A0A093I8R2_STRCA Loading...

Transmembrane protein 174

AlphaFold DB , UniProt , Accession A0A093I8R2, Species STRCA (Struthio camelus australis), Gene n/a, Length 243 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
1M34.9Very low39.2Very low225 Ų225146.4 Ų146.4100%1.10877%0.772SS**  01000-79.6166.7168.300108.2
2E41.3Very low39.6Very low163 Ų163144.8 Ų144.876%0.76276%0.764SS**  cis-139.8143.4-13.3-101.194.915700109.8
3Q41Very low39.6Very low165 Ų165144.8 Ų144.877%0.77177%0.765SS**  trans-7.6124.8148176-179.374.600117.9
4N35.4Very low39.7Very low156 Ų156143.2 Ų143.283%0.83476%0.763SS**  -142.8119122.1-162.1-1.2000109.5
5N40.4Very low39.8Very low118 Ų118146.5 Ų146.563%0.63177%0.768SS**  trans-98.8113.2-178.1-64.1-35.6000108.6V7N5-V7 VanDerWaalsContact C-N 3.31Å; N5-V7 PolarHBondContact O-N 3.37Å
6S35.8Very low39.8Very low115 Ų115143.7 Ų143.780%0.80477%0.765SS**  trans-69.891.8164.555.10000108.5E8S6-E8 PolarHBondContact O-N 3.47Å; S6-E8 VanDerWaalsContact O-N 3.15Å
7V41.5Very low40Very low120 Ų120141.8 Ų141.873%0.72776%0.759SS**  trans-64.1114.4170.6174.50000107.3N5 D9N5-V7 VanDerWaalsContact C-N 3.31Å; N5-V7 PolarHBondContact O-N 3.37Å; V7-D9 VanDerWaalsContact C-N 3.28Å; V7-D9 PolarHBondContact O-N 3.37Å
8E36.7Very low40.2Very low156 Ų156138.3 Ų138.373%0.72975%0.753SS**  trans-68.791.1167-63.5-176.3139.800107.2S6 F10S6-E8 PolarHBondContact O-N 3.47Å; S6-E8 VanDerWaalsContact O-N 3.15Å; E8-F10 HydrophobicContact CB-CD2 4.4Å; E8-F10 HydrophobicContact CB-CE2 4.22Å; E8-F10 WeakPolarHBondContact O-CD2 3.24Å; E8-F10 PolarHBondContact O-N 3.32Å
9D38.3Very low40.3Very low133 Ų133137.2 Ų137.271%0.71175%0.754SS**  trans-74.399.8-179-160.9-15.8000109.3V7 S11V7-D9 VanDerWaalsContact C-N 3.28Å; V7-D9 PolarHBondContact O-N 3.37Å; D9-S11 PolarHBondContact O-N 2.9Å
10F45.4Very low40.1Very low151 Ų151141.5 Ų141.566%0.66276%0.76SS**  trans-69.270.5-177-91.5-97.1000111.7E8 L12E8-F10 HydrophobicContact CB-CD2 4.4Å; E8-F10 HydrophobicContact CB-CE2 4.22Å; E8-F10 WeakPolarHBondContact O-CD2 3.24Å; E8-F10 PolarHBondContact O-N 3.32Å; F10-L12 HydrophobicContact CD1-CD1 4.21Å; F10-L12 HydrophobicContact CD1-CG 4.31Å; F10-L12 PolarHBondContact O-N 3.07Å
11S40Very low40.2Very low108 Ų108142.7 Ų142.776%0.75576%0.761SS**  trans-70.667.6165.6-71.40000110.9D9D9-S11 PolarHBondContact O-N 2.9Å
12L44.3Very low40.4Very low128 Ų128137.3 Ų137.367%0.6774%0.743SS**  trans-69.2132.3170.1-84.1164.9000110.4F10F10-L12 HydrophobicContact CD1-CD1 4.21Å; F10-L12 HydrophobicContact CD1-CG 4.31Å; F10-L12 PolarHBondContact O-N 3.07Å
13N39.9Very low40.5Very low145 Ų145136 Ų13678%0.77574%0.741SS**  trans69.7137.8-176-42.2-76000112.6
14V40.4Very low40.4Very low122 Ų122138.6 Ų138.674%0.73974%0.744SS**  cis-127.5121.927174.90000111.4S16V14-S16 VanDerWaalsContact C-N 3.27Å; V14-S16 WeakPolarHBondContact CG1-OG 3.23Å; V14-S16 PolarHBondContact O-N 2.9Å
15F42.5Very low41.1Very low192 Ų192135.6 Ų135.684%0.84274%0.735SS**  trans-82.374.7169.8-162.5-102.4000109.7V17F15-V17 VanDerWaalsContact C-N 3.35Å; F15-V17 HydrophobicContact CD1-CG2 3.57Å; F15-V17 HydrophobicContact CE1-CG2 3.67Å; F15-V17 PolarHBondContact O-N 3.35Å
16S39.5Very low41Very low102 Ų102136.7 Ų136.771%0.71374%0.741SS**  trans-6793.3174.5-790000109.8V14 A18V14-S16 VanDerWaalsContact C-N 3.27Å; V14-S16 WeakPolarHBondContact CG1-OG 3.23Å; V14-S16 PolarHBondContact O-N 2.9Å; S16-A18 PolarHBondContact O-N 3.34Å
17V42.9Very low41.3Very low111 Ų111137.9 Ų137.967%0.67374%0.743SS**  trans-66.689166-175.30000107.8F15F15-V17 VanDerWaalsContact C-N 3.35Å; F15-V17 HydrophobicContact CD1-CG2 3.57Å; F15-V17 HydrophobicContact CE1-CG2 3.67Å; F15-V17 PolarHBondContact O-N 3.35Å
18A43.8Very low41.4Very low79 Ų79139.7 Ų139.765%0.65375%0.748SS**  trans-55.2128.7158.900000107.2S16 Y20S16-A18 PolarHBondContact O-N 3.34Å; A18-Y20 PolarHBondContact O-N 3.18Å
19P41.4Very low41.4Very low118 Ų118138 Ų13877%0.76675%0.748SS**  trans-58.4127.5-179.724.3-33.2000108.5Q21P19-Q21 PolarHBondContact O-N 3.32Å
20Y37Very low41.8Very low222 Ų222135.7 Ų135.787%0.87174%0.742SS**  trans-59.797.3-172.7-172.4-89.9000110A18 P22A18-Y20 PolarHBondContact O-N 3.18Å; Y20-P22 VanDerWaalsContact O-CD 3.31Å; Y20-P22 WeakPolarHBondContact O-CD 3.36Å
21Q42.7Very low42.1Very low167 Ų167133 Ų13378%0.7873%0.734SS**  trans-63.3118.1-178.1-176.8175.8-6.400107.9P19 N23P19-Q21 PolarHBondContact O-N 3.32Å; Q21-N23 PolarHBondContact O-N 3Å
22P38Very low42.8Very low113 Ų113129.5 Ų129.573%0.73472%0.716SS**  trans-76.375.6-175.531.2-34.8000109.7Y20 R24Y20-P22 VanDerWaalsContact O-CD 3.31Å; Y20-P22 WeakPolarHBondContact O-CD 3.36Å; P22-R24 VanDerWaalsContact C-N 3.26Å; P22-R24 PolarHBondContact O-N 2.9Å
23N43.6Very low43.5Very low135 Ų135127.1 Ų127.172%0.72270%0.703SS**  trans-71.683.9174.9-174.116.9000109.7Q21Q21-N23 PolarHBondContact O-N 3Å
24R39.7Very low44.8Very low220 Ų220126.7 Ų126.783%0.8370%0.695SS**  trans-14047.5170-157.4175.1-174.8152.34.4111.2P22 D26P22-R24 VanDerWaalsContact C-N 3.26Å; P22-R24 PolarHBondContact O-N 2.9Å; R24-D26 PolarHBondContact O-N 3.17Å
25S50.2Low46.2Very low93 Ų93123.1 Ų123.165%0.6568%0.678SS**  trans-73.875.5161.653.80000109.5
26D37.5Very low47.8Very low140 Ų140114.5 Ų114.575%0.74964%0.644SS**SBendtrans-160.8132.8161.9-96.5-38000108.4R24R24-D26 PolarHBondContact O-N 3.17Å
27V42Very low49.8Very low140 Ų140112.5 Ų112.585%0.84863%0.633SS**  trans65.852-167.4-159.60000113.8V29V27-V29 PolarHBondContact O-N 3.49Å
28L42.8Very low51.8Low159 Ų159111.6 Ų111.683%0.83263%0.628SS**  trans-93.974.3170.2-163.785000111.6
29V38Very low53.8Low121 Ų121110.3 Ų110.373%0.73361%0.61SS**SBendtrans-108.196.1178.1-176.90000110.7V27 D31V27-V29 PolarHBondContact O-N 3.49Å; V29-D31 PolarHBondContact O-N 3.25Å
30S47.2Very low56Low83 Ų83107.9 Ų107.958%0.5859%0.59SS**SBendtrans45.428.2169.1-116.90000117.9G32 D33S30-G32 PolarHBondContact O-N 3.26Å; S30-G32 VanDerWaalsContact O-N 3.14Å; S30-D33 WeakPolarHBondContact CB-OD2 3.23Å; S30-D33 PolarHBondContact O-N 3.13Å; S30-D33 VanDerWaalsContact O-N 3.17Å; S30-D33 PolarHBondContact OG-OD2 3.31Å
31D51Low58.5Low94 Ų94104.8 Ų104.850%0.50358%0.581SS.*Hα-helixtrans-70.7-15.1-172.7-153.121.8000113.6V29 D33 K34 A35V29-D31 PolarHBondContact O-N 3.25Å; D31-D33 VanDerWaalsContact C-N 3.32Å; D31-D33 PolarHBondContact O-N 3.36Å; D31-K34 PolarHBondContact O-N 3.45Å; D31-K34 IonicContact OD1-NZ 2.58Å; D31-K34 PolarHBondContact OD1-NZ 3.22Å; D31-A35 WeakPolarHBondContact O-CB 3.4Å; D31-A35 PolarHBondContact O-N 3.05Å
32G54.8Low60.6Low35 Ų3598.6 Ų98.636%0.36156%0.556SS.*Hα-helixtrans-60.8-38.4171.400000113.2S30 G36S30-G32 PolarHBondContact O-N 3.26Å; S30-G32 VanDerWaalsContact O-N 3.14Å; G32-G36 PolarHBondContact O-N 2.81Å
33D59.5Low63.2Low78 Ų7893.2 Ų93.242%0.41752%0.521SS..Hα-helixtrans-71.8-40.4179.8-51.8-54.7000110.9S30 D31 G36 A37S30-D33 WeakPolarHBondContact CB-OD2 3.23Å; S30-D33 PolarHBondContact O-N 3.13Å; S30-D33 VanDerWaalsContact O-N 3.17Å; S30-D33 PolarHBondContact OG-OD2 3.31Å; D31-D33 VanDerWaalsContact C-N 3.32Å; D31-D33 PolarHBondContact O-N 3.36Å; D33-G36 PolarHBondContact O-N 3.33Å; D33-A37 WeakPolarHBondContact O-CB 3.41Å; D33-A37 PolarHBondContact O-N 2.87Å
34K66.1Low65.5Low137 Ų13790.2 Ų90.260%0.59651%0.508SS*.Hα-helixtrans-66.8-40.4179.5-143.3172.877.5-97.10111.6D31 T38D31-K34 PolarHBondContact O-N 3.45Å; D31-K34 IonicContact OD1-NZ 2.58Å; D31-K34 PolarHBondContact OD1-NZ 3.22Å; K34-T38 PolarHBondContact O-N 3.35Å; K34-T38 PolarHBondContact O-OG1 2.63Å
35A70.6Confident68.1Low46 Ų4685.6 Ų85.638%0.3849%0.494SS..Hα-helixtrans-64.4-44.717100000112.1D31 T38 L39D31-A35 WeakPolarHBondContact O-CB 3.4Å; D31-A35 PolarHBondContact O-N 3.05Å; A35-T38 PolarHBondContact O-N 2.74Å; A35-L39 WeakPolarHBondContact O-CG 3.07Å; A35-L39 PolarHBondContact O-N 2.92Å; A35-L39 VanDerWaalsContact O-N 3.13Å
36G76Confident70.1Confident12 Ų1283.2 Ų83.212%0.12447%0.474CS..Hα-helixtrans-59.6-49.1178.200000113.3G32 D33 T38 L39 L40G32-G36 PolarHBondContact O-N 2.81Å; D33-G36 PolarHBondContact O-N 3.33Å; G36-T38 VanDerWaalsContact C-N 3.3Å; G36-T38 PolarHBondContact O-N 2.92Å; G36-L39 PolarHBondContact O-N 3.34Å; G36-L40 PolarHBondContact O-N 3.44Å
37A81.5Confident72.7Confident59 Ų5977 Ų7749%0.48844%0.443SS..Hα-helixtrans-60.9-37.4177.800000112.8D33 L40 F41D33-A37 WeakPolarHBondContact O-CB 3.41Å; D33-A37 PolarHBondContact O-N 2.87Å; A37-L40 PolarHBondContact O-N 3.35Å; A37-F41 PolarHBondContact O-N 3.16Å
38T85.4Confident75.1Confident93 Ų9375.3 Ų75.357%0.57143%0.429SS*.Hα-helixtrans-66.6-40.9177.8-520000111.5K34 A35 G36 F41 S42K34-T38 PolarHBondContact O-N 3.35Å; K34-T38 PolarHBondContact O-OG1 2.63Å; A35-T38 PolarHBondContact O-N 2.74Å; G36-T38 VanDerWaalsContact C-N 3.3Å; G36-T38 PolarHBondContact O-N 2.92Å; T38-F41 PolarHBondContact O-N 3.02Å; T38-S42 PolarHBondContact O-N 2.88Å; T38-S42 PolarHBondContact O-OG 3.37Å
39L85.5Confident77.4Confident51 Ų5170.4 Ų70.427%0.26741%0.405SS..Hα-helixtrans-68.2-36.8176.6-67.6168000112.7A35 G36 S42 G43 F84 A88A35-L39 WeakPolarHBondContact O-CG 3.07Å; A35-L39 PolarHBondContact O-N 2.92Å; A35-L39 VanDerWaalsContact O-N 3.13Å; G36-L39 PolarHBondContact O-N 3.34Å; L39-S42 WeakPolarHBondContact CA-OG 3.43Å; L39-S42 PolarHBondContact O-OG 3.43Å; L39-G43 PolarHBondContact O-N 3.47Å; L39-F84 HydrophobicContact CD2-CD1 3.83Å; L39-F84 HydrophobicContact CD2-CE1 3.87Å; L39-A88 HydrophobicContact CB-CB 3.82Å
40L86.8Confident80Confident68 Ų6864.6 Ų64.636%0.35637%0.37SS..Hα-helixtrans-61.1-48.5170.9-72.2172.5000111G36 A37 S42 G43 V44 I85 A88 V89G36-L40 PolarHBondContact O-N 3.44Å; A37-L40 PolarHBondContact O-N 3.35Å; L40-S42 PolarHBondContact O-N 2.78Å; L40-G43 PolarHBondContact O-N 3.46Å; L40-V44 WeakPolarHBondContact O-CG2 3.36Å; L40-V44 PolarHBondContact O-N 3.48Å; L40-I85 HydrophobicContact CD2-CG2 4.17Å; L40-A88 HydrophobicContact CD2-CB 3.7Å; L40-A88 HydrophobicContact CG-CB 3.71Å; L40-V89 HydrophobicContact CD2-CG2 3.99Å
41F88.8Confident82Confident157 Ų15764.8 Ų64.869%0.68936%0.363SS*.Hα-helixtrans-62.8-43.7-179.9-173.8-98.9000112.2A37 T38 V44 F45A37-F41 PolarHBondContact O-N 3.16Å; T38-F41 PolarHBondContact O-N 3.02Å; F41-V44 PolarHBondContact O-N 2.98Å; F41-F45 WeakPolarHBondContact O-CB 3.37Å; F41-F45 PolarHBondContact O-N 3.16Å
42S88.6Confident83.8Confident36 Ų3664.3 Ų64.325%0.25236%0.364SS..Hα-helixtrans-64.6-39.9174.962.80000112.2T38 L39 L40 F45 L46T38-S42 PolarHBondContact O-N 2.88Å; T38-S42 PolarHBondContact O-OG 3.37Å; L39-S42 WeakPolarHBondContact CA-OG 3.43Å; L39-S42 PolarHBondContact O-OG 3.43Å; L40-S42 PolarHBondContact O-N 2.78Å; S42-F45 PolarHBondContact O-N 2.86Å; S42-L46 WeakPolarHBondContact O-CB 3.45Å; S42-L46 VanDerWaalsContact O-CD1 3.3Å; S42-L46 WeakPolarHBondContact O-CD1 3.49Å; S42-L46 PolarHBondContact O-N 3.47Å
43G91.4Very high85.3Confident0 Ų066 Ų660%036%0.362CS..Hα-helixtrans-65.3-41.8178.200000112.9L39 L40 G47 G81L39-G43 PolarHBondContact O-N 3.47Å; L40-G43 PolarHBondContact O-N 3.46Å; G43-G47 PolarHBondContact O-N 2.81Å; G43-G81 WeakPolarHBondContact CA-O 3.48Å; G43-G81 WeakPolarHBondContact O-CA 3.46Å
44V92.6Very high86.6Confident73 Ų7363.6 Ų63.644%0.44235%0.35SS..Hα-helixtrans-65.3-41.6173.1170.70000111.3L40 F41 G47 L48 I85L40-V44 WeakPolarHBondContact O-CG2 3.36Å; L40-V44 PolarHBondContact O-N 3.48Å; F41-V44 PolarHBondContact O-N 2.98Å; V44-G47 PolarHBondContact O-N 3.34Å; V44-L48 HydrophobicContact CG1-CD1 4.05Å; V44-L48 HydrophobicContact CG1-CG 4.42Å; V44-L48 WeakPolarHBondContact O-CG 3.42Å; V44-L48 PolarHBondContact O-N 2.99Å; V44-I85 HydrophobicContact CG2-CD1 3.99Å; V44-I85 HydrophobicContact CG2-CG1 4.39Å
45F93.4Very high87.4Confident122 Ų12260.7 Ų60.754%0.53534%0.344SS..Hα-helixtrans-64.1-46.2176.5-173-97.3000112F41 S42 G47 L48 V49F41-F45 WeakPolarHBondContact O-CB 3.37Å; F41-F45 PolarHBondContact O-N 3.16Å; S42-F45 PolarHBondContact O-N 2.86Å; F45-G47 VanDerWaalsContact C-N 3.3Å; F45-G47 PolarHBondContact O-N 3.17Å; F45-L48 PolarHBondContact O-N 3.42Å; F45-V49 HydrophobicContact CD1-CG2 4.21Å; F45-V49 HydrophobicContact CE1-CG2 3.86Å; F45-V49 HydrophobicContact CE2-CG2 4.49Å; F45-V49 HydrophobicContact CZ-CG2 4.01Å; F45-V49 WeakPolarHBondContact O-CG2 3.43Å; F45-V49 PolarHBondContact O-N 3.14Å
46L92.1Very high87.9Confident44 Ų4463.9 Ų63.923%0.2335%0.352CS..Hα-helixtrans-62.1-37.4173.6-94.469000111.9S42 G50 V80 F84S42-L46 WeakPolarHBondContact O-CB 3.45Å; S42-L46 VanDerWaalsContact O-CD1 3.3Å; S42-L46 WeakPolarHBondContact O-CD1 3.49Å; S42-L46 PolarHBondContact O-N 3.47Å; L46-G50 PolarHBondContact O-N 2.58Å; L46-V80 HydrophobicContact CD2-CB 4.35Å; L46-V80 HydrophobicContact CD2-CG1 3.67Å; L46-F84 HydrophobicContact CD2-CD2 4.2Å; L46-F84 HydrophobicContact CD2-CE2 4.29Å
47G92.7Very high87.9Confident10 Ų1063.7 Ų63.710%0.10335%0.349CS..Hα-helixtrans-62.1-50173.700000112.6G43 V44 F45 G50 I51G43-G47 PolarHBondContact O-N 2.81Å; V44-G47 PolarHBondContact O-N 3.34Å; F45-G47 VanDerWaalsContact C-N 3.3Å; F45-G47 PolarHBondContact O-N 3.17Å; G47-G50 PolarHBondContact O-N 3.01Å; G47-I51 WeakPolarHBondContact O-CB 3.43Å; G47-I51 WeakPolarHBondContact O-CD1 3.49Å; G47-I51 WeakPolarHBondContact O-CG1 3.39Å; G47-I51 PolarHBondContact O-N 2.77Å
48L92.6Very high87.5Confident104 Ų10470.1 Ų70.155%0.54536%0.361SS..Hα-helixtrans-62.6-43177.7-73.4170.8000112.3V44 F45 T52V44-L48 HydrophobicContact CG1-CD1 4.05Å; V44-L48 HydrophobicContact CG1-CG 4.42Å; V44-L48 WeakPolarHBondContact O-CG 3.42Å; V44-L48 PolarHBondContact O-N 2.99Å; F45-L48 PolarHBondContact O-N 3.42Å; L48-T52 WeakPolarHBondContact O-CB 3.46Å; L48-T52 PolarHBondContact O-N 3.33Å; L48-T52 PolarHBondContact O-OG1 2.84Å
49V91.2Very high86.6Confident55 Ų5572.2 Ų72.233%0.33337%0.368SS..Hα-helixtrans-65-45.2174.9174.80000110.4F45 T52 F53 L77F45-V49 HydrophobicContact CD1-CG2 4.21Å; F45-V49 HydrophobicContact CE1-CG2 3.86Å; F45-V49 HydrophobicContact CE2-CG2 4.49Å; F45-V49 HydrophobicContact CZ-CG2 4.01Å; F45-V49 WeakPolarHBondContact O-CG2 3.43Å; F45-V49 PolarHBondContact O-N 3.14Å; V49-T52 PolarHBondContact O-N 3.21Å; V49-F53 WeakPolarHBondContact O-CB 3.24Å; V49-F53 PolarHBondContact O-N 3.03Å; V49-L77 HydrophobicContact CG1-CD1 4.17Å
50G91.6Very high85.5Confident0 Ų077 Ų770%039%0.386CS..Hα-helixtrans-62.3-41.6177.800000113.4L46 G47 F53 T54L46-G50 PolarHBondContact O-N 2.58Å; G47-G50 PolarHBondContact O-N 3.01Å; G50-F53 PolarHBondContact O-N 3.35Å; G50-T54 WeakPolarHBondContact O-CB 3.36Å; G50-T54 PolarHBondContact O-N 2.92Å; G50-T54 PolarHBondContact O-OG1 3.37Å
51I89.7Confident84.1Confident86 Ų8676 Ų7644%0.44138%0.378SS..Hα-helixtrans-62.9-49.1172.4-69.8162.6000110.1G47 F53 T54 V55 L78G47-I51 WeakPolarHBondContact O-CB 3.43Å; G47-I51 WeakPolarHBondContact O-CD1 3.49Å; G47-I51 WeakPolarHBondContact O-CG1 3.39Å; G47-I51 PolarHBondContact O-N 2.77Å; I51-F53 VanDerWaalsContact C-N 3.28Å; I51-F53 PolarHBondContact O-N 3.23Å; I51-T54 PolarHBondContact O-N 2.92Å; I51-T54 VanDerWaalsContact O-N 3.13Å; I51-V55 HydrophobicContact CG2-CG2 4.28Å; I51-V55 WeakPolarHBondContact O-CB 3.44Å; I51-V55 WeakPolarHBondContact O-CG2 3.42Å; I51-V55 PolarHBondContact O-N 2.92Å; I51-L78 HydrophobicContact CG1-CD1 4.14Å; I51-L78 HydrophobicContact CG1-CG 4.46Å
52T88.7Confident82.6Confident84 Ų8476.7 Ų76.752%0.51539%0.389SS..Hα-helixtrans-58.5-41.8178.3-55.10000111.4L48 V49 M56L48-T52 WeakPolarHBondContact O-CB 3.46Å; L48-T52 PolarHBondContact O-N 3.33Å; L48-T52 PolarHBondContact O-OG1 2.84Å; V49-T52 PolarHBondContact O-N 3.21Å; T52-M56 WeakPolarHBondContact O-CB 3.46Å; T52-M56 PolarHBondContact O-N 3.46Å
53F85.9Confident80.9Confident71 Ų7178.3 Ų78.331%0.31141%0.411SS..Hα-helixtrans-72.3-32.4178.3-141.4-95000112.4V49 G50 I51 G57 T70 L73V49-F53 WeakPolarHBondContact O-CB 3.24Å; V49-F53 PolarHBondContact O-N 3.03Å; G50-F53 PolarHBondContact O-N 3.35Å; I51-F53 VanDerWaalsContact C-N 3.28Å; I51-F53 PolarHBondContact O-N 3.23Å; F53-G57 WeakPolarHBondContact O-CA 3.36Å; F53-G57 PolarHBondContact O-N 2.88Å; F53-T70 VanDerWaalsContact CD1-O 3.31Å; F53-T70 WeakPolarHBondContact CD1-O 3.47Å; F53-T70 HydrophobicContact CE1-CG2 4.36Å; F53-T70 VanDerWaalsContact CE1-O 3.23Å; F53-T70 WeakPolarHBondContact CE1-O 3.45Å; F53-T70 HydrophobicContact CZ-CG2 4.48Å; F53-L73 HydrophobicContact CD1-CB 4.03Å; F53-L73 HydrophobicContact CD1-CD2 4.26Å; F53-L73 HydrophobicContact CD1-CG 4.38Å; F53-L73 HydrophobicContact CE1-CB 3.88Å; F53-L73 HydrophobicContact CE1-CD2 3.7Å; F53-L73 HydrophobicContact CE1-CG 4.21Å; F53-L73 HydrophobicContact CZ-CD2 3.89Å
54T86.8Confident79.2Confident28 Ų2883.8 Ų83.817%0.17244%0.439CS..Hα-helixtrans-69.3-46.1173.4-550000110.9G50 I51 G57 W58 G74G50-T54 WeakPolarHBondContact O-CB 3.36Å; G50-T54 PolarHBondContact O-N 2.92Å; G50-T54 PolarHBondContact O-OG1 3.37Å; I51-T54 PolarHBondContact O-N 2.92Å; I51-T54 VanDerWaalsContact O-N 3.13Å; T54-G57 CarbonylContact O-C 3.59Å; T54-G57 WeakPolarHBondContact O-CA 3.49Å; T54-G57 PolarHBondContact O-N 2.87Å; T54-W58 HydrophobicContact CG2-CE3 4.32Å; T54-W58 WeakPolarHBondContact O-CB 3.47Å; T54-W58 PolarHBondContact O-N 3.49Å; T54-G74 VanDerWaalsContact OG1-CA 3.27Å; T54-G74 WeakPolarHBondContact OG1-CA 3.37Å
55V84.7Confident77.4Confident76 Ų7686.8 Ų86.846%0.46146%0.458SS..Hα-helixtrans-66-47.2178.61710000111.1I51 G57 W58 I59I51-V55 HydrophobicContact CG2-CG2 4.28Å; I51-V55 WeakPolarHBondContact O-CB 3.44Å; I51-V55 WeakPolarHBondContact O-CG2 3.42Å; I51-V55 PolarHBondContact O-N 2.92Å; V55-G57 PolarHBondContact O-N 3.25Å; V55-W58 PolarHBondContact O-N 3.37Å; V55-I59 HydrophobicContact CG1-CD1 3.61Å; V55-I59 HydrophobicContact CG1-CG1 4.41Å; V55-I59 WeakPolarHBondContact O-CG1 3.39Å; V55-I59 PolarHBondContact O-N 3.01Å
56M79.8Confident75.5Confident113 Ų11389.1 Ų89.156%0.55747%0.47SS*.Hα-helixtrans-63.9-30.5172.4-168.4176.5-62.800111.8T52 W58 K60T52-M56 WeakPolarHBondContact O-CB 3.46Å; T52-M56 PolarHBondContact O-N 3.46Å; M56-W58 VanDerWaalsContact C-N 3.27Å; M56-W58 PolarHBondContact O-N 3.01Å; M56-K60 WeakPolarHBondContact O-CB 3.32Å; M56-K60 PolarHBondContact O-N 3.43Å
57G75.6Confident73.7Confident7 Ų789.9 Ų89.97%0.07247%0.474CS..Hα-helixtrans-77.90.5171.200000115.4F53 T54 V55 Y61F53-G57 WeakPolarHBondContact O-CA 3.36Å; F53-G57 PolarHBondContact O-N 2.88Å; T54-G57 CarbonylContact O-C 3.59Å; T54-G57 WeakPolarHBondContact O-CA 3.49Å; T54-G57 PolarHBondContact O-N 2.87Å; V55-G57 PolarHBondContact O-N 3.25Å; G57-Y61 WeakPolarHBondContact O-CD2 3.43Å; G57-Y61 WeakPolarHBondContact O-CE2 3.16Å
58W72.8Confident72.4Confident194 Ų19496 Ų9674%0.73550%0.5SS*.Hα-helixtrans-110.9-47.2176.4-150-69000110.5T54 V55 M56 K60T54-W58 HydrophobicContact CG2-CE3 4.32Å; T54-W58 WeakPolarHBondContact O-CB 3.47Å; T54-W58 PolarHBondContact O-N 3.49Å; V55-W58 PolarHBondContact O-N 3.37Å; M56-W58 VanDerWaalsContact C-N 3.27Å; M56-W58 PolarHBondContact O-N 3.01Å; W58-K60 PolarHBondContact O-N 3.44Å
59I67.9Low71.2Confident137 Ų137101.6 Ų101.670%0.70351%0.514SS*.Hα-helixtrans-70-32.3-178.3-55.6162.1000111.7V55 Y61V55-I59 HydrophobicContact CG1-CD1 3.61Å; V55-I59 HydrophobicContact CG1-CG1 4.41Å; V55-I59 WeakPolarHBondContact O-CG1 3.39Å; V55-I59 PolarHBondContact O-N 3.01Å; I59-Y61 VanDerWaalsContact C-N 3.31Å; I59-Y61 PolarHBondContact O-N 2.9Å
60K62.2Low70.1Confident152 Ų152101.3 Ų101.366%0.66151%0.513SS*.THydrogen-bonded Turntrans-85.97-172.7-160.4-179.3171.7-175.80114.3M56 W58M56-K60 WeakPolarHBondContact O-CB 3.32Å; M56-K60 PolarHBondContact O-N 3.43Å; W58-K60 PolarHBondContact O-N 3.44Å
61Y58.2Low69.1Low46 Ų46105.1 Ų105.118%0.1853%0.531CS..THydrogen-bonded Turntrans-106.86.3-161.7-88.6-112.2000115.8G57 I59 G63 L67 T70 Q71G57-Y61 WeakPolarHBondContact O-CD2 3.43Å; G57-Y61 WeakPolarHBondContact O-CE2 3.16Å; I59-Y61 VanDerWaalsContact C-N 3.31Å; I59-Y61 PolarHBondContact O-N 2.9Å; Y61-G63 PolarHBondContact O-N 3.37Å; Y61-L67 HydrophobicContact CE1-CB 4.08Å; Y61-L67 VanDerWaalsContact OH-CB 3.28Å; Y61-L67 WeakPolarHBondContact OH-CB 3.45Å; Y61-L67 PolarHBondContact OH-O 3.24Å; Y61-T70 PolarHBondContact OH-OG1 2.76Å; Y61-Q71 HydrophobicContact CE1-CB 3.8Å; Y61-Q71 HydrophobicContact CE1-CG 4.04Å; Y61-Q71 WeakPolarHBondContact OH-CB 3.39Å; Y61-Q71 PolarHBondContact OH-N 2.86Å; Y61-Q71 VanDerWaalsContact OH-N 3.14Å
62D56.1Low68.7Low173 Ų173106 Ų10693%0.92554%0.536SS*.SBendtrans-75.143.3-178.6-154.430.5000113.9
63G53.5Low68.4Low69 Ų69105 Ų10571%0.71153%0.526SS*.SBendtrans160.4-4.3171.600000120.3Y61Y61-G63 PolarHBondContact O-N 3.37Å
64I54.8Low68.5Low115 Ų115101.6 Ų101.659%0.5951%0.512SS*.  trans-131.1100.9-176.2-53.8-179.5000112.4H66I64-H66 HydrophobicContact CG2-CB 3.94Å; I64-H66 PolarHBondContact O-N 3.26Å; I64-H66 VanDerWaalsContact O-N 3.09Å
65T54.9Low68.6Low136 Ų136103.4 Ų103.483%0.83452%0.524SS*.  trans-68.1-2.2179.850.70000115.3L67T65-L67 PolarHBondContact O-N 3.13Å; T65-L67 VanDerWaalsContact O-N 3.16Å
66H53.2Low68.9Low171 Ų171104.3 Ų104.379%0.79253%0.525SS*.THydrogen-bonded Turntrans-83.115.2-171.2-151.6-61.6000114.3I64I64-H66 HydrophobicContact CG2-CB 3.94Å; I64-H66 PolarHBondContact O-N 3.26Å; I64-H66 VanDerWaalsContact O-N 3.09Å
67L55.6Low69.4Low61 Ų61101 Ų10132%0.31951%0.51SS..THydrogen-bonded Turntrans-131.78-166.3-73.5176.1000115.8Y61 T65 W69 T70 Q71Y61-L67 HydrophobicContact CE1-CB 4.08Å; Y61-L67 VanDerWaalsContact OH-CB 3.28Å; Y61-L67 WeakPolarHBondContact OH-CB 3.45Å; Y61-L67 PolarHBondContact OH-O 3.24Å; T65-L67 PolarHBondContact O-N 3.13Å; T65-L67 VanDerWaalsContact O-N 3.16Å; L67-W69 PolarHBondContact O-N 3.33Å; L67-T70 HydrophobicContact CD2-CG2 4.49Å; L67-T70 WeakPolarHBondContact O-CA 3.48Å; L67-T70 PolarHBondContact O-N 2.97Å; L67-T70 PolarHBondContact O-OG1 2.76Å; L67-Q71 PolarHBondContact O-N 3.14Å
68E65.6Low70.1Confident139 Ų139103.6 Ų103.665%0.6552%0.522SS*.Hα-helixtrans-42.6-40.2179.7-61.9-179.9122.300114.2T70 Q71 L72E68-T70 VanDerWaalsContact C-N 3.27Å; E68-T70 PolarHBondContact O-N 3.33Å; E68-Q71 WeakPolarHBondContact O-CB 3.17Å; E68-Q71 PolarHBondContact O-N 3.32Å; E68-Q71 VanDerWaalsContact O-N 3.13Å; E68-L72 WeakPolarHBondContact O-CB 3.34Å; E68-L72 WeakPolarHBondContact O-CG 3.39Å; E68-L72 PolarHBondContact O-N 3.01Å
69W65.8Low71Confident220 Ų22097.8 Ų97.883%0.83351%0.511SS*.Hα-helixtrans-58.3-34.1176.6-114.792.1000114.2L67 L73L67-W69 PolarHBondContact O-N 3.33Å; W69-L73 PolarHBondContact O-N 2.83Å
70T68.6Low72.2Confident50 Ų5094 Ų9431%0.30749%0.493SS..Hα-helixtrans-82.4-33.3174.760.80000111.9F53 Y61 L67 E68 L73F53-T70 VanDerWaalsContact CD1-O 3.31Å; F53-T70 WeakPolarHBondContact CD1-O 3.47Å; F53-T70 HydrophobicContact CE1-CG2 4.36Å; F53-T70 VanDerWaalsContact CE1-O 3.23Å; F53-T70 WeakPolarHBondContact CE1-O 3.45Å; F53-T70 HydrophobicContact CZ-CG2 4.48Å; Y61-T70 PolarHBondContact OH-OG1 2.76Å; L67-T70 HydrophobicContact CD2-CG2 4.49Å; L67-T70 WeakPolarHBondContact O-CA 3.48Å; L67-T70 PolarHBondContact O-N 2.97Å; L67-T70 PolarHBondContact O-OG1 2.76Å; E68-T70 VanDerWaalsContact C-N 3.27Å; E68-T70 PolarHBondContact O-N 3.33Å; T70-L73 PolarHBondContact O-N 3.26Å
71Q71.4Confident73.6Confident80 Ų8086.7 Ų86.737%0.37446%0.462SS..Hα-helixtrans-62.1-45.4173.1-157.5173.65.800111.2Y61 L67 E68 L73 G74 P75Y61-Q71 HydrophobicContact CE1-CB 3.8Å; Y61-Q71 HydrophobicContact CE1-CG 4.04Å; Y61-Q71 WeakPolarHBondContact OH-CB 3.39Å; Y61-Q71 PolarHBondContact OH-N 2.86Å; Y61-Q71 VanDerWaalsContact OH-N 3.14Å; L67-Q71 PolarHBondContact O-N 3.14Å; E68-Q71 WeakPolarHBondContact O-CB 3.17Å; E68-Q71 PolarHBondContact O-N 3.32Å; E68-Q71 VanDerWaalsContact O-N 3.13Å; Q71-L73 VanDerWaalsContact C-N 3.31Å; Q71-L73 PolarHBondContact O-N 3.21Å; Q71-G74 PolarHBondContact O-N 3.3Å; Q71-P75 WeakPolarHBondContact O-CD 3.33Å
72L80.7Confident75.2Confident105 Ų10587.6 Ų87.655%0.5547%0.472SS..Hα-helixtrans-64.3-31.4176.3-75.6163.7000113.1E68 G74 P75 I76E68-L72 WeakPolarHBondContact O-CB 3.34Å; E68-L72 WeakPolarHBondContact O-CG 3.39Å; E68-L72 PolarHBondContact O-N 3.01Å; L72-G74 VanDerWaalsContact C-N 3.27Å; L72-G74 PolarHBondContact O-N 3.44Å; L72-P75 WeakPolarHBondContact O-CD 3.41Å; L72-I76 HydrophobicContact CB-CD1 4.24Å; L72-I76 WeakPolarHBondContact O-CB 3.39Å; L72-I76 WeakPolarHBondContact O-CD1 3.46Å; L72-I76 WeakPolarHBondContact O-CG1 3.44Å; L72-I76 PolarHBondContact O-N 3.45Å; L72-I76 VanDerWaalsContact O-N 3.07Å
73L83.1Confident76.9Confident61 Ų6182.4 Ų82.432%0.31945%0.446SS..Hα-helixtrans-63.6-32.2-178-16965.9000112.5F53 W69 T70 Q71 L77F53-L73 HydrophobicContact CD1-CB 4.03Å; F53-L73 HydrophobicContact CD1-CD2 4.26Å; F53-L73 HydrophobicContact CD1-CG 4.38Å; F53-L73 HydrophobicContact CE1-CB 3.88Å; F53-L73 HydrophobicContact CE1-CD2 3.7Å; F53-L73 HydrophobicContact CE1-CG 4.21Å; F53-L73 HydrophobicContact CZ-CD2 3.89Å; W69-L73 PolarHBondContact O-N 2.83Å; T70-L73 PolarHBondContact O-N 3.26Å; Q71-L73 VanDerWaalsContact C-N 3.31Å; Q71-L73 PolarHBondContact O-N 3.21Å; L73-L77 HydrophobicContact CD1-CD1 4.43Å; L73-L77 HydrophobicContact CD1-CG 4.31Å; L73-L77 HydrophobicContact CD2-CD1 4.42Å; L73-L77 HydrophobicContact CG-CD1 3.92Å; L73-L77 HydrophobicContact CG-CG 4.24Å; L73-L77 WeakPolarHBondContact O-CB 3.31Å; L73-L77 VanDerWaalsContact O-CG 3.26Å; L73-L77 WeakPolarHBondContact O-CG 3.35Å; L73-L77 PolarHBondContact O-N 3.25Å
74G87.8Confident78.6Confident0 Ų082.6 Ų82.60%043%0.428CS..Hα-helixtrans-59.9-62.1175.900000112.9T54 Q71 L72 I76 L77 L78T54-G74 VanDerWaalsContact OG1-CA 3.27Å; T54-G74 WeakPolarHBondContact OG1-CA 3.37Å; Q71-G74 PolarHBondContact O-N 3.3Å; L72-G74 VanDerWaalsContact C-N 3.27Å; L72-G74 PolarHBondContact O-N 3.44Å; G74-I76 VanDerWaalsContact C-N 3.29Å; G74-I76 PolarHBondContact O-N 2.84Å; G74-L77 PolarHBondContact O-N 3.03Å; G74-L78 WeakPolarHBondContact O-CB 3.22Å; G74-L78 PolarHBondContact O-N 3.45Å
75P87.8Confident80.3Confident67 Ų6779.6 Ų79.644%0.43541%0.412SS..Hα-helixtrans-58.8-33.4174.7-28.137.2000114.3Q71 L72 S79Q71-P75 WeakPolarHBondContact O-CD 3.33Å; L72-P75 WeakPolarHBondContact O-CD 3.41Å; P75-S79 VanDerWaalsContact O-CB 3.25Å; P75-S79 WeakPolarHBondContact O-CB 3.4Å; P75-S79 PolarHBondContact O-N 3.35Å
76I91Very high81.9Confident94 Ų9477.6 Ų77.648%0.48240%0.396SS..Hα-helixtrans-64.8-50.2174.6-70.2166.4000110.6L72 G74 L78 S79 V80L72-I76 HydrophobicContact CB-CD1 4.24Å; L72-I76 WeakPolarHBondContact O-CB 3.39Å; L72-I76 WeakPolarHBondContact O-CD1 3.46Å; L72-I76 WeakPolarHBondContact O-CG1 3.44Å; L72-I76 PolarHBondContact O-N 3.45Å; L72-I76 VanDerWaalsContact O-N 3.07Å; G74-I76 VanDerWaalsContact C-N 3.29Å; G74-I76 PolarHBondContact O-N 2.84Å; I76-L78 VanDerWaalsContact C-N 3.31Å; I76-L78 PolarHBondContact O-N 2.85Å; I76-S79 PolarHBondContact O-N 2.94Å; I76-V80 WeakPolarHBondContact O-CG2 3.3Å; I76-V80 PolarHBondContact O-N 2.92Å
77L89.9Confident83.5Confident44 Ų4474 Ų7423%0.2338%0.382CS..Hα-helixtrans-63.6-36.9177.3-72.4172.8000112.2V49 L73 G74 G81V49-L77 HydrophobicContact CG1-CD1 4.17Å; L73-L77 HydrophobicContact CD1-CD1 4.43Å; L73-L77 HydrophobicContact CD1-CG 4.31Å; L73-L77 HydrophobicContact CD2-CD1 4.42Å; L73-L77 HydrophobicContact CG-CD1 3.92Å; L73-L77 HydrophobicContact CG-CG 4.24Å; L73-L77 WeakPolarHBondContact O-CB 3.31Å; L73-L77 VanDerWaalsContact O-CG 3.26Å; L73-L77 WeakPolarHBondContact O-CG 3.35Å; L73-L77 PolarHBondContact O-N 3.25Å; G74-L77 PolarHBondContact O-N 3.03Å; L77-G81 PolarHBondContact O-N 3.03Å
78L91.1Very high84.9Confident62 Ų6271.2 Ų71.233%0.32537%0.368SS..Hα-helixtrans-63.6-49.2175.1-161.1170.2000110.8I51 G74 I76 V80 G81 V82I51-L78 HydrophobicContact CG1-CD1 4.14Å; I51-L78 HydrophobicContact CG1-CG 4.46Å; G74-L78 WeakPolarHBondContact O-CB 3.22Å; G74-L78 PolarHBondContact O-N 3.45Å; I76-L78 VanDerWaalsContact C-N 3.31Å; I76-L78 PolarHBondContact O-N 2.85Å; L78-V80 PolarHBondContact O-N 3.35Å; L78-G81 PolarHBondContact O-N 3.29Å; L78-V82 HydrophobicContact CD2-CG2 3.8Å; L78-V82 WeakPolarHBondContact O-CB 3.5Å; L78-V82 WeakPolarHBondContact O-CG2 3.38Å; L78-V82 PolarHBondContact O-N 3.33Å
79S91.1Very high85.8Confident72 Ų7268.1 Ų68.150%0.50336%0.358SS..Hα-helixtrans-60.5-43.1177.2-177.50000112.5P75 I76 T83P75-S79 VanDerWaalsContact O-CB 3.25Å; P75-S79 WeakPolarHBondContact O-CB 3.4Å; P75-S79 PolarHBondContact O-N 3.35Å; I76-S79 PolarHBondContact O-N 2.94Å; S79-T83 WeakPolarHBondContact O-CB 3.36Å; S79-T83 WeakPolarHBondContact O-CG2 3.42Å; S79-T83 PolarHBondContact O-N 3.49Å; S79-T83 PolarHBondContact O-OG1 2.86Å
80V92.9Very high86.3Confident56 Ų5661.2 Ų61.234%0.33934%0.343SS..Hα-helixtrans-66-43.6174.5176.60000110.9L46 I76 L78 T83 F84L46-V80 HydrophobicContact CD2-CB 4.35Å; L46-V80 HydrophobicContact CD2-CG1 3.67Å; I76-V80 WeakPolarHBondContact O-CG2 3.3Å; I76-V80 PolarHBondContact O-N 2.92Å; L78-V80 PolarHBondContact O-N 3.35Å; V80-T83 WeakPolarHBondContact CA-OG1 3.34Å; V80-T83 PolarHBondContact O-N 3.29Å; V80-T83 PolarHBondContact O-OG1 2.85Å; V80-F84 HydrophobicContact CG1-CD2 3.76Å; V80-F84 HydrophobicContact CG1-CE2 3.66Å; V80-F84 VanDerWaalsContact O-CD2 3.26Å; V80-F84 WeakPolarHBondContact O-CD2 3.26Å; V80-F84 PolarHBondContact O-N 2.94Å
81G92.8Very high86.8Confident0 Ų064 Ų640%035%0.35CS..Hα-helixtrans-59.8-46.4175.800000113.2G43 L77 L78 F84 I85G43-G81 WeakPolarHBondContact CA-O 3.48Å; G43-G81 WeakPolarHBondContact O-CA 3.46Å; L77-G81 PolarHBondContact O-N 3.03Å; L78-G81 PolarHBondContact O-N 3.29Å; G81-F84 WeakPolarHBondContact O-CB 3.44Å; G81-F84 PolarHBondContact O-N 2.89Å; G81-I85 WeakPolarHBondContact O-CG1 3.28Å; G81-I85 PolarHBondContact O-N 2.8Å
82V91.6Very high86.6Confident64 Ų6466.2 Ų66.239%0.38836%0.359SS..Hα-helixtrans-65-40.8176.7168.30000111.5L78 I85 L86L78-V82 HydrophobicContact CD2-CG2 3.8Å; L78-V82 WeakPolarHBondContact O-CB 3.5Å; L78-V82 WeakPolarHBondContact O-CG2 3.38Å; L78-V82 PolarHBondContact O-N 3.33Å; V82-I85 PolarHBondContact O-N 2.93Å; V82-L86 HydrophobicContact CG1-CD1 3.88Å; V82-L86 HydrophobicContact CG1-CG 4.25Å; V82-L86 WeakPolarHBondContact O-CB 3.47Å; V82-L86 WeakPolarHBondContact O-CG 3.42Å; V82-L86 PolarHBondContact O-N 2.91Å
83T90.9Very high86Confident64 Ų6467 Ų6739%0.39336%0.359SS..Hα-helixtrans-67.6-34.2175.448.50000112.5S79 V80 L86 I87S79-T83 WeakPolarHBondContact O-CB 3.36Å; S79-T83 WeakPolarHBondContact O-CG2 3.42Å; S79-T83 PolarHBondContact O-N 3.49Å; S79-T83 PolarHBondContact O-OG1 2.86Å; V80-T83 WeakPolarHBondContact CA-OG1 3.34Å; V80-T83 PolarHBondContact O-N 3.29Å; V80-T83 PolarHBondContact O-OG1 2.85Å; T83-L86 PolarHBondContact O-N 3.27Å; T83-I87 WeakPolarHBondContact O-CB 3.48Å; T83-I87 WeakPolarHBondContact O-CD1 3.36Å; T83-I87 WeakPolarHBondContact O-CG1 3.21Å; T83-I87 PolarHBondContact O-N 2.84Å
84F90.5Very high85.1Confident73 Ų7371 Ų7132%0.3238%0.378SS..Hα-helixtrans-60.8-45.6168.5-90.5-70.7000112.5L39 L46 V80 G81 I87 A88L39-F84 HydrophobicContact CD2-CD1 3.83Å; L39-F84 HydrophobicContact CD2-CE1 3.87Å; L46-F84 HydrophobicContact CD2-CD2 4.2Å; L46-F84 HydrophobicContact CD2-CE2 4.29Å; V80-F84 HydrophobicContact CG1-CD2 3.76Å; V80-F84 HydrophobicContact CG1-CE2 3.66Å; V80-F84 VanDerWaalsContact O-CD2 3.26Å; V80-F84 WeakPolarHBondContact O-CD2 3.26Å; V80-F84 PolarHBondContact O-N 2.94Å; G81-F84 WeakPolarHBondContact O-CB 3.44Å; G81-F84 PolarHBondContact O-N 2.89Å; F84-I87 PolarHBondContact O-N 3.46Å; F84-A88 WeakPolarHBondContact O-CB 3.47Å; F84-A88 PolarHBondContact O-N 3.23Å
85I89.3Confident83.5Confident52 Ų5274.4 Ų74.427%0.26740%0.396SS..Hα-helixtrans-61.6-48.7176-65.3167.1000110.2L40 V44 G81 V82 I87 A88 V89L40-I85 HydrophobicContact CD2-CG2 4.17Å; V44-I85 HydrophobicContact CG2-CD1 3.99Å; V44-I85 HydrophobicContact CG2-CG1 4.39Å; G81-I85 WeakPolarHBondContact O-CG1 3.28Å; G81-I85 PolarHBondContact O-N 2.8Å; V82-I85 PolarHBondContact O-N 2.93Å; I85-I87 PolarHBondContact O-N 3Å; I85-A88 PolarHBondContact O-N 3.35Å; I85-V89 HydrophobicContact CG2-CG2 4.21Å; I85-V89 WeakPolarHBondContact O-CG2 3.39Å; I85-V89 PolarHBondContact O-N 2.72Å
86L89.3Confident82.1Confident95 Ų9574 Ų7450%0.49739%0.393SS..Hα-helixtrans-62-41.7178.9-72173.1000112.1V82 T83 A88 V89 C90V82-L86 HydrophobicContact CG1-CD1 3.88Å; V82-L86 HydrophobicContact CG1-CG 4.25Å; V82-L86 WeakPolarHBondContact O-CB 3.47Å; V82-L86 WeakPolarHBondContact O-CG 3.42Å; V82-L86 PolarHBondContact O-N 2.91Å; T83-L86 PolarHBondContact O-N 3.27Å; L86-A88 VanDerWaalsContact C-N 3.32Å; L86-A88 PolarHBondContact O-N 2.94Å; L86-V89 PolarHBondContact O-N 3.13Å; L86-C90 WeakPolarHBondContact O-CB 3.45Å; L86-C90 PolarHBondContact O-N 2.83Å; L86-C90 PolarHBondContact O-SG 3.44Å
87I87.2Confident80.2Confident96 Ų9673.4 Ų73.449%0.49240%0.396SS..Hα-helixtrans-62.7-41175.9-72.2163.6000110.7T83 F84 I85 K91T83-I87 WeakPolarHBondContact O-CB 3.48Å; T83-I87 WeakPolarHBondContact O-CD1 3.36Å; T83-I87 WeakPolarHBondContact O-CG1 3.21Å; T83-I87 PolarHBondContact O-N 2.84Å; F84-I87 PolarHBondContact O-N 3.46Å; I85-I87 PolarHBondContact O-N 3Å; I87-K91 WeakPolarHBondContact O-CG 3.36Å; I87-K91 PolarHBondContact O-N 2.84Å
88A85.4Confident78.5Confident2 Ų278.4 Ų78.42%0.01742%0.416CS..Hα-helixtrans-68.9-44177.700000112.5L39 L40 F84 I85 L86 K91 F92L39-A88 HydrophobicContact CB-CB 3.82Å; L40-A88 HydrophobicContact CD2-CB 3.7Å; L40-A88 HydrophobicContact CG-CB 3.71Å; F84-A88 WeakPolarHBondContact O-CB 3.47Å; F84-A88 PolarHBondContact O-N 3.23Å; I85-A88 PolarHBondContact O-N 3.35Å; L86-A88 VanDerWaalsContact C-N 3.32Å; L86-A88 PolarHBondContact O-N 2.94Å; A88-K91 PolarHBondContact O-N 2.81Å; A88-F92 WeakPolarHBondContact O-CB 3.27Å; A88-F92 PolarHBondContact O-N 3.3Å
89V82.6Confident76.6Confident73 Ų7378.8 Ų78.844%0.44242%0.423SS..Hα-helixtrans-66.4-39.1175.4174.80000111.4L40 I85 L86 F92 H93L40-V89 HydrophobicContact CD2-CG2 3.99Å; I85-V89 HydrophobicContact CG2-CG2 4.21Å; I85-V89 WeakPolarHBondContact O-CG2 3.39Å; I85-V89 PolarHBondContact O-N 2.72Å; L86-V89 PolarHBondContact O-N 3.13Å; V89-F92 CarbonylContact O-C 3.52Å; V89-F92 PolarHBondContact O-N 3.33Å; V89-H93 WeakPolarHBondContact O-CB 3.43Å; V89-H93 PolarHBondContact O-N 2.8Å
90C77.7Confident74.6Confident76 Ų7679.8 Ų79.851%0.51443%0.43SS..Hα-helixtrans-66.3-40.1174.4-74.30000111.8L86 H93 M94L86-C90 WeakPolarHBondContact O-CB 3.45Å; L86-C90 PolarHBondContact O-N 2.83Å; L86-C90 PolarHBondContact O-SG 3.44Å; C90-H93 PolarHBondContact O-N 2.95Å; C90-M94 WeakPolarHBondContact O-CB 3.01Å; C90-M94 WeakPolarHBondContact O-CG 3.33Å; C90-M94 PolarHBondContact O-N 3.43Å
91K77.9Confident72.5Confident107 Ų10783.8 Ų83.847%0.46544%0.443SS..Hα-helixtrans-60-46.5169-80-168.879.7760110.9I87 A88 H93 M94 L95I87-K91 WeakPolarHBondContact O-CG 3.36Å; I87-K91 PolarHBondContact O-N 2.84Å; A88-K91 PolarHBondContact O-N 2.81Å; K91-H93 PolarHBondContact O-N 2.83Å; K91-M94 PolarHBondContact O-N 3.19Å; K91-L95 WeakPolarHBondContact O-CB 3.31Å; K91-L95 VanDerWaalsContact O-CG 3.24Å; K91-L95 WeakPolarHBondContact O-CG 3.26Å; K91-L95 PolarHBondContact O-N 3.13Å
92F68.1Low70.3Confident128 Ų12888.9 Ų88.956%0.56147%0.466SS*.Hα-helixtrans-61.7-42.3179.5-169.6-99.3000112A88 V89 L95 T96A88-F92 WeakPolarHBondContact O-CB 3.27Å; A88-F92 PolarHBondContact O-N 3.3Å; V89-F92 CarbonylContact O-C 3.52Å; V89-F92 PolarHBondContact O-N 3.33Å; F92-L95 CarbonylContact O-C 3.22Å; F92-L95 WeakPolarHBondContact O-CA 3.13Å; F92-L95 WeakPolarHBondContact O-CB 3.35Å; F92-L95 PolarHBondContact O-N 3.39Å; F92-L95 VanDerWaalsContact O-N 3.16Å; F92-T96 HydrophobicContact CD1-CG2 4.19Å; F92-T96 HydrophobicContact CE1-CG2 3.86Å; F92-T96 HydrophobicContact CZ-CG2 4.28Å; F92-T96 PolarHBondContact O-N 2.83Å; F92-T96 PolarHBondContact O-OG1 3.48Å
93H67.9Low68.1Low120 Ų12094.7 Ų94.756%0.55648%0.481SS*.Hα-helixtrans-70.3-34.9177.5-165.3-67.6000112.7V89 C90 K91 L95 T96 C97V89-H93 WeakPolarHBondContact O-CB 3.43Å; V89-H93 PolarHBondContact O-N 2.8Å; C90-H93 PolarHBondContact O-N 2.95Å; K91-H93 PolarHBondContact O-N 2.83Å; H93-L95 VanDerWaalsContact C-N 3.31Å; H93-T96 WeakPolarHBondContact CA-OG1 3.33Å; H93-T96 PolarHBondContact O-OG1 3Å; H93-C97 PolarHBondContact O-N 3.18Å; H93-C97 VanDerWaalsContact O-N 3.16Å; H93-C97 PolarHBondContact O-SG 2.83Å; H93-C97 VanDerWaalsContact O-SG 3.35Å
94M64.3Low65.9Low145 Ų14597.3 Ų97.371%0.71449%0.493SS*.Hα-helixtrans-66.4-35.8168.9-72.5-165.581.800111.6C90 K91 K98C90-M94 WeakPolarHBondContact O-CB 3.01Å; C90-M94 WeakPolarHBondContact O-CG 3.33Å; C90-M94 PolarHBondContact O-N 3.43Å; K91-M94 PolarHBondContact O-N 3.19Å; M94-K98 WeakPolarHBondContact O-CB 3.25Å; M94-K98 PolarHBondContact O-N 3.23Å
95L55Low63.8Low72 Ų7298.9 Ų98.938%0.37750%0.501SS..Hα-helixtrans-69.2-39.6175.6-73.9167.4000112K91 F92 H93 K98 S99K91-L95 WeakPolarHBondContact O-CB 3.31Å; K91-L95 VanDerWaalsContact O-CG 3.24Å; K91-L95 WeakPolarHBondContact O-CG 3.26Å; K91-L95 PolarHBondContact O-N 3.13Å; F92-L95 CarbonylContact O-C 3.22Å; F92-L95 WeakPolarHBondContact O-CA 3.13Å; F92-L95 WeakPolarHBondContact O-CB 3.35Å; F92-L95 PolarHBondContact O-N 3.39Å; F92-L95 VanDerWaalsContact O-N 3.16Å; H93-L95 VanDerWaalsContact C-N 3.31Å; L95-K98 PolarHBondContact O-N 2.66Å; L95-S99 WeakPolarHBondContact O-CA 3.38Å; L95-S99 WeakPolarHBondContact O-CB 3.08Å; L95-S99 PolarHBondContact O-N 3.43Å
96T58.2Low61.6Low59 Ų59101.6 Ų101.636%0.36252%0.516SS..Hα-helixtrans-64.7-43.1174.553.40000111.4F92 H93 K98 C100F92-T96 HydrophobicContact CD1-CG2 4.19Å; F92-T96 HydrophobicContact CE1-CG2 3.86Å; F92-T96 HydrophobicContact CZ-CG2 4.28Å; F92-T96 PolarHBondContact O-N 2.83Å; F92-T96 PolarHBondContact O-OG1 3.48Å; H93-T96 WeakPolarHBondContact CA-OG1 3.33Å; H93-T96 PolarHBondContact O-OG1 3Å; T96-K98 PolarHBondContact O-N 3.01Å; T96-C100 PolarHBondContact O-N 2.94Å; T96-C100 PolarHBondContact O-SG 2.96Å
97C51.3Low59.2Low81 Ų8199.9 Ų99.955%0.54752%0.516SS..Hα-helixtrans-63.6-37.1174.6-670000113.3H93H93-C97 PolarHBondContact O-N 3.18Å; H93-C97 VanDerWaalsContact O-N 3.16Å; H93-C97 PolarHBondContact O-SG 2.83Å; H93-C97 VanDerWaalsContact O-SG 3.35Å
98K54.3Low57.1Low149 Ų14999.8 Ų99.865%0.64852%0.524SS*.Hα-helixtrans-77-40.4176.1-105.9-164.7167.5-157.10113.4M94 L95 T96 C100 K101 E102M94-K98 WeakPolarHBondContact O-CB 3.25Å; M94-K98 PolarHBondContact O-N 3.23Å; L95-K98 PolarHBondContact O-N 2.66Å; T96-K98 PolarHBondContact O-N 3.01Å; K98-C100 VanDerWaalsContact C-N 3.26Å; K98-C100 PolarHBondContact O-N 3.24Å; K98-K101 WeakPolarHBondContact O-CA 3.36Å; K98-K101 WeakPolarHBondContact O-CB 3.42Å; K98-K101 PolarHBondContact O-N 3.34Å; K98-E102 PolarHBondContact O-N 2.9Å
99S50.6Low55.1Low70 Ų70107 Ų10749%0.4956%0.562SS.*Hα-helixtrans-62.6-33.6-178.9-178.50000111.5L95 K101 E102 R103L95-S99 WeakPolarHBondContact O-CA 3.38Å; L95-S99 WeakPolarHBondContact O-CB 3.08Å; L95-S99 PolarHBondContact O-N 3.43Å; S99-K101 VanDerWaalsContact C-N 3.26Å; S99-K101 PolarHBondContact O-N 2.88Å; S99-E102 PolarHBondContact O-N 3.33Å; S99-R103 VanDerWaalsContact O-CB 3.23Å; S99-R103 WeakPolarHBondContact O-CB 3.46Å; S99-R103 PolarHBondContact O-N 3.07Å
100C48.8Very low53.4Low94 Ų94110.4 Ų110.464%0.63558%0.576SS**Hα-helixtrans-59.2-34.3169.8-700000113.4T96 K98T96-C100 PolarHBondContact O-N 2.94Å; T96-C100 PolarHBondContact O-SG 2.96Å; K98-C100 VanDerWaalsContact C-N 3.26Å; K98-C100 PolarHBondContact O-N 3.24Å
101K48.3Very low51.4Low140 Ų140114.5 Ų114.561%0.60959%0.593SS**Hα-helixtrans-79.5-43.3174.5174.8172.3175170.30112.1K98 S99 R103 D104 E105K98-K101 WeakPolarHBondContact O-CA 3.36Å; K98-K101 WeakPolarHBondContact O-CB 3.42Å; K98-K101 PolarHBondContact O-N 3.34Å; S99-K101 VanDerWaalsContact C-N 3.26Å; S99-K101 PolarHBondContact O-N 2.88Å; K101-R103 VanDerWaalsContact C-N 3.26Å; K101-R103 PolarHBondContact O-N 3.35Å; K101-D104 WeakPolarHBondContact O-CB 3.47Å; K101-D104 PolarHBondContact O-N 3.4Å; K101-E105 PolarHBondContact O-N 2.9Å; K101-E105 VanDerWaalsContact O-N 3.17Å
102E48Very low49.4Very low107 Ų107118 Ų11850%0.561%0.611SS.*Hα-helixtrans-65.8-30.9-178.9-161.3169.3128.400111.8K98 S99 D104 E105 N106K98-E102 PolarHBondContact O-N 2.9Å; S99-E102 PolarHBondContact O-N 3.33Å; E102-D104 VanDerWaalsContact C-N 3.34Å; E102-E105 WeakPolarHBondContact CA-OE1 3.38Å; E102-N106 WeakPolarHBondContact O-CB 3.44Å; E102-N106 PolarHBondContact O-N 3.04Å; E102-N106 VanDerWaalsContact O-N 3.13Å; E102-N106 PolarHBondContact O-ND2 3.21Å
103R44.3Very low47.9Very low186 Ų186120.4 Ų120.470%0.70263%0.626SS**Hα-helixtrans-72.1-25172.6-159.6-175.679.991.74.7113.3S99 K101 A107S99-R103 VanDerWaalsContact O-CB 3.23Å; S99-R103 WeakPolarHBondContact O-CB 3.46Å; S99-R103 PolarHBondContact O-N 3.07Å; K101-R103 VanDerWaalsContact C-N 3.26Å; K101-R103 PolarHBondContact O-N 3.35Å; R103-A107 VanDerWaalsContact O-CB 3.23Å; R103-A107 WeakPolarHBondContact O-CB 3.19Å; R103-A107 PolarHBondContact O-N 2.83Å
104D44.4Very low46.6Very low119 Ų119119.4 Ų119.464%0.63664%0.639SS**Hα-helixtrans-76.3-47.6177.4-130.522.1000109.9K101 E102 N106 A107 S108K101-D104 WeakPolarHBondContact O-CB 3.47Å; K101-D104 PolarHBondContact O-N 3.4Å; E102-D104 VanDerWaalsContact C-N 3.34Å; D104-N106 PolarHBondContact O-N 2.91Å; D104-A107 PolarHBondContact O-N 2.86Å; D104-S108 PolarHBondContact O-N 3.29Å; D104-S108 PolarHBondContact O-OG 3.47Å
105E47.4Very low45.3Very low105 Ų105118.6 Ų118.649%0.49165%0.647SS.*Hα-helixtrans-71.5-29-18066-156.8167.400113.6K101 E102 S108K101-E105 PolarHBondContact O-N 2.9Å; K101-E105 VanDerWaalsContact O-N 3.17Å; E102-E105 WeakPolarHBondContact CA-OE1 3.38Å; E105-S108 PolarHBondContact O-OG 3.42Å
106N41.6Very low44.7Very low109 Ų109118.9 Ų118.958%0.58367%0.667SS**THydrogen-bonded Turntrans-83.9-12.7172-73.6-85.5000114.3E102 D104E102-N106 WeakPolarHBondContact O-CB 3.44Å; E102-N106 PolarHBondContact O-N 3.04Å; E102-N106 VanDerWaalsContact O-N 3.13Å; E102-N106 PolarHBondContact O-ND2 3.21Å; D104-N106 PolarHBondContact O-N 2.91Å
107A39.1Very low44.3Very low59 Ų59125.6 Ų125.649%0.48870%0.695SS.*THydrogen-bonded Turntrans-81.3-29.8171.600000112.1R103 D104 D109R103-A107 VanDerWaalsContact O-CB 3.23Å; R103-A107 WeakPolarHBondContact O-CB 3.19Å; R103-A107 PolarHBondContact O-N 2.83Å; D104-A107 PolarHBondContact O-N 2.86Å; A107-D109 VanDerWaalsContact C-N 3.25Å; A107-D109 PolarHBondContact O-N 3.06Å
108S44.6Very low43.8Very low95 Ų95127.8 Ų127.866%0.66471%0.711SS**THydrogen-bonded Turntrans-71.9-3.1-174.742.30000116.8D104 E105D104-S108 PolarHBondContact O-N 3.29Å; D104-S108 PolarHBondContact O-OG 3.47Å; E105-S108 PolarHBondContact O-OG 3.42Å
109D42.3Very low43Very low152 Ų152128.7 Ų128.781%0.81372%0.715SS**THydrogen-bonded Turntrans-114.78.4-178.1-146.416.9000113.6A107A107-D109 VanDerWaalsContact C-N 3.25Å; A107-D109 PolarHBondContact O-N 3.06Å
110I46.3Very low42.6Very low146 Ų146129.6 Ų129.675%0.74972%0.718SS**  trans-128.953.8173.9-42.2-176.1000111.1
111D35.7Very low42.3Very low161 Ų161134 Ų13486%0.86173%0.726SS**  trans-129.165.2162.8-119.1-35.5000110.7M113D111-M113 PolarHBondContact O-N 3.47Å
112Q36.6Very low42.4Very low182 Ų182133.7 Ų133.785%0.8574%0.736SS**  trans-74.9111.4178.6177.8173.496.300111.2
113M36Very low42.3Very low177 Ų177132.1 Ų132.187%0.87275%0.749SS**  trans64.773.3144.2-169.4177.4159.400117.2D111D111-M113 PolarHBondContact O-N 3.47Å
114A41.8Very low43Very low99 Ų99130.6 Ų130.682%0.81875%0.753SS**  trans-143123163.500000115.1
115S37.5Very low43.3Very low129 Ų129131.8 Ų131.890%0.90276%0.759SS**  trans55.984.6152.6-160.70000119.9
116G40.9Very low43.4Very low77 Ų77135.8 Ų135.879%0.79478%0.778SS**  trans-152.884.2163.100000112.1S118G116-S118 PolarHBondContact O-N 3.32Å
117Q50.4Low43.5Very low201 Ų201136 Ų13694%0.93979%0.786SS**  trans-73.1118.3-177-69-177.8-93.200112.3
118S39.9Very low44.2Very low127 Ų127140.7 Ų140.789%0.88880%0.8SS**  trans-149156.3151.7-163.30000111.6G116G116-S118 PolarHBondContact O-N 3.32Å
119F38.3Very low44Very low168 Ų168142.5 Ų142.574%0.73781%0.808SS**  trans-98.3129.6-156.3165.7-88.7000113.5
120V41.3Very low44Very low89 Ų89143.5 Ų143.554%0.53981%0.805SS.*  trans29.1117.3142.6-179.20000117.9
121F44.1Very low43.9Very low187 Ų187145 Ų14582%0.8281%0.809SS**  -149134.5106.4-125.6-84.2000113.2G123F121-G123 PolarHBondContact O-N 2.88Å
122T50.7Low44.8Very low132 Ų132141.7 Ų141.781%0.8181%0.813SS**  trans-73.4117.1172.226.80000110.4
123G45.3Very low45.4Very low74 Ų74137 Ų13776%0.76381%0.805SS**  trans-162.2109.517600000111.2F121F121-G123 PolarHBondContact O-N 2.88Å
124I59.6Low46.2Very low154 Ų154135.2 Ų135.279%0.7980%0.804SS**  trans-78.9146.4-177.249169.8000112.6
125N49.1Very low46.4Very low145 Ų145136.6 Ų136.678%0.77580%0.802SS**  trans73.3109.8174.1-41.6-79.8000116.9
126Q50Low47.1Very low188 Ų188136.5 Ų136.588%0.87980%0.796SS**  -154.7155.5118.4-107-172.2-1.400110.5
127P43.3Very low47.5Very low115 Ų115140.5 Ų140.575%0.74779%0.794SS**PPolyproline II helixtrans-86.7165.1-171.235.2-35.5000113.8
128I53.7Low47.2Very low156 Ų156139.7 Ų139.780%0.878%0.783SS**PPolyproline II helixtrans-59131.6-179.9-61.9159.5000111.6F130I128-F130 HydrophobicContact CG2-CD2 3.97Å
129T40.6Very low47.7Very low134 Ų134140.3 Ų140.382%0.82278%0.775SS**PPolyproline II helixtrans-85.1118.9169.130.40000111.7
130F42Very low48.1Very low173 Ų173136.3 Ų136.376%0.75977%0.766SS**  trans-132.4134.9162.6-108.3-100000110.3I128I128-F130 HydrophobicContact CG2-CD2 3.97Å
131H44.4Very low48.3Very low178 Ų178136.9 Ų136.982%0.82477%0.771SS**SBendtrans28.997166-76.7-103.5000119.2A133H131-A133 PolarHBondContact O-N 3.36Å
132G55.2Low48.6Very low91 Ų91133.5 Ų133.594%0.93877%0.768SS**SBendtrans88.1-0.7136.200000119.3
133A50.1Low48.1Very low83 Ų83137.3 Ų137.369%0.68677%0.77SS**  trans-131.181.8179.600000113.1H131 V135H131-A133 PolarHBondContact O-N 3.36Å; A133-V135 PolarHBondContact O-N 3.13Å
134T52.5Low48.1Very low139 Ų139139.7 Ų139.785%0.85377%0.771SS**  trans-76.482.7174.648.20000112.1V136T134-V136 PolarHBondContact O-N 3.14Å
135V45.3Very low47.2Very low128 Ų128136.8 Ų136.878%0.77677%0.771SS**  trans-76.2105.8162.1-1790000108.1A133 Q137A133-V135 PolarHBondContact O-N 3.13Å; V135-Q137 VanDerWaalsContact C-N 3.27Å; V135-Q137 PolarHBondContact O-N 3.25Å
136V51.6Low46.6Very low127 Ų127137.3 Ų137.377%0.7777%0.768SS**  trans-73.784.3172.6-178.20000108.6T134 Y138T134-V136 PolarHBondContact O-N 3.14Å; V136-Y138 PolarHBondContact O-N 2.78Å
137Q49.4Very low46.2Very low161 Ų161136 Ų13675%0.75276%0.762SS**  trans-74.482.6171.3-169.3165.626.300109.3V135 I139V135-Q137 VanDerWaalsContact C-N 3.27Å; V135-Q137 PolarHBondContact O-N 3.25Å; Q137-I139 HydrophobicContact CG-CG1 4.49Å; Q137-I139 PolarHBondContact O-N 2.81Å
138Y45.1Very low45.8Very low185 Ų185134 Ų13473%0.72576%0.762SS**  trans-65.1104.4173.7-174.8-95.9000109.5V136 P140V136-Y138 PolarHBondContact O-N 2.78Å; Y138-P140 HydrophobicContact CD1-CB 4.49Å; Y138-P140 HydrophobicContact CE1-CB 4.07Å; Y138-P140 VanDerWaalsContact O-CD 3.24Å; Y138-P140 WeakPolarHBondContact O-CD 3.48Å
139I50.4Low45Very low140 Ų140134.5 Ų134.572%0.71877%0.765SS**  trans-88.1106.3172-58.5174.1000107Q137Q137-I139 HydrophobicContact CG-CG1 4.49Å; Q137-I139 PolarHBondContact O-N 2.81Å
140P45.6Very low44.9Very low84 Ų84132.5 Ų132.555%0.54576%0.762SS.*  trans-68139.8176.128.5-34.3000110.5Y138Y138-P140 HydrophobicContact CD1-CB 4.49Å; Y138-P140 HydrophobicContact CE1-CB 4.07Å; Y138-P140 VanDerWaalsContact O-CD 3.24Å; Y138-P140 WeakPolarHBondContact O-CD 3.48Å
141P47.2Very low44.7Very low100 Ų100131.1 Ų131.165%0.64977%0.768SS**  trans-68.2135.2178.727.1-33.9000111.5Y143P141-Y143 PolarHBondContact O-N 3.28Å
142P50.4Low44.4Very low116 Ų116129.8 Ų129.875%0.75377%0.767SS**  trans-9097.9-172.334-34.4000112.8
143Y39.6Very low44.5Very low213 Ų213131.1 Ų131.184%0.83576%0.758SS**  trans-137.2164.7174.8-80.2-62.4000112.3P141P141-Y143 PolarHBondContact O-N 3.28Å
144P43.9Very low43.7Very low123 Ų123132 Ų13280%0.79977%0.765SS**  trans-93.8-179.8-134.137.4-39.2000115.4
145A42.5Very low43.2Very low94 Ų94135.1 Ų135.178%0.77776%0.763SS**  trans-57139.9-174.600000115.3
146Q35.5Very low42.8Very low155 Ų155138.7 Ų138.772%0.72477%0.769SS**  -157.5163.9103.7-137.5161.7-86.600112.3
147E41Very low42.3Very low161 Ų161141 Ų14175%0.75277%0.771SS**  trans10.4142.4162.966.3-129.2151.200124.3
148G35.9Very low42Very low73 Ų73138.6 Ų138.675%0.75377%0.769SS**  trans147.765.7150.600000122.7
149I37.5Very low41.7Very low167 Ų167135.7 Ų135.786%0.85677%0.77SS**  trans47.495.9139.1-55.5177.4000120.7
150A38.6Very low41.4Very low92 Ų92136.7 Ų136.776%0.7678%0.776SS**  77.6156.7119.300000126.5
151V36.1Very low40.9Very low144 Ų144137.4 Ų137.487%0.87378%0.783SS**  trans103.1126.9157.3-167.10000119.5
152N39.5Very low40.3Very low150 Ų150138.1 Ų138.180%0.80279%0.789SS**  trans-58167.1-170.3-88.9-68.9000120
153P56.5Low39.9Very low118 Ų118138.9 Ų138.977%0.76680%0.796SS**  trans-89.5171.917039-36.1000114
154A33.8Very low39.6Very low101 Ų101132.6 Ų132.684%0.83580%0.796SS**  trans-144.2158.5173.200000113
155Y40.9Very low39.4Very low205 Ų205132.3 Ų132.380%0.80480%0.804SS**  trans-104.5176.4-173.9-83.4-108.5000113.3
156F37.4Very low39Very low204 Ų204131.7 Ų131.790%0.89581%0.807SS**  trans112.8153.2146.1-59.7-66.3000119.8
157H41.8Very low38.9Very low176 Ų176130 Ų13082%0.81581%0.812SS**  trans-129.7146.7-161.5-146.1-62.9000111.2
158P43.1Very low38.6Very low110 Ų110128 Ų12871%0.71482%0.816SS**  trans-116.8-169.9164.112.910.4000113.2
159V39.5Very low38.5Very low124 Ų124127.4 Ų127.475%0.75281%0.81SS**  -172.8161.6-103149.70000110.4
160L42.8Very low38.4Very low160 Ų160124.5 Ų124.584%0.83881%0.811SS**  trans73.2152.5176.2-108.671.9000115.9
161S36.4Very low38.5Very low99 Ų99126.5 Ų126.569%0.69281%0.814SS**  cis-151.8-173.80.4-151.50000108.3
162C32.9Very low39.1Very low115 Ų115124.4 Ų124.478%0.77780%0.803SS**  cis-156.8-174.27.9-160.40000110
163C42.2Very low39.4Very low133 Ų133124.6 Ų124.690%0.89980%0.803SS**  trans-125.7158.8-175.9-58.10000115.1
164G33.3Very low38.5Very low81 Ų81124.9 Ų124.984%0.83580%0.804SS**  trans-159.1131.2162.700000110.1
165A40.3Very low39Very low116 Ų116126.1 Ų126.196%0.95980%0.802SS**  trans-128142.4-165.900000113.8
166G33.5Very low39.2Very low82 Ų82122.1 Ų122.185%0.84580%0.801SS**  trans-16491175.900000111.8
167S34.3Very low39.5Very low119 Ų119120 Ų12083%0.83280%0.799SS**  trans-76.9155.6167.6-158.50000109.1
168S35.3Very low39.4Very low118 Ų118116.8 Ų116.883%0.82580%0.796SS**  cis-156.2156.722.8-167.30000109.1
169G33.9Very low39.4Very low62 Ų62116.5 Ų116.564%0.63979%0.794SS**  cis173.2-157.30.700000111.8
170A35Very low40Very low105 Ų105120 Ų12087%0.86880%0.802SS**  trans68.282173.300000118.6
171T40.8Very low39.9Very low135 Ų135121.3 Ų121.383%0.82880%0.802SS**  trans-70.4-179.6150.615.40000112.1
172P47.6Very low40.5Very low100 Ų100122.3 Ų122.365%0.64981%0.807SS**  cis-137.5167.4-12.730.8-9.7000116.9
173I45.3Very low41.3Very low154 Ų154122.9 Ų122.979%0.7981%0.809SS**  trans60.5123.2142-68.4165.1000118.9
174P39.4Very low41.9Very low123 Ų123120 Ų12080%0.79980%0.796SS**  -138.2146.7101.737.8-26.5000115.8
175T43.5Very low42.6Very low128 Ų128126.7 Ų126.779%0.78580%0.797SS**  trans-87.8155150.447.90000108.9
176P45Very low43.3Very low120 Ų120126.3 Ų126.378%0.77979%0.788SS**  -148.9176.594.239.8-22.8000115.1
177D43.1Very low44Very low161 Ų161130.1 Ų130.186%0.86179%0.788SS**  trans-74.3148.8178.7-50.2-94.2000114.7
178S39.7Very low44.9Very low107 Ų107131.6 Ų131.675%0.74879%0.786SS**  trans-164.6137152.3-163.30000111.3
179P44.3Very low45.5Very low105 Ų105130.8 Ų130.868%0.68277%0.772SS**  trans-77.9131.8-179.231.1-34.3000112.6F181P179-F181 PolarHBondContact O-N 2.85Å
180Q52Low46.7Very low196 Ų196133.1 Ų133.192%0.91678%0.776SS**  trans-82.4110.6177.4-65.3-174.60.400111.4
181F39.4Very low47.6Very low189 Ų189131.4 Ų131.483%0.82976%0.762SS**  trans-72.7135.7163-77.1-95.2000109.8P179 P183P179-F181 PolarHBondContact O-N 2.85Å; F181-P183 WeakPolarHBondContact O-CD 3.23Å
182C49.9Very low48.3Very low119 Ų119133.5 Ų133.580%0.80476%0.76SS**  trans-102.3110.5178.2-171.50000110.3A184C182-A184 PolarHBondContact O-N 3.37Å
183P48.5Very low48.6Very low127 Ų127134.8 Ų134.883%0.82577%0.766SS**  trans-82.2103.2173.931.7-31.3000109.9F181F181-P183 WeakPolarHBondContact O-CD 3.23Å
184A55.4Low48.6Very low74 Ų74136.5 Ų136.561%0.61277%0.771SS**  trans-95.4128.5171.400000110.4C182C182-A184 PolarHBondContact O-N 3.37Å
185Y48.7Very low48.9Very low221 Ų221138.4 Ų138.487%0.86777%0.774SS**  trans70.493.3176.4-55.8-78.8000117.3
186S54.4Low49.3Very low108 Ų108141.2 Ų141.276%0.75578%0.779SS**  trans-70.6140.3138.6-57.70000108.9
187L49.2Very low49.3Very low162 Ų162142 Ų14285%0.84878%0.776SS**  trans-126.883.9169.3-169.978000108.8N189L187-N189 PolarHBondContact O-N 2.82Å; L187-N189 VanDerWaalsContact O-N 3.13Å
188D52.8Low49.2Very low150 Ų150144.3 Ų144.380%0.80277%0.774SS**  trans-62.4111.8174.1-66-73.3000109.7P190D188-P190 WeakPolarHBondContact O-CD 3.47Å
189N47.8Very low49.3Very low100 Ų100143.9 Ų143.954%0.53578%0.777SS.*  trans-100.4110.1179.3-179.510.8000109.9L187 A191L187-N189 PolarHBondContact O-N 2.82Å; L187-N189 VanDerWaalsContact O-N 3.13Å; N189-A191 PolarHBondContact O-N 3.09Å; N189-A191 VanDerWaalsContact OD1-CB 3.28Å; N189-A191 WeakPolarHBondContact OD1-CB 3.28Å; N189-A191 PolarHBondContact OD1-N 3.16Å
190P58Low48.8Very low111 Ų111145.4 Ų145.472%0.72179%0.785SS**THydrogen-bonded Turntrans-74.18.4-177.932-36.8000114.4D188 F192D188-P190 WeakPolarHBondContact O-CD 3.47Å; P190-F192 PolarHBondContact O-N 3.3Å
191A54.5Low48.2Very low69 Ų69146.6 Ų146.657%0.5778%0.782SS**THydrogen-bonded Turntrans-75.45.7-178.900000115.4N189N189-A191 PolarHBondContact O-N 3.09Å; N189-A191 VanDerWaalsContact OD1-CB 3.28Å; N189-A191 WeakPolarHBondContact OD1-CB 3.28Å; N189-A191 PolarHBondContact OD1-N 3.16Å
192F55.8Low48.9Very low180 Ų180143.2 Ų143.279%0.78978%0.779SS**SBendtrans-136.858.2-176-67.9-78.3000111.5P190P190-F192 PolarHBondContact O-N 3.3Å
193T54.2Low48.7Very low126 Ų126143.3 Ų143.377%0.77378%0.779SS**  trans-147.858-179.2-32.20000113.5
194E45.4Very low48.6Very low191 Ų191146.4 Ų146.489%0.89378%0.782SS**  trans-149.479.6163.7-163168.9126.400105.1
195D45.8Very low47.7Very low162 Ų162149.9 Ų149.987%0.86679%0.79SS**  74.2126.485.8-160.324.3000112
196E50.7Low47.3Very low188 Ų188144.2 Ų144.288%0.87978%0.779SS**  trans-118.8103.7-155.6-66.2-177.3-139.600112.6
197D46Very low46.5Very low136 Ų136150.4 Ų150.473%0.72779%0.786SS**  trans-155.5164.4163.7-150.3-8.7000113.7
198Y40Very low46.2Very low210 Ų210148.5 Ų148.582%0.82478%0.781SS**  trans75.8104.6177.9-64.9-84.7000118.5
199A42.8Very low45.5Very low97 Ų97150.7 Ų150.780%0.80279%0.787SS**  trans-84.3151171.700000113.8
200T34.6Very low45.5Very low138 Ų138155.7 Ų155.785%0.84780%0.798SS**  trans-162.9154.1147.2-79.70000109.9
201Y38.9Very low44.6Very low220 Ų220156.2 Ų156.286%0.86380%0.804SS**  trans-67.4155.3-175.7-66.4-89.5000114.4
202P53.1Low44.1Very low118 Ų118158.8 Ų158.877%0.76681%0.808SS**  trans-86.5158.1-177.735.8-36.9000113.7
203P45.4Very low43.2Very low122 Ų122157.7 Ų157.779%0.79281%0.811SS**  trans-117.8155.2149.137.1-27.9000112.4
204E46.7Very low42.5Very low191 Ų191156.1 Ų156.189%0.89381%0.805SS**  trans-68.8149.4165-58.7156.1107.600110.4
205D36.7Very low42.2Very low147 Ų147152.5 Ų152.579%0.78680%0.801SS**  -175.7146.2110.7-155.25.2000114.2
206T40Very low42Very low102 Ų102152.6 Ų152.663%0.62680%0.801SS**  trans1.2121.9153.4-56.30000120.2
207R37.7Very low41.5Very low238 Ų238152.2 Ų152.290%0.89880%0.799SS**  -151.8133115.5-134.7176-167.582.41.4116.2
208T43.5Very low41.3Very low123 Ų123151.7 Ų151.776%0.75580%0.803SS**  trans-71.6144.2170.937.10000113.1
209Q39.1Very low41.8Very low196 Ų196150.7 Ų150.792%0.91681%0.806SS**  trans-142.8119.1146.2-171.4150.683.700109.8
210R46.4Very low42.1Very low204 Ų204155 Ų15577%0.7781%0.81SS**  trans-83152167.5-97.1-179.4161.391.3-2.4109.7D212R210-D212 WeakPolarHBondContact CD-OD1 3.45Å; R210-D212 WeakPolarHBondContact CD-OD2 3.44Å; R210-D212 IonicContact NE-OD1 3.14Å; R210-D212 PolarHBondContact NE-OD1 2.76Å; R210-D212 VanDerWaalsContact NE-OD1 3.14Å
211S38.8Very low42.2Very low122 Ų122156.2 Ų156.285%0.85381%0.81SS**  trans-148.595.6148.457.20000107.8
212D45.5Very low42.7Very low123 Ų123153.8 Ų153.866%0.65881%0.811SS**  trans-77.4142.3-179.5-37.2-105.8000110.3R210R210-D212 WeakPolarHBondContact CD-OD1 3.45Å; R210-D212 WeakPolarHBondContact CD-OD2 3.44Å; R210-D212 IonicContact NE-OD1 3.14Å; R210-D212 PolarHBondContact NE-OD1 2.76Å; R210-D212 VanDerWaalsContact NE-OD1 3.14Å
213D35.6Very low42.6Very low157 Ų157156.9 Ų156.984%0.8482%0.816SS**  trans-151.7162.4145.4-153.50.5000110.6
214S40.1Very low42.7Very low94 Ų94157.8 Ų157.866%0.65781%0.814SS**  trans-58.9149.4-158.358.50000117.6
215S39.1Very low42.6Very low114 Ų114160 Ų16080%0.79782%0.815SS**  trans-137.9132.4147.6-67.80000107.7E217S215-E217 PolarHBondContact O-N 2.95Å
216D40.9Very low43.3Very low164 Ų164155.6 Ų155.688%0.87780%0.8SS**  trans-69.5119.2-175.1-60.6-74.7000111.6
217E41Very low43.8Very low180 Ų180156.7 Ų156.784%0.84181%0.81SS**  trans-94.1135.6165.9-69.8-156104.600110.9S215 E219S215-E217 PolarHBondContact O-N 2.95Å; E217-E219 PolarHBondContact O-N 2.8Å
218P41.2Very low44.4Very low125 Ų125152.3 Ų152.381%0.81280%0.799SS**  trans-78.7110.9164.131-30.2000110.3E220P218-E220 PolarHBondContact O-N 2.78Å
219E51.8Low45.3Very low190 Ų190152.3 Ų152.389%0.88880%0.795SS**  trans-66.983.9174.7-66.3-176.111200112.3E217E217-E219 PolarHBondContact O-N 2.8Å
220E47.6Very low46.2Very low188 Ų188151 Ų15188%0.87979%0.793SS**  trans-148.755.2171.9-143.7169.9-12800114.7P218P218-E220 PolarHBondContact O-N 2.78Å
221L37.5Very low47.4Very low162 Ų162145.5 Ų145.585%0.84879%0.786SS**  trans-149.532.5163.4-128.6173.3000114.4E223L221-E223 PolarHBondContact O-N 3.04Å
222L49.4Very low49.1Very low170 Ų170145 Ų14589%0.8978%0.78SS**  trans-90.567.2171.9-91.2175.6000111.9
223E50.3Low50.7Low183 Ų183143.3 Ų143.386%0.85578%0.776SS**SBendtrans-149.8136.8162.4-119.5164.6-15600112.2L221L221-E223 PolarHBondContact O-N 3.04Å
224D47.1Very low52.7Low140 Ų140144.9 Ų144.975%0.74977%0.77SS**  trans55.661173.9-152.424.6000119.7
225Y45.8Very low54.4Low237 Ų237147.8 Ų147.893%0.92977%0.768SS**  trans-103.985.5137.5-109.9-86.4000109.4C227Y225-C227 PolarHBondContact O-N 2.95Å
226A50.5Low56.4Low55 Ų55148.5 Ų148.546%0.45576%0.758SS.*  trans-56.1124.5178.400000111.9H228A226-H228 VanDerWaalsContact C-N 3.27Å; A226-H228 PolarHBondContact O-N 2.83Å
227C50.4Low58.1Low125 Ų125147.3 Ų147.385%0.84575%0.748SS**  trans-74.673.6-176-173.20000111.8Y225Y225-C227 PolarHBondContact O-N 2.95Å
228H50.5Low60Low146 Ų146143.4 Ų143.468%0.67673%0.731SS**  trans-89.3119.4178.6-82.9-75.2000112.7A226A226-H228 VanDerWaalsContact C-N 3.27Å; A226-H228 PolarHBondContact O-N 2.83Å
229D61.9Low61.8Low124 Ų124144.3 Ų144.366%0.66372%0.72SS**  trans64.752.4148.8-56-54.5000118.3S231D229-S231 PolarHBondContact O-N 3.42Å
230L58.8Low63Low167 Ų167139.8 Ų139.887%0.87471%0.707SS**  trans-77.523.6150.1-65-179.9000113.1
231S70.9Confident64.3Low89 Ų89139 Ų13962%0.62271%0.708SS**SBendtrans-87.8133.1173.9-67.30000110D229D229-S231 PolarHBondContact O-N 3.42Å
232P76.3Confident66.1Low113 Ų113137.5 Ų137.573%0.73471%0.711SS**PPolyproline II helixtrans-63.5147.8171.827.6-33.9000110.9
233P77.7Confident66.9Low87 Ų87138.4 Ų138.457%0.56573%0.731SS**PPolyproline II helixtrans-60.4153.7-179.324.8-34.1000111.8I238P233-I238 HydrophobicContact CG-CD1 4.33Å
234R78.8Confident67.7Low189 Ų189136.2 Ų136.271%0.71373%0.725SS**PPolyproline II helixtrans-78.4152.5-172.9-68-165.6176.1-173.71.7111.9E236 E237 I238R234-E236 WeakPolarHBondContact CB-OE2 3.34Å; R234-E236 PolarHBondContact O-N 3Å; R234-E236 VanDerWaalsContact O-N 3.16Å; R234-E237 PolarHBondContact N-OE2 3.41Å; R234-E237 WeakPolarHBondContact O-CB 3.43Å; R234-E237 PolarHBondContact O-N 3.16Å; R234-I238 PolarHBondContact O-N 3.15Å
235Y75.3Confident68.8Low156 Ų156135.9 Ų135.961%0.61272%0.724SS**Hα-helixtrans-59.4-33.3-173.4-172.3-95.4000112.4E237 I238 Y239Y235-E237 VanDerWaalsContact C-N 3.29Å; Y235-E237 PolarHBondContact O-N 3.27Å; Y235-I238 PolarHBondContact O-N 2.91Å; Y235-Y239 HydrophobicContact CD2-CD2 4.12Å; Y235-Y239 HydrophobicContact CE1-CD2 4.06Å; Y235-Y239 HydrophobicContact CE1-CG 4.36Å; Y235-Y239 AromaticContact CE2-CD2 3.54Å; Y235-Y239 HydrophobicContact CE2-CD2 3.54Å; Y235-Y239 AromaticContact CE2-CE2 3.85Å; Y235-Y239 HydrophobicContact CE2-CE2 3.85Å; Y235-Y239 AromaticContact CZ-CD2 3.5Å; Y235-Y239 PolarHBondContact O-N 2.95Å
236E81.6Confident70.1Confident128 Ų128130.3 Ų130.360%0.59871%0.712SS**Hα-helixtrans-69.6-22.4179-57.175-162.500113.4R234R234-E236 WeakPolarHBondContact CB-OE2 3.34Å; R234-E236 PolarHBondContact O-N 3Å; R234-E236 VanDerWaalsContact O-N 3.16Å
237E76Confident71.2Confident140 Ų140134.8 Ų134.865%0.65473%0.727SS**Hα-helixtrans-81-33.5174.1-58.2176.5114.900111.3R234 Y235R234-E237 PolarHBondContact N-OE2 3.41Å; R234-E237 WeakPolarHBondContact O-CB 3.43Å; R234-E237 PolarHBondContact O-N 3.16Å; Y235-E237 VanDerWaalsContact C-N 3.29Å; Y235-E237 PolarHBondContact O-N 3.27Å
238I80.9Confident72.5Confident97 Ų97135.4 Ų135.450%0.49772%0.72SS.*Hα-helixtrans-80.1-35.9-179.5-53.7169.3000110.8P233 R234 Y235 P240P233-I238 HydrophobicContact CG-CD1 4.33Å; R234-I238 PolarHBondContact O-N 3.15Å; Y235-I238 PolarHBondContact O-N 2.91Å; I238-P240 WeakPolarHBondContact O-CD 3.47Å
239Y79.1Confident74Confident144 Ų144134.7 Ų134.757%0.56572%0.723SS**SBendtrans-122.878.5179-71.6-78.8000111.2Y235 L241Y235-Y239 HydrophobicContact CD2-CD2 4.12Å; Y235-Y239 HydrophobicContact CE1-CD2 4.06Å; Y235-Y239 HydrophobicContact CE1-CG 4.36Å; Y235-Y239 AromaticContact CE2-CD2 3.54Å; Y235-Y239 HydrophobicContact CE2-CD2 3.54Å; Y235-Y239 AromaticContact CE2-CE2 3.85Å; Y235-Y239 HydrophobicContact CE2-CE2 3.85Å; Y235-Y239 AromaticContact CZ-CD2 3.5Å; Y235-Y239 PolarHBondContact O-N 2.95Å; Y239-L241 PolarHBondContact O-N 3.23Å
240P76.4Confident74.9Confident95 Ų95135.4 Ų135.462%0.61773%0.727SS**  trans-61.4122.8174.925-34000110.8I238 S242I238-P240 WeakPolarHBondContact O-CD 3.47Å; P240-S242 PolarHBondContact O-N 3.37Å; P240-S242 VanDerWaalsContact O-N 3.08Å
241L75.8Confident76.1Confident172 Ų172133 Ų13390%0.90172%0.716SS**  trans-61111175.8-74165.1000109.9Y239 S243Y239-L241 PolarHBondContact O-N 3.23Å; L241-S243 PolarHBondContact O-N 3.08Å
242S75.1Confident76.5Confident131 Ų131136.7 Ų136.792%0.91672%0.724SS**  trans-70.8120.4175.6-59.50000110P240P240-S242 PolarHBondContact O-N 3.37Å; P240-S242 VanDerWaalsContact O-N 3.08Å
243S65.4Low76.6Confident188 Ų188138.8 Ų138.8100%1.31572%0.723SS**  trans-110.80175.6-1770000112.1L241L241-S243 PolarHBondContact O-N 3.08Å

Retrieved 243 of 243 residues in 41.1 ms (Link to these results)