobicContact CE2-CG1 4Å; S217-V219 PolarHBondContact O-N 2.8Å; V219-S221 VanDerWaalsContact C-N 3.25Å; V219-S221 PolarHBondContact O-N 3.47Å; V219-S222 PolarHBondContact O-N 3.48Å; V219-S222 PolarHBondContact O-OG 2.9Å; V219-L223 HydrophobicContact CG1-CD1 4.46Å; V219-L223 PolarHBondContact O-N 3.49Å
220P81.9Confident84.5Confident69 Ų6971.7 Ų71.745%0.44841%0.406SS..Hα-helixtrans-62.4-33.517923-32.9000112.2V216 S217 L223 V224V216-P220 WeakPolarHBondContact O-CD 3.5Å; S217-P220 VanDerWaalsContact O-CD 3.29Å; S217-P220 WeakPolarHBondContact O-CD 3.24Å; S217-P220 WeakPolarHBondContact O-CG 3.09Å; P220-L223 PolarHBondContact O-N 3.32Å; P220-V224 VanDerWaalsContact O-CG2 3.29Å; P220-V224 WeakPolarHBondContact O-CG2 3.11Å; P220-V224 PolarHBondContact O-N 2.72Å
221S84.8Confident84.2Confident62 Ų6273 Ų7343%0.43440%0.402SS..Hα-helixtrans-64.9-44.3177.1-54.60000112S217 V219 L223 V224 I225S217-S221 WeakPolarHBondContact O-CB 3.39Å; S217-S221 PolarHBondContact O-N 2.84Å; S217-S221 PolarHBondContact O-OG 2.84Å; V219-S221 VanDerWaalsContact C-N 3.25Å; V219-S221 PolarHBondContact O-N 3.47Å; S221-L223 VanDerWaalsContact C-N 3.35Å; S221-L223 PolarHBondContact O-N 3.38Å; S221-V224 PolarHBondContact O-N 3.23Å; S221-I225 VanDerWaalsContact O-CG1 3.28Å; S221-I225 WeakPolarHBondContact O-CG1 3.37Å; S221-I225 PolarHBondContact O-N 3.31Å
222S84.6Confident83.8Confident27 Ų2772.3 Ų72.319%0.18940%0.402CS..Hα-helixtrans-63.6-38.6177.472.10000112.7L218 V219 I225 L226L218-S222 VanDerWaalsContact O-CB 3.32Å; L218-S222 WeakPolarHBondContact O-CB 3.2Å; L218-S222 PolarHBondContact O-N 3.06Å; L218-S222 PolarHBondContact O-OG 3.26Å; V219-S222 PolarHBondContact O-N 3.48Å; V219-S222 PolarHBondContact O-OG 2.9Å; S222-I225 PolarHBondContact O-N 3.42Å; S222-L226 WeakPolarHBondContact O-CG 2.96Å; S222-L226 PolarHBondContact O-N 3.34Å; S222-L226 VanDerWaalsContact O-N 3.08Å
223L82.3Confident83.4Confident89 Ų8974.8 Ų74.847%0.46641%0.414SS..Hα-helixtrans-65.4-43.3176.3-75.9169.3000112.2L189 V219 P220 S221 L226 M227L189-L223 HydrophobicContact CD2-CD2 3.26Å; L189-L223 HydrophobicContact CD2-CG 3.87Å; V219-L223 HydrophobicContact CG1-CD1 4.46Å; V219-L223 PolarHBondContact O-N 3.49Å; P220-L223 PolarHBondContact O-N 3.32Å; S221-L223 VanDerWaalsContact C-N 3.35Å; S221-L223 PolarHBondContact O-N 3.38Å; L223-L226 PolarHBondContact O-N 2.87Å; L223-M227 PolarHBondContact O-N 3.04Å
224V86.4Confident82.8Confident92 Ų9275 Ų7556%0.55842%0.418SS*.Hα-helixtrans-63.5-43.7177171.30000110.8P220 S221 L226 M227 V228P220-V224 VanDerWaalsContact O-CG2 3.29Å; P220-V224 WeakPolarHBondContact O-CG2 3.11Å; P220-V224 PolarHBondContact O-N 2.72Å; S221-V224 PolarHBondContact O-N 3.23Å; V224-L226 VanDerWaalsContact C-N 3.32Å; V224-L226 PolarHBondContact O-N 3.15Å; V224-M227 PolarHBondContact O-N 2.94Å; V224-V228 HydrophobicContact CG1-CG2 4.36Å; V224-V228 VanDerWaalsContact O-CG2 3.32Å; V224-V228 WeakPolarHBondContact O-CG2 3.42Å; V224-V228 PolarHBondContact O-N 2.78Å
225I85.4Confident82.2Confident116 Ų11673.7 Ų73.760%0.59541%0.41SS*.Hα-helixtrans-60.1-42.5177.3-69.2165.1000111S221 S222 V228 Y229S221-I225 VanDerWaalsContact O-CG1 3.28Å; S221-I225 WeakPolarHBondContact O-CG1 3.37Å; S221-I225 PolarHBondContact O-N 3.31Å; S222-I225 PolarHBondContact O-N 3.42Å; I225-V228 PolarHBondContact O-N 3.36Å; I225-Y229 VanDerWaalsContact O-CB 3.27Å; I225-Y229 WeakPolarHBondContact O-CB 3.37Å; I225-Y229 PolarHBondContact O-N 3.16Å
226L82Confident81.6Confident54 Ų5475 Ų7528%0.28343%0.425SS..Hα-helixtrans-66.7-41177.4-72.7175.4000113L185 L189 S222 L223 V224 Y229 G230L185-L226 HydrophobicContact CD1-CD2 4.33Å; L185-L226 HydrophobicContact CD2-CD2 4.06Å; L189-L226 HydrophobicContact CD1-CD1 3.69Å; L189-L226 HydrophobicContact CD2-CD1 3.87Å; L189-L226 HydrophobicContact CG-CD1 4.33Å; S222-L226 WeakPolarHBondContact O-CG 2.96Å; S222-L226 PolarHBondContact O-N 3.34Å; S222-L226 VanDerWaalsContact O-N 3.08Å; L223-L226 PolarHBondContact O-N 2.87Å; V224-L226 VanDerWaalsContact C-N 3.32Å; V224-L226 PolarHBondContact O-N 3.15Å; L226-Y229 PolarHBondContact O-N 3.4Å; L226-G230 PolarHBondContact O-N 3.28Å
227M83Confident80.9Confident145 Ų14576.2 Ų76.271%0.71443%0.426SS*.Hα-helixtrans-60.6-46.3174.2-88.3-126.868.200112L223 V224 G230 F231L223-M227 PolarHBondContact O-N 3.04Å; V224-M227 PolarHBondContact O-N 2.94Å; M227-G230 PolarHBondContact O-N 2.7Å; M227-F231 WeakPolarHBondContact O-CB 3.28Å; M227-F231 PolarHBondContact O-N 2.99Å
228V86.7Confident80.2Confident81 Ų8180 Ų8049%0.49144%0.438SS..Hα-helixtrans-64.6-44.1178.1172.90000110.8V224 I225 G230 F231 C232V224-V228 HydrophobicContact CG1-CG2 4.36Å; V224-V228 VanDerWaalsContact O-CG2 3.32Å; V224-V228 WeakPolarHBondContact O-CG2 3.42Å; V224-V228 PolarHBondContact O-N 2.78Å; I225-V228 PolarHBondContact O-N 3.36Å; V228-G230 PolarHBondContact O-N 2.84Å; V228-F231 PolarHBondContact O-N 3.38Å; V228-C232 WeakPolarHBondContact O-CB 3.31Å; V228-C232 PolarHBondContact O-N 2.78Å; V228-C232 PolarHBondContact O-SG 3.39Å
229Y82.5Confident79.6Confident129 Ų12982.8 Ų82.851%0.50645%0.447SS..Hα-helixtrans-60.7-46.2177.5-179.1-105000112I225 L226 F231 C232 Q233I225-Y229 VanDerWaalsContact O-CB 3.27Å; I225-Y229 WeakPolarHBondContact O-CB 3.37Å; I225-Y229 PolarHBondContact O-N 3.16Å; L226-Y229 PolarHBondContact O-N 3.4Å; Y229-F231 PolarHBondContact O-N 3.39Å; Y229-C232 PolarHBondContact O-N 2.93Å; Y229-Q233 HydrophobicContact CE1-CG 4.25Å; Y229-Q233 VanDerWaalsContact CE1-NE2 3.25Å; Y229-Q233 HydrophobicContact CE2-CG 4.4Å; Y229-Q233 VanDerWaalsContact CZ-CD 3.47Å; Y229-Q233 WeakPolarHBondContact O-CB 3.32Å; Y229-Q233 WeakPolarHBondContact O-CG 3.34Å; Y229-Q233 PolarHBondContact O-N 3.27Å; Y229-Q233 PolarHBondContact OH-NE2 3.04Å
230G83.2Confident79Confident26 Ų2687.1 Ų87.127%0.26847%0.47SS..Hα-helixtrans-61.5-43176.200000112.6L226 M227 V228 Q233 C234L226-G230 PolarHBondContact O-N 3.28Å; M227-G230 PolarHBondContact O-N 2.7Å; V228-G230 PolarHBondContact O-N 2.84Å; G230-Q233 PolarHBondContact O-N 2.9Å; G230-C234 PolarHBondContact O-N 3.32Å; G230-C234 PolarHBondContact O-SG 3.45Å; G230-C234 VanDerWaalsContact O-SG 3.33Å
231F79.7Confident78.2Confident145 Ų14586 Ų8664%0.63646%0.46SS*.Hα-helixtrans-62.4-48.4175.8-179-99.5000112M227 V228 Y229 Q233 C234 V235M227-F231 WeakPolarHBondContact O-CB 3.28Å; M227-F231 PolarHBondContact O-N 2.99Å; V228-F231 PolarHBondContact O-N 3.38Å; Y229-F231 PolarHBondContact O-N 3.39Å; F231-Q233 VanDerWaalsContact C-N 3.27Å; F231-Q233 PolarHBondContact O-N 2.92Å; F231-C234 PolarHBondContact O-N 3.42Å; F231-V235 HydrophobicContact CD1-CG2 4.2Å; F231-V235 HydrophobicContact CE1-CG2 3.8Å; F231-V235 HydrophobicContact CE2-CG2 4.23Å; F231-V235 HydrophobicContact CZ-CG2 3.81Å; F231-V235 WeakPolarHBondContact O-CG2 3.44Å; F231-V235 PolarHBondContact O-N 3.41Å
232C77.5Confident77.3Confident63 Ų6387.6 Ų87.643%0.42647%0.47SS..Hα-helixtrans-57.9-40.8176.2-73.40000111.6V228 Y229 V235 C236V228-C232 WeakPolarHBondContact O-CB 3.31Å; V228-C232 PolarHBondContact O-N 2.78Å; V228-C232 PolarHBondContact O-SG 3.39Å; Y229-C232 PolarHBondContact O-N 2.93Å; C232-V235 PolarHBondContact O-N 3.11Å; C232-C236 VanDerWaalsContact O-CB 3.31Å; C232-C236 WeakPolarHBondContact O-CB 3.46Å; C232-C236 PolarHBondContact O-N 2.79Å; C232-C236 PolarHBondContact O-SG 3.38Å
233Q77.1Confident76Confident53 Ų5393.6 Ų93.625%0.24850%0.497CS..Hα-helixtrans-66.7-40.7176.6-75.6-176.9-43.500113.1F178 Y229 G230 F231 C236 H237F178-Q233 VanDerWaalsContact CE2-CD 3.5Å; Y229-Q233 HydrophobicContact CE1-CG 4.25Å; Y229-Q233 VanDerWaalsContact CE1-NE2 3.25Å; Y229-Q233 HydrophobicContact CE2-CG 4.4Å; Y229-Q233 VanDerWaalsContact CZ-CD 3.47Å; Y229-Q233 WeakPolarHBondContact O-CB 3.32Å; Y229-Q233 WeakPolarHBondContact O-CG 3.34Å; Y229-Q233 PolarHBondContact O-N 3.27Å; Y229-Q233 PolarHBondContact OH-NE2 3.04Å; G230-Q233 PolarHBondContact O-N 2.9Å; F231-Q233 VanDerWaalsContact C-N 3.27Å; F231-Q233 PolarHBondContact O-N 2.92Å; Q233-C236 PolarHBondContact O-N 3.05Å; Q233-H237 WeakPolarHBondContact O-CB 3.41Å; Q233-H237 PolarHBondContact O-N 2.87Å
234C74.7Confident74.6Confident83 Ų8393.8 Ų93.856%0.56151%0.505SS*.Hα-helixtrans-60.7-46.2174.6-71.60000111.5G230 F231 H237 E238G230-C234 PolarHBondContact O-N 3.32Å; G230-C234 PolarHBondContact O-SG 3.45Å; G230-C234 VanDerWaalsContact O-SG 3.33Å; F231-C234 PolarHBondContact O-N 3.42Å; C234-H237 PolarHBondContact O-N 3.29Å; C234-E238 WeakPolarHBondContact O-CG 3.46Å; C234-E238 PolarHBondContact O-N 3.11Å
235V77.4Confident72.8Confident51 Ų5195.9 Ų95.931%0.30952%0.524SS..Hα-helixtrans-62.9-47.4177.2174.20000110.3F231 C232 H237 E238 F239F231-V235 HydrophobicContact CD1-CG2 4.2Å; F231-V235 HydrophobicContact CE1-CG2 3.8Å; F231-V235 HydrophobicContact CE2-CG2 4.23Å; F231-V235 HydrophobicContact CZ-CG2 3.81Å; F231-V235 WeakPolarHBondContact O-CG2 3.44Å; F231-V235 PolarHBondContact O-N 3.41Å; C232-V235 PolarHBondContact O-N 3.11Å; V235-H237 VanDerWaalsContact C-N 3.27Å; V235-H237 PolarHBondContact O-N 3.33Å; V235-E238 PolarHBondContact O-N 2.99Å; V235-F239 HydrophobicContact CG1-CD2 3.56Å; V235-F239 HydrophobicContact CG1-CE2 3.66Å; V235-F239 WeakPolarHBondContact O-CD2 3.18Å; V235-F239 PolarHBondContact O-N 2.97Å
236C72.8Confident72.2Confident80 Ų8094.9 Ų94.954%0.54152%0.52SS..Hα-helixtrans-59.2-38.2176.6-72.80000112.3C232 Q233 L240C232-C236 VanDerWaalsContact O-CB 3.31Å; C232-C236 WeakPolarHBondContact O-CB 3.46Å; C232-C236 PolarHBondContact O-N 2.79Å; C232-C236 PolarHBondContact O-SG 3.38Å; Q233-C236 PolarHBondContact O-N 3.05Å; C236-L240 WeakPolarHBondContact O-CB 3.3Å; C236-L240 PolarHBondContact O-N 3.37Å
237H68.9Low71.7Confident86 Ų8697 Ų9740%0.39853%0.533SS..Hα-helixtrans-65.9-45.5176.7-168.3-61.8000111.6Q233 C234 V235 L240 D241Q233-H237 WeakPolarHBondContact O-CB 3.41Å; Q233-H237 PolarHBondContact O-N 2.87Å; C234-H237 PolarHBondContact O-N 3.29Å; V235-H237 VanDerWaalsContact C-N 3.27Å; V235-H237 PolarHBondContact O-N 3.33Å; H237-L240 PolarHBondContact O-N 3.42Å; H237-D241 IonicContact CE1-OD1 3.57Å; H237-D241 IonicContact CE1-OD2 3.79Å; H237-D241 PolarHBondContact CE1-OD2 3.25Å; H237-D241 IonicContact ND1-OD1 2.68Å; H237-D241 IonicContact ND1-OD2 3.06Å; H237-D241 PolarHBondContact ND1-OD2 3.33Å; H237-D241 WeakPolarHBondContact O-CB 3.47Å; H237-D241 VanDerWaalsContact O-CG 3.23Å; H237-D241 PolarHBondContact O-N 3.47Å
238E70.5Confident71Confident132 Ų13294.3 Ų94.362%0.61752%0.523SS*.Hα-helixtrans-62.1-43176.1-71.9-110.812500111.8C234 V235 D241 C242C234-E238 WeakPolarHBondContact O-CG 3.46Å; C234-E238 PolarHBondContact O-N 3.11Å; V235-E238 PolarHBondContact O-N 2.99Å; E238-D241 PolarHBondContact O-N 3.38Å; E238-C242 PolarHBondContact O-N 3.35Å; E238-C242 PolarHBondContact O-SG 3.09Å; E238-C242 VanDerWaalsContact O-SG 3.32Å
239F70.7Confident70.1Confident140 Ų14095.1 Ų95.161%0.61453%0.525SS*.Hα-helixtrans-65.6-39.3176.9-91.7-85000112.6V235 D241 C242 M243V235-F239 HydrophobicContact CG1-CD2 3.56Å; V235-F239 HydrophobicContact CG1-CE2 3.66Å; V235-F239 WeakPolarHBondContact O-CD2 3.18Å; V235-F239 PolarHBondContact O-N 2.97Å; F239-D241 VanDerWaalsContact C-N 3.34Å; F239-C242 PolarHBondContact O-N 3.04Å; F239-M243 WeakPolarHBondContact O-CG 3.37Å; F239-M243 PolarHBondContact O-N 3.05Å
240L67.9Low69.3Low107 Ų10793 Ų9356%0.5653%0.526SS*.Hα-helixtrans-65.8-40.2176.1-134.4101000111.3C236 H237 C242 M243 S244C236-L240 WeakPolarHBondContact O-CB 3.3Å; C236-L240 PolarHBondContact O-N 3.37Å; H237-L240 PolarHBondContact O-N 3.42Å; L240-C242 VanDerWaalsContact C-N 3.34Å; L240-M243 PolarHBondContact O-N 3.25Å; L240-S244 WeakPolarHBondContact O-CB 3.37Å; L240-S244 PolarHBondContact O-N 2.92Å; L240-S244 VanDerWaalsContact O-N 3.09Å; L240-S244 PolarHBondContact O-OG 2.91Å
241D63.5Low68.4Low45 Ų4597.5 Ų97.524%0.24154%0.543CS..Hα-helixtrans-61.4-43.6176-73.9-25.9000110.7W171 H237 E238 F239 M243 S244W171-D241 VanDerWaalsContact CH2-OD1 3.26Å; W171-D241 WeakPolarHBondContact CH2-OD1 3.17Å; H237-D241 IonicContact CE1-OD1 3.57Å; H237-D241 IonicContact CE1-OD2 3.79Å; H237-D241 PolarHBondContact CE1-OD2 3.25Å; H237-D241 IonicContact ND1-OD1 2.68Å; H237-D241 IonicContact ND1-OD2 3.06Å; H237-D241 PolarHBondContact ND1-OD2 3.33Å; H237-D241 WeakPolarHBondContact O-CB 3.47Å; H237-D241 VanDerWaalsContact O-CG 3.23Å; H237-D241 PolarHBondContact O-N 3.47Å; E238-D241 PolarHBondContact O-N 3.38Å; F239-D241 VanDerWaalsContact C-N 3.34Å; D241-M243 PolarHBondContact O-N 3.27Å; D241-S244 PolarHBondContact O-N 3.36Å; D241-S244 PolarHBondContact O-OG 2.81Å
242C66.1Low67.6Low95 Ų9594.1 Ų94.164%0.64254%0.536SS*.Hα-helixtrans-64.2-37.5176.4-71.50000113.7E238 F239 L240 S244E238-C242 PolarHBondContact O-N 3.35Å; E238-C242 PolarHBondContact O-SG 3.09Å; E238-C242 VanDerWaalsContact O-SG 3.32Å; F239-C242 PolarHBondContact O-N 3.04Å; L240-C242 VanDerWaalsContact C-N 3.34Å; C242-S244 VanDerWaalsContact C-N 3.33Å
243M57.7Low66.8Low154 Ų15496.5 Ų96.576%0.75955%0.545SS*.Hα-helixtrans-75.2-22.1178.5-77.717827.200113.6F239 L240 D241F239-M243 WeakPolarHBondContact O-CG 3.37Å; F239-M243 PolarHBondContact O-N 3.05Å; L240-M243 PolarHBondContact O-N 3.25Å; D241-M243 PolarHBondContact O-N 3.27Å
244S53.7Low66Low92 Ų92100.1 Ų100.164%0.64357%0.57SS**THydrogen-bonded Turntrans-86-6.5-179.674.20000114.3L240 D241 C242L240-S244 WeakPolarHBondContact O-CB 3.37Å; L240-S244 PolarHBondContact O-N 2.92Å; L240-S244 VanDerWaalsContact O-N 3.09Å; L240-S244 PolarHBondContact O-OG 2.91Å; D241-S244 PolarHBondContact O-N 3.36Å; D241-S244 PolarHBondContact O-OG 2.81Å; C242-S244 VanDerWaalsContact C-N 3.33Å
245S47.9Very low65.2Low136 Ų136101.6 Ų101.695%0.95157%0.57SS**  trans-96.80-179.8-170.80000113.2

Retrieved 245 of 245 residues in 232.9 ms (Link to these results)