A0A087Y1F6_POEFO Loading...

Transcription termination factor 1

AlphaFold DB , UniProt , Accession A0A087Y1F6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 411 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
1M35.8Very low36.2Very low251 Ų251164.3 Ų164.3100%1.23684%0.84SS**  0101.10-67.7178.6176.700106.2
2G34.7Very low35.9Very low74 Ų74168.1 Ų168.176%0.76385%0.846SS**  106.189.694.900000109
3S35.5Very low35.6Very low124 Ų124171.5 Ų171.587%0.86785%0.852SS**  73.8109.1101.4-93.10000115.8
4T36Very low35.5Very low127 Ų127173.9 Ų173.978%0.77986%0.855SS**  trans-146.398.3152.936.50000111.3E6T4-E6 VanDerWaalsContact C-N 3.35Å; T4-E6 PolarHBondContact O-N 3.45Å
5E35.5Very low35.3Very low180 Ų180173.7 Ų173.784%0.84186%0.859SS**  50.224.5116.8-135.8159.9-158.500122
6E37.3Very low34.9Very low189 Ų189168.8 Ų168.888%0.88385%0.854SS**  trans-90.8-9.8170.9-94-172.4152.800115.2T4T4-E6 VanDerWaalsContact C-N 3.35Å; T4-E6 PolarHBondContact O-N 3.45Å
7D36.8Very low34.6Very low123 Ų123171.1 Ų171.166%0.65886%0.857SS**  trans-114.925.4-167.5-123.2-17000115.6K9D7-K9 WeakPolarHBondContact O-CG 3.47Å; D7-K9 PolarHBondContact O-N 2.99Å
8K35.7Very low34.3Very low191 Ų191168.3 Ų168.383%0.8385%0.853SS**SBendtrans-9258.2156.1-81.5-178.9-178.2169.90110.6
9K35.2Very low34.1Very low148 Ų148169.6 Ų169.664%0.64386%0.856SS**  42.497118.6-82.2166.5176.9168.40114.5D7 K11D7-K9 WeakPolarHBondContact O-CG 3.47Å; D7-K9 PolarHBondContact O-N 2.99Å; K9-K11 PolarHBondContact O-N 2.95Å
10K39.1Very low33.9Very low207 Ų207171.5 Ų171.590%0.986%0.858SS**SBend56.912.7100.4-69.9173.9172.2167.10117.9
11K36.3Very low33.6Very low193 Ų193174.1 Ų174.184%0.83986%0.858SS**  trans-140.474.2176.7-86.6-174.7173.8178.30111.1K9K9-K11 PolarHBondContact O-N 2.95Å
12K33.3Very low33.4Very low210 Ų210172.3 Ų172.391%0.91384%0.843SS**SBendtrans165.281.8149.7-96.3168.8176.9-178.20109.7
13K31.5Very low33.1Very low212 Ų212174.9 Ų174.992%0.92284%0.844SS**  trans-178.357.8151.2-101.8169.3-177.6-179.20109
14K34.7Very low32.7Very low205 Ų205177.8 Ų177.889%0.89184%0.844SS**  trans-117.183.2158.2-85.7-171.6176.5-179.20106.4
15N32.3Very low32.3Very low171 Ų171183.5 Ų183.591%0.91485%0.851SS**  trans177.888.6155.3-100-5.2000108.9
16A29.5Very low32Very low95 Ų95177.9 Ų177.979%0.78584%0.842SS**  trans-158.3111154.200000107.5P18A16-P18 WeakPolarHBondContact O-CD 3.37Å
17K29.1Very low31.6Very low208 Ų208177.5 Ų177.590%0.90484%0.84SS**  trans-62.1127.6175.1-79.4170.7171.6172.90109.9
18P28.8Very low31.5Very low121 Ų121179.6 Ų179.679%0.78685%0.85SS**  trans-81.7124160.9-1.419.7000109A16 K20A16-P18 WeakPolarHBondContact O-CD 3.37Å; P18-K20 PolarHBondContact O-N 3.11Å
19Q30.5Very low31.3Very low194 Ų194175.3 Ų175.391%0.90784%0.844SS**  trans-52.5115.8169.2-75.1169.8-31.800109.7R21Q19-R21 PolarHBondContact O-N 3.33Å
20K30.3Very low31.2Very low206 Ų206172.8 Ų172.890%0.89685%0.845SS**  trans-71.3112.4168.6-91.3-176.9174.3-179.10108.7P18P18-K20 PolarHBondContact O-N 3.11Å
21R27.5Very low31.1Very low228 Ų228167.5 Ų167.586%0.8683%0.834SS**  trans-39.7131163-76.6173.5160178.3-7.3110.5Q19 T23Q19-R21 PolarHBondContact O-N 3.33Å; R21-T23 PolarHBondContact O-N 3.41Å; R21-T23 VanDerWaalsContact O-N 3.08Å
22K31.2Very low31.3Very low213 Ų213164 Ų16493%0.92683%0.831SS**  trans-60.2106.8161.9-76176.9174.9177.20107.1
23T28.3Very low32Very low128 Ų128162.9 Ų162.979%0.78583%0.829SS**  trans-98.1124.8166.1-26.60000106.8R21 R25R21-T23 PolarHBondContact O-N 3.41Å; R21-T23 VanDerWaalsContact O-N 3.08Å; T23-R25 PolarHBondContact O-N 3.08Å
24E27.5Very low33.3Very low185 Ų185158.8 Ų158.886%0.86481%0.813SS**  trans-50.2127.5-176.7-69159.3148.600110.9G26E24-G26 PolarHBondContact O-N 3.3Å; E24-G26 VanDerWaalsContact O-N 3.13Å
25R28.9Very low35.4Very low246 Ų246157.5 Ų157.593%0.92881%0.811SS**  trans-67.5110.7164.7-86.2-178.9178.1177-0.6106.7T23 H27T23-R25 PolarHBondContact O-N 3.08Å; R25-H27 PolarHBondContact O-N 3.5Å
26G27.4Very low37.7Very low62 Ų62150.1 Ų150.164%0.63977%0.771SS**  trans-45.1128.517200000111.4E24 L28E24-G26 PolarHBondContact O-N 3.3Å; E24-G26 VanDerWaalsContact O-N 3.13Å; G26-L28 VanDerWaalsContact C-N 3.32Å; G26-L28 PolarHBondContact O-N 3.46Å
27H30.4Very low40.4Very low182 Ų182149.4 Ų149.484%0.84376%0.755SS**  trans-61.790.3171.4-143.6-42.6000108.2R25 S29R25-H27 PolarHBondContact O-N 3.5Å; H27-S29 VanDerWaalsContact C-N 3.32Å; H27-S29 PolarHBondContact O-N 3.37Å; H27-S29 VanDerWaalsContact O-N 3.07Å
28L33.6Very low43.1Very low167 Ų167145.8 Ų145.887%0.87474%0.735SS**  trans-75.494.8164.3-93.5143.9000106.9G26 S30G26-L28 VanDerWaalsContact C-N 3.32Å; G26-L28 PolarHBondContact O-N 3.46Å; L28-S30 PolarHBondContact O-N 2.86Å
29S31.1Very low45.9Very low100 Ų100142.7 Ų142.770%0.69972%0.72SS**  trans-4.4106.4159.8171.90000113.8H27 S31H27-S29 VanDerWaalsContact C-N 3.32Å; H27-S29 PolarHBondContact O-N 3.37Å; H27-S29 VanDerWaalsContact O-N 3.07Å; S29-S31 PolarHBondContact O-N 3.34Å
30S34.1Very low48.6Very low95 Ų95135.5 Ų135.566%0.66469%0.687SS**  trans-59.9113.9161.351.90000108.1L28L28-S30 PolarHBondContact O-N 2.86Å
31S36.6Very low51.3Low96 Ų96125.7 Ų125.767%0.67165%0.645SS**  trans-55149.2157.5-56.40000108.7S29 E33S29-S31 PolarHBondContact O-N 3.34Å; S31-E33 PolarHBondContact O-N 3.37Å
32P41.2Very low54Low121 Ų121120.4 Ų120.479%0.78663%0.63SS**  trans-54.6130.9-175.9-16.328.3000108.6E34P32-E34 VanDerWaalsContact C-N 3.26Å; P32-E34 PolarHBondContact O-N 3.46Å
33E48.1Very low56.6Low185 Ų185114 Ų11486%0.86460%0.603SS**  trans-61.994.5173.1-68.8-176.5157.600107.5S31 E35S31-E33 PolarHBondContact O-N 3.37Å; E33-E35 PolarHBondContact O-N 3.03Å
34E59.3Low59.4Low126 Ų126108 Ų10859%0.58957%0.566SS**  trans-51.6110.1170.4-77.7177.5163.600107.3P32 K60 R64P32-E34 VanDerWaalsContact C-N 3.26Å; P32-E34 PolarHBondContact O-N 3.46Å; E34-K60 WeakPolarHBondContact O-CE 3.47Å; E34-K60 PolarHBondContact O-NZ 3.15Å; E34-R64 IonicContact OE2-NH2 3.55Å; E34-R64 PolarHBondContact OE2-NH2 3.15Å; E34-R64 VanDerWaalsContact OE2-NH2 3.08Å
35E77.2Confident62.1Low179 Ų179101.6 Ų101.684%0.83654%0.536SS*.  trans-61.3143.2-179.7-157.1168.1-175.600109.2E33 D37E33-E35 PolarHBondContact O-N 3.03Å; E35-D37 PolarHBondContact O-N 3.5Å
36V81.1Confident64.6Low15 Ų1594.6 Ų94.69%0.09152%0.517CS..  trans-75.8120.7177.7177.10000108W38 V41 I56 I59 K60 L63V36-W38 VanDerWaalsContact O-CD1 3.28Å; V36-W38 PolarHBondContact O-N 2.91Å; V36-V41 HydrophobicContact CG1-CG2 3.8Å; V36-I56 HydrophobicContact CG2-CG2 3.65Å; V36-I59 HydrophobicContact CG1-CG2 3.97Å; V36-K60 HydrophobicContact CG2-CD 4.32Å; V36-K60 VanDerWaalsContact CG2-CE 3.49Å; V36-K60 HydrophobicContact CG2-CG 3.9Å; V36-L63 HydrophobicContact CG1-CD1 4.13Å
37D86.1Confident67Low81 Ų8192.7 Ų92.743%0.43349%0.491SS..  trans-68.5103.7170.6-172.8-19.7000109.9E35 A39 L40 V41E35-D37 PolarHBondContact O-N 3.5Å; D37-A39 VanDerWaalsContact C-N 3.28Å; D37-A39 PolarHBondContact O-N 3.44Å; D37-A39 WeakPolarHBondContact OD1-CB 3.47Å; D37-A39 PolarHBondContact OD1-N 2.91Å; D37-L40 HydrophobicContact CB-CB 4.47Å; D37-L40 HydrophobicContact CB-CD1 3.9Å; D37-L40 HydrophobicContact CB-CG 3.98Å; D37-L40 PolarHBondContact O-N 3.29Å; D37-L40 PolarHBondContact OD1-N 3.1Å; D37-L40 WeakPolarHBondContact OD2-CG 3.28Å; D37-V41 PolarHBondContact O-N 3.26Å
38W86.4Confident69.5Low132 Ų13285 Ų8550%0.546%0.456SS..Hα-helixtrans-70.9-21.4-178.3-68.3106.1000113.4V36 V41 E42 I59V36-W38 VanDerWaalsContact O-CD1 3.28Å; V36-W38 PolarHBondContact O-N 2.91Å; W38-V41 HydrophobicContact CE3-CB 4.15Å; W38-V41 HydrophobicContact CE3-CG1 4.18Å; W38-V41 HydrophobicContact CE3-CG2 4.12Å; W38-V41 HydrophobicContact CZ3-CG1 4.36Å; W38-V41 WeakPolarHBondContact O-CB 3.25Å; W38-V41 PolarHBondContact O-N 2.89Å; W38-E42 PolarHBondContact O-N 3.15Å; W38-I59 HydrophobicContact CZ3-CD1 4.5Å
39A86.8Confident71.8Confident55 Ų5580.2 Ų80.246%0.45544%0.435SS..Hα-helixtrans-67.2-41.5174.700000110.5D37 V41 E42 E43D37-A39 VanDerWaalsContact C-N 3.28Å; D37-A39 PolarHBondContact O-N 3.44Å; D37-A39 WeakPolarHBondContact OD1-CB 3.47Å; D37-A39 PolarHBondContact OD1-N 2.91Å; A39-V41 VanDerWaalsContact C-N 3.25Å; A39-V41 PolarHBondContact O-N 2.98Å; A39-E42 WeakPolarHBondContact O-CB 3.44Å; A39-E42 PolarHBondContact O-N 2.94Å; A39-E42 VanDerWaalsContact O-N 3.15Å; A39-E43 PolarHBondContact O-N 2.88Å; A39-E43 VanDerWaalsContact O-N 3.15Å
40L87.5Confident74.1Confident43 Ų4380.9 Ų80.923%0.22543%0.427CS..Hα-helixtrans-66-29.7174.2-55.8-178.9000112.5D37 L44 L63 L67D37-L40 HydrophobicContact CB-CB 4.47Å; D37-L40 HydrophobicContact CB-CD1 3.9Å; D37-L40 HydrophobicContact CB-CG 3.98Å; D37-L40 PolarHBondContact O-N 3.29Å; D37-L40 PolarHBondContact OD1-N 3.1Å; D37-L40 WeakPolarHBondContact OD2-CG 3.28Å; L40-L44 PolarHBondContact O-N 3.31Å; L40-L63 HydrophobicContact CB-CD2 3.58Å; L40-L67 HydrophobicContact CB-CD2 4.22Å; L40-L67 HydrophobicContact CD1-CD2 4Å; L40-L67 HydrophobicContact CD2-CD2 4.07Å; L40-L67 HydrophobicContact CG-CD2 4.33Å
41V86.2Confident76.5Confident0 Ų076.4 Ų76.40%040%0.395CS..Hα-helixtrans-69.7-36.8174.6178.20000110.9V36 D37 W38 A39 L44 Q45 I51 R52 I59 L63V36-V41 HydrophobicContact CG1-CG2 3.8Å; D37-V41 PolarHBondContact O-N 3.26Å; W38-V41 HydrophobicContact CE3-CB 4.15Å; W38-V41 HydrophobicContact CE3-CG1 4.18Å; W38-V41 HydrophobicContact CE3-CG2 4.12Å; W38-V41 HydrophobicContact CZ3-CG1 4.36Å; W38-V41 WeakPolarHBondContact O-CB 3.25Å; W38-V41 PolarHBondContact O-N 2.89Å; A39-V41 VanDerWaalsContact C-N 3.25Å; A39-V41 PolarHBondContact O-N 2.98Å; V41-L44 PolarHBondContact O-N 3.36Å; V41-Q45 PolarHBondContact O-N 3.49Å; V41-I51 HydrophobicContact CG1-CD1 4.42Å; V41-I51 HydrophobicContact CG1-CG1 4.44Å; V41-I51 HydrophobicContact CG1-CG2 3.72Å; V41-R52 HydrophobicContact CG1-CG 4.39Å; V41-I59 HydrophobicContact CG2-CG2 3.54Å; V41-L63 HydrophobicContact CG2-CD1 4.05Å; V41-L63 HydrophobicContact CG2-CD2 4.42Å
42E86Confident78.8Confident118 Ų11878.5 Ų78.555%0.55139%0.388SS*.Hα-helixtrans-65-43.1176.5-171.6160.9-139.800111.8W38 A39 L44 Q45W38-E42 PolarHBondContact O-N 3.15Å; A39-E42 WeakPolarHBondContact O-CB 3.44Å; A39-E42 PolarHBondContact O-N 2.94Å; A39-E42 VanDerWaalsContact O-N 3.15Å; E42-L44 PolarHBondContact O-N 3.15Å; E42-Q45 WeakPolarHBondContact O-CB 3.38Å; E42-Q45 PolarHBondContact O-N 3.49Å
43E85.7Confident80.9Confident78 Ų7882.2 Ų82.236%0.36439%0.387SS..Hα-helixtrans-55.3-37.4172.2-70.6-178.6-132.600112.7A39 Q45 R71A39-E43 PolarHBondContact O-N 2.88Å; A39-E43 VanDerWaalsContact O-N 3.15Å; E43-Q45 VanDerWaalsContact C-N 3.28Å; E43-Q45 PolarHBondContact O-N 2.99Å; E43-R71 VanDerWaalsContact CD-NH2 3.29Å; E43-R71 IonicContact OE1-CZ 2.78Å; E43-R71 IonicContact OE1-NH2 3.85Å; E43-R71 PolarHBondContact OE1-NH2 2.96Å; E43-R71 IonicContact OE2-CZ 2.71Å; E43-R71 VanDerWaalsContact OE2-CZ 3.32Å; E43-R71 IonicContact OE2-NE 2.96Å; E43-R71 PolarHBondContact OE2-NE 2.86Å; E43-R71 IonicContact OE2-NH2 3.32Å; E43-R71 PolarHBondContact OE2-NH2 3.49Å
44L85.4Confident82.6Confident1 Ų177.1 Ų77.11%0.00536%0.362CS..THydrogen-bonded Turntrans-74-14.9178.4-73.8-177.5000113.7L40 V41 E42 D46 Y47 M48 I51 I62 L63 L67 F70L40-L44 PolarHBondContact O-N 3.31Å; V41-L44 PolarHBondContact O-N 3.36Å; E42-L44 PolarHBondContact O-N 3.15Å; L44-D46 VanDerWaalsContact C-N 3.26Å; L44-D46 PolarHBondContact O-N 2.92Å; L44-Y47 PolarHBondContact O-N 3.2Å; L44-M48 WeakPolarHBondContact O-CA 3.49Å; L44-M48 WeakPolarHBondContact O-CB 3.37Å; L44-M48 PolarHBondContact O-N 2.72Å; L44-I51 HydrophobicContact CB-CD1 3.78Å; L44-I51 HydrophobicContact CD1-CD1 3.54Å; L44-I51 HydrophobicContact CG-CD1 4.33Å; L44-I62 HydrophobicContact CD1-CG2 3.85Å; L44-L63 HydrophobicContact CD1-CD2 3.56Å; L44-L63 HydrophobicContact CD1-CG 4.19Å; L44-L63 HydrophobicContact CG-CD2 4.37Å; L44-L67 HydrophobicContact CD2-CD1 4.04Å; L44-L67 HydrophobicContact CG-CD1 4Å; L44-F70 HydrophobicContact CD2-CB 4.5Å; L44-F70 HydrophobicContact CD2-CD2 3.44Å; L44-F70 VanDerWaalsContact CD2-CD2 3.44Å; L44-F70 HydrophobicContact CD2-CE2 4.11Å; L44-F70 HydrophobicContact CD2-CG 4.43Å
45Q85.4Confident83.9Confident51 Ų5174.4 Ų74.424%0.23836%0.356CS..THydrogen-bonded Turntrans-66.6-29.7-178.8-71.7-176.3-95.100112.6V41 E42 E43 Y47 M48 P49 I51 R52V41-Q45 PolarHBondContact O-N 3.49Å; E42-Q45 WeakPolarHBondContact O-CB 3.38Å; E42-Q45 PolarHBondContact O-N 3.49Å; E43-Q45 VanDerWaalsContact C-N 3.28Å; E43-Q45 PolarHBondContact O-N 2.99Å; Q45-Y47 PolarHBondContact O-N 2.95Å; Q45-M48 CarbonylContact O-C 3.48Å; Q45-M48 VanDerWaalsContact O-C 3.31Å; Q45-M48 PolarHBondContact O-N 3.36Å; Q45-P49 WeakPolarHBondContact O-CA 3.38Å; Q45-I51 HydrophobicContact CG-CG2 3.71Å; Q45-R52 VanDerWaalsContact OE1-CZ 3.32Å
46D80.3Confident84.4Confident100 Ų10070.4 Ų70.454%0.53534%0.339SS..THydrogen-bonded Turntrans-55.2-41.6173.8-69.1-8000111.2L44 K74L44-D46 VanDerWaalsContact C-N 3.26Å; L44-D46 PolarHBondContact O-N 2.92Å; D46-K74 IonicContact OD2-NZ 2.84Å; D46-K74 PolarHBondContact OD2-NZ 3.44Å
47Y79.7Confident84.6Confident21 Ų2175.1 Ų75.18%0.08236%0.364CS..THydrogen-bonded Turntrans-95.5-21.5179.4-74-99.4000113.2L44 Q45 F70 F73 K74 V78 A80L44-Y47 PolarHBondContact O-N 3.2Å; Q45-Y47 PolarHBondContact O-N 2.95Å; Y47-F70 AromaticContact CD1-CD1 3.4Å; Y47-F70 HydrophobicContact CD1-CD1 3.4Å; Y47-F70 VanDerWaalsContact CD1-CD1 3.4Å; Y47-F70 AromaticContact CD1-CE1 3.73Å; Y47-F70 HydrophobicContact CD1-CE1 3.73Å; Y47-F70 HydrophobicContact CD1-CG 4.06Å; Y47-F70 HydrophobicContact CD2-CB 4.03Å; Y47-F70 HydrophobicContact CD2-CD1 4.35Å; Y47-F70 HydrophobicContact CD2-CG 4.21Å; Y47-F70 AromaticContact CE1-CD1 3.9Å; Y47-F70 HydrophobicContact CE1-CD1 3.9Å; Y47-F70 HydrophobicContact CE1-CE1 4.49Å; Y47-F70 HydrophobicContact CE2-CB 4.25Å; Y47-F70 HydrophobicContact CG-CB 4.2Å; Y47-F70 AromaticContact CG-CD1 3.7Å; Y47-F70 HydrophobicContact CG-CD1 3.7Å; Y47-F70 HydrophobicContact CG-CD2 4.39Å; Y47-F70 HydrophobicContact CG-CE1 4.15Å; Y47-F70 AromaticContact CG-CG 3.86Å; Y47-F70 HydrophobicContact CG-CG 3.86Å; Y47-F73 HydrophobicContact CE1-CB 4.32Å; Y47-K74 HydrophobicContact CE2-CB 4.44Å; Y47-K74 PolarHBondContact OH-N 3.11Å; Y47-V78 PolarHBondContact OH-O 3.46Å; Y47-A80 HydrophobicContact CD1-CB 3.24Å; Y47-A80 HydrophobicContact CE1-CB 3.72Å; Y47-A80 HydrophobicContact CG-CB 3.74Å
48M81.6Confident84.6Confident21 Ų2175.8 Ų75.810%0.10336%0.364CS..  trans-138.679.9-175.3-62.4-170.566.600111.9L44 Q45 H50 I51 I62 F70 P145L44-M48 WeakPolarHBondContact O-CA 3.49Å; L44-M48 WeakPolarHBondContact O-CB 3.37Å; L44-M48 PolarHBondContact O-N 2.72Å; Q45-M48 CarbonylContact O-C 3.48Å; Q45-M48 VanDerWaalsContact O-C 3.31Å; Q45-M48 PolarHBondContact O-N 3.36Å; M48-H50 PolarHBondContact O-N 3.42Å; M48-I51 HydrophobicContact CB-CB 4.16Å; M48-I51 PolarHBondContact O-N 3.2Å; M48-I51 VanDerWaalsContact O-N 3.07Å; M48-I62 HydrophobicContact CE-CD1 4.04Å; M48-I62 HydrophobicContact SD-CG2 3.8Å; M48-F70 HydrophobicContact CG-CE2 4.49Å; M48-F70 HydrophobicContact SD-CE2 4.35Å; M48-P145 HydrophobicContact CE-CB 4.39Å; M48-P145 HydrophobicContact CE-CG 3.98Å; M48-P145 HydrophobicContact CG-CG 3.97Å; M48-P145 HydrophobicContact SD-CB 4.11Å; M48-P145 HydrophobicContact SD-CG 3.62Å
49P81.1Confident84.6Confident67 Ų6769.6 Ų69.644%0.43534%0.341SS..THydrogen-bonded Turntrans-57.5-22-172.6-27.534.2000115.4Q45Q45-P49 WeakPolarHBondContact O-CA 3.38Å
50H81.3Confident84.7Confident114 Ų11469.2 Ų69.253%0.52833%0.329SS..THydrogen-bonded Turntrans-113.721.4-175.7-57.8-34.1000113.8M48 R52 R53M48-H50 PolarHBondContact O-N 3.42Å; H50-R52 VanDerWaalsContact C-N 3.27Å; H50-R52 PolarHBondContact O-N 3.22Å; H50-R53 PolarHBondContact O-N 3.48Å; H50-R53 VanDerWaalsContact O-N 3.16Å
51I83.8Confident84.7Confident1 Ų174.2 Ų74.21%0.00535%0.349CS..G310 helixtrans-58.3-37.2-179.2-169.1166.8000112.9V41 L44 Q45 M48 R53 K54 I59 I62V41-I51 HydrophobicContact CG1-CD1 4.42Å; V41-I51 HydrophobicContact CG1-CG1 4.44Å; V41-I51 HydrophobicContact CG1-CG2 3.72Å; L44-I51 HydrophobicContact CB-CD1 3.78Å; L44-I51 HydrophobicContact CD1-CD1 3.54Å; L44-I51 HydrophobicContact CG-CD1 4.33Å; Q45-I51 HydrophobicContact CG-CG2 3.71Å; M48-I51 HydrophobicContact CB-CB 4.16Å; M48-I51 PolarHBondContact O-N 3.2Å; M48-I51 VanDerWaalsContact O-N 3.07Å; I51-R53 PolarHBondContact O-N 3.3Å; I51-R53 VanDerWaalsContact O-N 3.11Å; I51-K54 VanDerWaalsContact O-CB 3.32Å; I51-K54 WeakPolarHBondContact O-CB 3.32Å; I51-K54 PolarHBondContact O-N 2.89Å; I51-I59 HydrophobicContact CG1-CG1 4.28Å; I51-I62 HydrophobicContact CD1-CG2 4.14Å
52R84.1Confident84.8Confident139 Ų13975.1 Ų75.153%0.52535%0.354SS..G310 helixtrans-62.8-18.2179.4-61.3-171.2-174.6-159.22.3114.1V41 Q45 H50 K54V41-R52 HydrophobicContact CG1-CG 4.39Å; Q45-R52 VanDerWaalsContact OE1-CZ 3.32Å; H50-R52 VanDerWaalsContact C-N 3.27Å; H50-R52 PolarHBondContact O-N 3.22Å; R52-K54 VanDerWaalsContact C-N 3.27Å; R52-K54 PolarHBondContact O-N 3.08Å
53R86Confident84.9Confident200 Ų20070.7 Ų70.776%0.75533%0.333SS*.G310 helixtrans-80-6.7176-60.5-176.7-178161.30.6113.1H50 I51H50-R53 PolarHBondContact O-N 3.48Å; H50-R53 VanDerWaalsContact O-N 3.16Å; I51-R53 PolarHBondContact O-N 3.3Å; I51-R53 VanDerWaalsContact O-N 3.11Å
54K84.5Confident85.1Confident78 Ų7874.8 Ų74.834%0.33935%0.346SS..SBendtrans-86.9157.5-179.4-64.3-176.1176.7-640111I51 R52 Q58 I59 I62I51-K54 VanDerWaalsContact O-CB 3.32Å; I51-K54 WeakPolarHBondContact O-CB 3.32Å; I51-K54 PolarHBondContact O-N 2.89Å; R52-K54 VanDerWaalsContact C-N 3.27Å; R52-K54 PolarHBondContact O-N 3.08Å; K54-Q58 HydrophobicContact CB-CB 4.19Å; K54-I59 HydrophobicContact CB-CG1 4.04Å; K54-I59 WeakPolarHBondContact O-CD1 3.39Å; K54-I62 HydrophobicContact CD-CD1 3.49Å; K54-I62 VanDerWaalsContact CD-CD1 3.49Å
55C86.5Confident85.1Confident69 Ų6975.9 Ų75.947%0.46635%0.353SS..  trans-70.2151.9173.867.70000111.4N57 Q58 I59C55-N57 VanDerWaalsContact C-N 3.26Å; C55-N57 PolarHBondContact O-N 3.03Å; C55-N57 VanDerWaalsContact O-N 3.16Å; C55-Q58 WeakPolarHBondContact O-CA 3.46Å; C55-Q58 WeakPolarHBondContact O-CB 3.38Å; C55-Q58 PolarHBondContact O-N 3.46Å; C55-Q58 VanDerWaalsContact SG-CD 3.5Å; C55-Q58 WeakPolarHBondContact SG-CG 3.35Å; C55-I59 PolarHBondContact O-N 3.33Å
56I86.3Confident85.3Confident95 Ų9573.5 Ų73.549%0.48734%0.342SS..Hα-helixtrans-49.4-45.6-177.5-72.1167000112.1V36 Q58 I59 K60V36-I56 HydrophobicContact CG2-CG2 3.65Å; I56-Q58 VanDerWaalsContact C-N 3.27Å; I56-Q58 PolarHBondContact O-N 3.32Å; I56-I59 PolarHBondContact O-N 3.38Å; I56-I59 VanDerWaalsContact O-N 3.15Å; I56-K60 HydrophobicContact CG2-CD 4.29Å; I56-K60 WeakPolarHBondContact O-CG 3.5Å; I56-K60 PolarHBondContact O-N 3.3Å
57N86.7Confident85.8Confident114 Ų11469.6 Ų69.661%0.6132%0.321SS*.Hα-helixtrans-63.5-30.7179.1-71.4-24.7000113.6C55 K61C55-N57 VanDerWaalsContact C-N 3.26Å; C55-N57 PolarHBondContact O-N 3.03Å; C55-N57 VanDerWaalsContact O-N 3.16Å; N57-K61 WeakPolarHBondContact O-CG 3.42Å; N57-K61 PolarHBondContact O-N 2.98Å
58Q85.1Confident86.3Confident95 Ų9573.2 Ų73.244%0.44434%0.339SS..Hα-helixtrans-74.9-41.7173.6-75.7173.49.900111.1K54 C55 I56 K60 K61 I62K54-Q58 HydrophobicContact CB-CB 4.19Å; C55-Q58 WeakPolarHBondContact O-CA 3.46Å; C55-Q58 WeakPolarHBondContact O-CB 3.38Å; C55-Q58 PolarHBondContact O-N 3.46Å; C55-Q58 VanDerWaalsContact SG-CD 3.5Å; C55-Q58 WeakPolarHBondContact SG-CG 3.35Å; I56-Q58 VanDerWaalsContact C-N 3.27Å; I56-Q58 PolarHBondContact O-N 3.32Å; Q58-K60 VanDerWaalsContact C-N 3.35Å; Q58-K60 PolarHBondContact O-N 2.88Å; Q58-K61 PolarHBondContact O-N 3.21Å; Q58-I62 VanDerWaalsContact O-CG1 3.32Å; Q58-I62 WeakPolarHBondContact O-CG1 3.46Å; Q58-I62 PolarHBondContact O-N 3.47Å
59I87.7Confident86.8Confident2 Ų273 Ų731%0.0134%0.337CS..Hα-helixtrans-58.1-48.6176.7-66.4166000110V36 W38 V41 I51 K54 C55 I56 K61 I62 L63V36-I59 HydrophobicContact CG1-CG2 3.97Å; W38-I59 HydrophobicContact CZ3-CD1 4.5Å; V41-I59 HydrophobicContact CG2-CG2 3.54Å; I51-I59 HydrophobicContact CG1-CG1 4.28Å; K54-I59 HydrophobicContact CB-CG1 4.04Å; K54-I59 WeakPolarHBondContact O-CD1 3.39Å; C55-I59 PolarHBondContact O-N 3.33Å; I56-I59 PolarHBondContact O-N 3.38Å; I56-I59 VanDerWaalsContact O-N 3.15Å; I59-K61 VanDerWaalsContact C-N 3.28Å; I59-K61 PolarHBondContact O-N 3.11Å; I59-I62 PolarHBondContact O-N 3.48Å; I59-I62 VanDerWaalsContact O-N 3.13Å; I59-L63 HydrophobicContact CG2-CD1 3.93Å; I59-L63 HydrophobicContact CG2-CG 4.33Å; I59-L63 WeakPolarHBondContact O-CG 3.46Å; I59-L63 PolarHBondContact O-N 3Å
60K88.4Confident87.2Confident46 Ų4670.1 Ų70.120%0.232%0.317CS..Hα-helixtrans-55.8-40.1175.9-71.4-178.2176.4-174.10113.1E34 V36 I56 Q58 R64E34-K60 WeakPolarHBondContact O-CE 3.47Å; E34-K60 PolarHBondContact O-NZ 3.15Å; V36-K60 HydrophobicContact CG2-CD 4.32Å; V36-K60 VanDerWaalsContact CG2-CE 3.49Å; V36-K60 HydrophobicContact CG2-CG 3.9Å; I56-K60 HydrophobicContact CG2-CD 4.29Å; I56-K60 WeakPolarHBondContact O-CG 3.5Å; I56-K60 PolarHBondContact O-N 3.3Å; Q58-K60 VanDerWaalsContact C-N 3.35Å; Q58-K60 PolarHBondContact O-N 2.88Å; K60-R64 WeakPolarHBondContact O-CG 3.37Å; K60-R64 PolarHBondContact O-N 3.2Å; K60-R64 VanDerWaalsContact O-N 3.16Å
61K86.6Confident87.7Confident149 Ų14969.6 Ų69.665%0.64831%0.311SS*.Hα-helixtrans-66.7-44.8177.4-74.3177.5-175.9-179.30111.7N57 Q58 I59 L63 R64 S65N57-K61 WeakPolarHBondContact O-CG 3.42Å; N57-K61 PolarHBondContact O-N 2.98Å; Q58-K61 PolarHBondContact O-N 3.21Å; I59-K61 VanDerWaalsContact C-N 3.28Å; I59-K61 PolarHBondContact O-N 3.11Å; K61-L63 VanDerWaalsContact C-N 3.35Å; K61-R64 PolarHBondContact O-N 3.43Å; K61-S65 PolarHBondContact O-N 3.31Å; K61-S65 PolarHBondContact O-OG 3.19Å
62I88.3Confident88.1Confident19 Ų1974.8 Ų74.810%0.09733%0.333CS..Hα-helixtrans-63-44.1178.5-64.7164000110L44 M48 I51 K54 Q58 I59 R64 S65 D66L44-I62 HydrophobicContact CD1-CG2 3.85Å; M48-I62 HydrophobicContact CE-CD1 4.04Å; M48-I62 HydrophobicContact SD-CG2 3.8Å; I51-I62 HydrophobicContact CD1-CG2 4.14Å; K54-I62 HydrophobicContact CD-CD1 3.49Å; K54-I62 VanDerWaalsContact CD-CD1 3.49Å; Q58-I62 VanDerWaalsContact O-CG1 3.32Å; Q58-I62 WeakPolarHBondContact O-CG1 3.46Å; Q58-I62 PolarHBondContact O-N 3.47Å; I59-I62 PolarHBondContact O-N 3.48Å; I59-I62 VanDerWaalsContact O-N 3.13Å; I62-R64 VanDerWaalsContact C-N 3.28Å; I62-R64 PolarHBondContact O-N 3.22Å; I62-S65 PolarHBondContact O-N 2.77Å; I62-D66 HydrophobicContact CG2-CB 4.08Å; I62-D66 WeakPolarHBondContact O-CA 3.47Å; I62-D66 WeakPolarHBondContact O-CB 3.38Å; I62-D66 PolarHBondContact O-N 2.99Å
63L89.1Confident88.4Confident24 Ų2468.9 Ų68.913%0.12631%0.312CS..Hα-helixtrans-56.4-43.6175.7-74169.7000111.7V36 L40 V41 L44 I59 K61 L67V36-L63 HydrophobicContact CG1-CD1 4.13Å; L40-L63 HydrophobicContact CB-CD2 3.58Å; V41-L63 HydrophobicContact CG2-CD1 4.05Å; V41-L63 HydrophobicContact CG2-CD2 4.42Å; L44-L63 HydrophobicContact CD1-CD2 3.56Å; L44-L63 HydrophobicContact CD1-CG 4.19Å; L44-L63 HydrophobicContact CG-CD2 4.37Å; I59-L63 HydrophobicContact CG2-CD1 3.93Å; I59-L63 HydrophobicContact CG2-CG 4.33Å; I59-L63 WeakPolarHBondContact O-CG 3.46Å; I59-L63 PolarHBondContact O-N 3Å; K61-L63 VanDerWaalsContact C-N 3.35Å; L63-L67 HydrophobicContact CD2-CD2 4.4Å; L63-L67 WeakPolarHBondContact O-CB 3.38Å
64R88.5Confident88.5Confident165 Ų16565.2 Ų65.262%0.62330%0.301SS*.Hα-helixtrans-67.6-44.9178.3-69.7174.2-174.5171.90.7112.5E34 K60 K61 I62E34-R64 IonicContact OE2-NH2 3.55Å; E34-R64 PolarHBondContact OE2-NH2 3.15Å; E34-R64 VanDerWaalsContact OE2-NH2 3.08Å; K60-R64 WeakPolarHBondContact O-CG 3.37Å; K60-R64 PolarHBondContact O-N 3.2Å; K60-R64 VanDerWaalsContact O-N 3.16Å; K61-R64 PolarHBondContact O-N 3.43Å; I62-R64 VanDerWaalsContact C-N 3.28Å; I62-R64 PolarHBondContact O-N 3.22Å
65S85.9Confident88.7Confident23 Ų2369.6 Ų69.616%0.16132%0.323CS..Hα-helixtrans-86.6-30.4-172.9560000115.5K61 I62 H68K61-S65 PolarHBondContact O-N 3.31Å; K61-S65 PolarHBondContact O-OG 3.19Å; I62-S65 PolarHBondContact O-N 2.77Å; S65-H68 PolarHBondContact O-CE1 3.11Å
66D89.8Confident88.8Confident2 Ų271.7 Ų71.71%0.01133%0.325CS..Hα-helixtrans-117.4-25.2-164.1-70-77.5000114.3I62 H68 R69 F70 P145 C146I62-D66 HydrophobicContact CG2-CB 4.08Å; I62-D66 WeakPolarHBondContact O-CA 3.47Å; I62-D66 WeakPolarHBondContact O-CB 3.38Å; I62-D66 PolarHBondContact O-N 2.99Å; D66-H68 PolarHBondContact O-N 3.15Å; D66-R69 PolarHBondContact O-N 3.07Å; D66-R69 IonicContact OD1-NH1 2.8Å; D66-R69 PolarHBondContact OD1-NH1 2.64Å; D66-F70 HydrophobicContact CB-CD2 3.94Å; D66-F70 HydrophobicContact CB-CE2 3.62Å; D66-F70 HydrophobicContact CB-CZ 4.36Å; D66-F70 VanDerWaalsContact O-CD2 3.32Å; D66-F70 WeakPolarHBondContact O-CD2 3.14Å; D66-F70 PolarHBondContact O-N 3.44Å; D66-P145 VanDerWaalsContact OD1-CA 3.28Å; D66-P145 WeakPolarHBondContact OD1-CA 3.4Å; D66-C146 PolarHBondContact OD1-N 2.77Å; D66-C146 PolarHBondContact OD1-SG 2.75Å
67L90.1Very high88.8Confident18 Ų1870.1 Ų70.19%0.09433%0.333CS..Hα-helixtrans-57-50.2-174-17967.5000112.8L40 L44 L63 R69 F70 R71L40-L67 HydrophobicContact CB-CD2 4.22Å; L40-L67 HydrophobicContact CD1-CD2 4Å; L40-L67 HydrophobicContact CD2-CD2 4.07Å; L40-L67 HydrophobicContact CG-CD2 4.33Å; L44-L67 HydrophobicContact CD2-CD1 4.04Å; L44-L67 HydrophobicContact CG-CD1 4Å; L63-L67 HydrophobicContact CD2-CD2 4.4Å; L63-L67 WeakPolarHBondContact O-CB 3.38Å; L67-R69 VanDerWaalsContact C-N 3.33Å; L67-R69 PolarHBondContact O-N 3.34Å; L67-F70 PolarHBondContact O-N 2.88Å; L67-R71 WeakPolarHBondContact O-CG 3.12Å; L67-R71 PolarHBondContact O-N 3.1Å
68H90.8Very high88.8Confident96 Ų9666.9 Ų66.944%0.44432%0.317SS..Hα-helixtrans-65.5-36.1-178.866.9-85.2000112.2S65 D66 R71 K72S65-H68 PolarHBondContact O-CE1 3.11Å; D66-H68 PolarHBondContact O-N 3.15Å; H68-R71 PolarHBondContact O-N 3.37Å; H68-K72 PolarHBondContact O-N 3.46Å; H68-K72 VanDerWaalsContact O-N 3.11Å
69R91.9Very high88.7Confident16 Ų1667 Ų676%0.0633%0.326CS..Hα-helixtrans-64.7-46.7176.5-66173.558.3-108.8-11.8110.9D66 L67 K72 F73 A139 I142 R144 C146D66-R69 PolarHBondContact O-N 3.07Å; D66-R69 IonicContact OD1-NH1 2.8Å; D66-R69 PolarHBondContact OD1-NH1 2.64Å; L67-R69 VanDerWaalsContact C-N 3.33Å; L67-R69 PolarHBondContact O-N 3.34Å; R69-K72 WeakPolarHBondContact O-CB 3.48Å; R69-K72 PolarHBondContact O-N 3.39Å; R69-F73 HydrophobicContact CB-CE2 4.25Å; R69-F73 WeakPolarHBondContact O-CD2 3.46Å; R69-F73 WeakPolarHBondContact O-CG 3.41Å; R69-F73 PolarHBondContact O-N 3.05Å; R69-A139 VanDerWaalsContact CZ-CB 3.48Å; R69-A139 PolarHBondContact NH2-O 3.42Å; R69-I142 PolarHBondContact NH2-O 2.71Å; R69-R144 PolarHBondContact NH1-O 3.27Å; R69-R144 PolarHBondContact NH2-O 3.05Å; R69-C146 PolarHBondContact NH1-SG 3.33Å
70F90.3Very high88.3Confident7 Ų768.5 Ų68.53%0.03134%0.339CS..Hα-helixtrans-68.3-34.3178.7-66.5-43.1000113.1L44 Y47 M48 D66 L67 K72 F73 K74 P145L44-F70 HydrophobicContact CD2-CB 4.5Å; L44-F70 HydrophobicContact CD2-CD2 3.44Å; L44-F70 VanDerWaalsContact CD2-CD2 3.44Å; L44-F70 HydrophobicContact CD2-CE2 4.11Å; L44-F70 HydrophobicContact CD2-CG 4.43Å; Y47-F70 AromaticContact CD1-CD1 3.4Å; Y47-F70 HydrophobicContact CD1-CD1 3.4Å; Y47-F70 VanDerWaalsContact CD1-CD1 3.4Å; Y47-F70 AromaticContact CD1-CE1 3.73Å; Y47-F70 HydrophobicContact CD1-CE1 3.73Å; Y47-F70 HydrophobicContact CD1-CG 4.06Å; Y47-F70 HydrophobicContact CD2-CB 4.03Å; Y47-F70 HydrophobicContact CD2-CD1 4.35Å; Y47-F70 HydrophobicContact CD2-CG 4.21Å; Y47-F70 AromaticContact CE1-CD1 3.9Å; Y47-F70 HydrophobicContact CE1-CD1 3.9Å; Y47-F70 HydrophobicContact CE1-CE1 4.49Å; Y47-F70 HydrophobicContact CE2-CB 4.25Å; Y47-F70 HydrophobicContact CG-CB 4.2Å; Y47-F70 AromaticContact CG-CD1 3.7Å; Y47-F70 HydrophobicContact CG-CD1 3.7Å; Y47-F70 HydrophobicContact CG-CD2 4.39Å; Y47-F70 HydrophobicContact CG-CE1 4.15Å; Y47-F70 AromaticContact CG-CG 3.86Å; Y47-F70 HydrophobicContact CG-CG 3.86Å; M48-F70 HydrophobicContact CG-CE2 4.49Å; M48-F70 HydrophobicContact SD-CE2 4.35Å; D66-F70 HydrophobicContact CB-CD2 3.94Å; D66-F70 HydrophobicContact CB-CE2 3.62Å; D66-F70 HydrophobicContact CB-CZ 4.36Å; D66-F70 VanDerWaalsContact O-CD2 3.32Å; D66-F70 WeakPolarHBondContact O-CD2 3.14Å; D66-F70 PolarHBondContact O-N 3.44Å; L67-F70 PolarHBondContact O-N 2.88Å; F70-K72 VanDerWaalsContact C-N 3.33Å; F70-K72 PolarHBondContact O-N 3.18Å; F70-F73 AromaticContact CD1-CD2 3.97Å; F70-F73 HydrophobicContact CD1-CD2 3.97Å; F70-F73 PolarHBondContact O-N 3.23Å; F70-K74 WeakPolarHBondContact O-CB 3.35Å; F70-K74 PolarHBondContact O-N 3.45Å; F70-P145 HydrophobicContact CZ-CB 4.41Å; F70-P145 HydrophobicContact CZ-CG 3.98Å
71R91.2Very high88Confident104 Ų10469.5 Ų69.539%0.39234%0.341SS..Hα-helixtrans-59.4-43.8170-75.2177.3173.8175-4.2111.8E43 L67 H68 K74 Q75E43-R71 VanDerWaalsContact CD-NH2 3.29Å; E43-R71 IonicContact OE1-CZ 2.78Å; E43-R71 IonicContact OE1-NH2 3.85Å; E43-R71 PolarHBondContact OE1-NH2 2.96Å; E43-R71 IonicContact OE2-CZ 2.71Å; E43-R71 VanDerWaalsContact OE2-CZ 3.32Å; E43-R71 IonicContact OE2-NE 2.96Å; E43-R71 PolarHBondContact OE2-NE 2.86Å; E43-R71 IonicContact OE2-NH2 3.32Å; E43-R71 PolarHBondContact OE2-NH2 3.49Å; L67-R71 WeakPolarHBondContact O-CG 3.12Å; L67-R71 PolarHBondContact O-N 3.1Å; H68-R71 PolarHBondContact O-N 3.37Å; R71-K74 PolarHBondContact O-N 3.42Å; R71-Q75 WeakPolarHBondContact O-CG 3.31Å; R71-Q75 PolarHBondContact O-N 3.04Å
72K91.4Very high87.4Confident110 Ų11067.5 Ų67.548%0.47834%0.337SS..Hα-helixtrans-61.4-45.3175.2-174.5-178.4176.9-174.50111.6H68 R69 F70 K74 Q75 Q76H68-K72 PolarHBondContact O-N 3.46Å; H68-K72 VanDerWaalsContact O-N 3.11Å; R69-K72 WeakPolarHBondContact O-CB 3.48Å; R69-K72 PolarHBondContact O-N 3.39Å; F70-K72 VanDerWaalsContact C-N 3.33Å; F70-K72 PolarHBondContact O-N 3.18Å; K72-K74 VanDerWaalsContact C-N 3.34Å; K72-K74 PolarHBondContact O-N 3.17Å; K72-Q75 PolarHBondContact O-N 3.31Å; K72-Q76 VanDerWaalsContact O-CG 3.28Å; K72-Q76 WeakPolarHBondContact O-CG 3.12Å; K72-Q76 PolarHBondContact O-N 3.24Å
73F90.9Very high86.7Confident15 Ų1569.9 Ų69.97%0.06637%0.366CS..Hα-helixtrans-63-39.9176.8-67.9-48.5000112.6Y47 R69 F70 Q75 Q76 G77 V78 P143Y47-F73 HydrophobicContact CE1-CB 4.32Å; R69-F73 HydrophobicContact CB-CE2 4.25Å; R69-F73 WeakPolarHBondContact O-CD2 3.46Å; R69-F73 WeakPolarHBondContact O-CG 3.41Å; R69-F73 PolarHBondContact O-N 3.05Å; F70-F73 AromaticContact CD1-CD2 3.97Å; F70-F73 HydrophobicContact CD1-CD2 3.97Å; F70-F73 PolarHBondContact O-N 3.23Å; F73-Q75 PolarHBondContact O-N 3.27Å; F73-Q76 CarbonylContact O-C 3.49Å; F73-Q76 PolarHBondContact O-N 3.31Å; F73-Q76 VanDerWaalsContact O-N 3.15Å; F73-G77 PolarHBondContact O-N 3.45Å; F73-G77 VanDerWaalsContact O-N 3.08Å; F73-V78 HydrophobicContact CB-CB 4.12Å; F73-V78 HydrophobicContact CD1-CB 4.17Å; F73-V78 HydrophobicContact CD1-CG1 4.26Å; F73-V78 HydrophobicContact CD1-CG2 4.44Å; F73-V78 PolarHBondContact O-N 3.09Å; F73-P143 HydrophobicContact CD2-CB 4.38Å; F73-P143 HydrophobicContact CE2-CB 4.43Å
74K88.1Confident86Confident123 Ų12378.9 Ų78.954%0.53540%0.399SS..Hα-helixtrans-62.2-42176.2-169.3167.5-176164.90111.8D46 Y47 F70 R71 K72 Q76 G77D46-K74 IonicContact OD2-NZ 2.84Å; D46-K74 PolarHBondContact OD2-NZ 3.44Å; Y47-K74 HydrophobicContact CE2-CB 4.44Å; Y47-K74 PolarHBondContact OH-N 3.11Å; F70-K74 WeakPolarHBondContact O-CB 3.35Å; F70-K74 PolarHBondContact O-N 3.45Å; R71-K74 PolarHBondContact O-N 3.42Å; K72-K74 VanDerWaalsContact C-N 3.34Å; K72-K74 PolarHBondContact O-N 3.17Å; K74-Q76 VanDerWaalsContact C-N 3.3Å; K74-Q76 PolarHBondContact O-N 3.47Å; K74-G77 PolarHBondContact O-N 3.47Å
75Q89.9Confident85.6Confident169 Ų16972.9 Ų72.979%0.7938%0.377SS*.Hα-helixtrans-64.9-33.4174.3-71172.42.100112.9R71 K72 F73 G77R71-Q75 WeakPolarHBondContact O-CG 3.31Å; R71-Q75 PolarHBondContact O-N 3.04Å; K72-Q75 PolarHBondContact O-N 3.31Å; F73-Q75 PolarHBondContact O-N 3.27Å; Q75-G77 VanDerWaalsContact C-N 3.27Å; Q75-G77 PolarHBondContact O-N 2.91Å
76Q88.4Confident85.5Confident113 Ų11371.9 Ų71.953%0.52837%0.37SS..THydrogen-bonded Turntrans-82.6-1.1177.4-67.9175.1-21.500113.4K72 F73 K74 V78K72-Q76 VanDerWaalsContact O-CG 3.28Å; K72-Q76 WeakPolarHBondContact O-CG 3.12Å; K72-Q76 PolarHBondContact O-N 3.24Å; F73-Q76 CarbonylContact O-C 3.49Å; F73-Q76 PolarHBondContact O-N 3.31Å; F73-Q76 VanDerWaalsContact O-N 3.15Å; K74-Q76 VanDerWaalsContact C-N 3.3Å; K74-Q76 PolarHBondContact O-N 3.47Å; Q76-V78 HydrophobicContact CB-CG2 4Å; Q76-V78 PolarHBondContact O-N 3.03Å
77G86.6Confident84.9Confident62 Ų6277 Ų7764%0.63940%0.401SS*.THydrogen-bonded Turntrans69.417.6-176.300000114.4F73 K74 Q75 P79F73-G77 PolarHBondContact O-N 3.45Å; F73-G77 VanDerWaalsContact O-N 3.08Å; K74-G77 PolarHBondContact O-N 3.47Å; Q75-G77 VanDerWaalsContact C-N 3.27Å; Q75-G77 PolarHBondContact O-N 2.91Å; G77-P79 WeakPolarHBondContact O-CD 3.08Å
78V85.5Confident84.7Confident47 Ų4782.5 Ų82.529%0.28543%0.426SS..  trans-84115.4-179.1179.20000109.7Y47 F73 Q76 P143Y47-V78 PolarHBondContact OH-O 3.46Å; F73-V78 HydrophobicContact CB-CB 4.12Å; F73-V78 HydrophobicContact CD1-CB 4.17Å; F73-V78 HydrophobicContact CD1-CG1 4.26Å; F73-V78 HydrophobicContact CD1-CG2 4.44Å; F73-V78 PolarHBondContact O-N 3.09Å; Q76-V78 HydrophobicContact CB-CG2 4Å; Q76-V78 PolarHBondContact O-N 3.03Å; V78-P143 HydrophobicContact CG1-CB 3.82Å; V78-P143 HydrophobicContact CG1-CG 4.13Å
79P82.4Confident84.5Confident97 Ų9778.2 Ų78.263%0.6341%0.407SS*.PPolyproline II helixtrans-70.8158.6-178.329.6-35000112.3G77 R81G77-P79 WeakPolarHBondContact O-CD 3.08Å; P79-R81 PolarHBondContact O-N 3.15Å
80A80.5Confident84.2Confident34 Ų3478.2 Ų78.228%0.28141%0.408SS..PPolyproline II helixtrans-66.2129.617400000111Y47Y47-A80 HydrophobicContact CD1-CB 3.24Å; Y47-A80 HydrophobicContact CE1-CB 3.72Å; Y47-A80 HydrophobicContact CG-CB 3.74Å
81R80.8Confident84.2Confident66 Ų6681.7 Ų81.725%0.24942%0.424CS..PPolyproline II helixtrans-97.9124.9174.8-75.2-169.8162.5144.3-4.7112P79 E89 P143 R144 D316P79-R81 PolarHBondContact O-N 3.15Å; R81-E89 WeakPolarHBondContact CD-OE1 3.12Å; R81-P143 HydrophobicContact CB-CG 4.26Å; R81-P143 HydrophobicContact CG-CG 4Å; R81-P143 PolarHBondContact N-O 2.97Å; R81-R144 HydrophobicContact CB-CG 4.34Å; R81-R144 PolarHBondContact O-NH1 3.07Å; R81-D316 IonicContact CZ-OD2 3.11Å; R81-D316 IonicContact NE-OD1 2.66Å; R81-D316 IonicContact NH2-OD2 3.15Å; R81-D316 PolarHBondContact NH2-OD2 2.93Å; R81-D316 VanDerWaalsContact NH2-OD2 3.15Å
82L74.4Confident84.3Confident108 Ų10879.8 Ų79.857%0.56542%0.419SS*.  trans-115.2165175-61.3176000110.1
83G74.6Confident84.5Confident68 Ų6874.5 Ų74.570%0.70140%0.397SS*.SBendtrans83.3-141.8176.500000114.9R144G83-R144 PolarHBondContact O-NH1 3.24Å; G83-R144 VanDerWaalsContact O-NH1 3.13Å
84R74.4Confident84.6Confident214 Ų21479.1 Ų79.181%0.80841%0.414SS*.SBendtrans-74.4145.9-173.5-66.9-176.3-179.5-177.82.6110.7R144R84-R144 PolarHBondContact O-NH2 3.36Å
85F80.1Confident85.1Confident39 Ų3977 Ų7717%0.17141%0.406CS..PPolyproline II helixtrans-74129174.4-80-104.8000110.4E89 N90 I93 Q148 V149 R152F85-E89 VanDerWaalsContact CA-OE2 3.26Å; F85-E89 WeakPolarHBondContact CA-OE2 3.5Å; F85-E89 HydrophobicContact CD1-CB 4.03Å; F85-N90 WeakPolarHBondContact CB-OD1 3.27Å; F85-I93 HydrophobicContact CD1-CD1 4.1Å; F85-I93 HydrophobicContact CE1-CD1 4.04Å; F85-Q148 HydrophobicContact CZ-CB 4.36Å; F85-V149 HydrophobicContact CE1-CG2 4.35Å; F85-R152 HydrophobicContact CB-CG 4.46Å; F85-R152 HydrophobicContact CD1-CB 4.3Å; F85-R152 HydrophobicContact CD1-CG 3.8Å; F85-R152 HydrophobicContact CD2-CB 4.2Å; F85-R152 HydrophobicContact CD2-CG 3.93Å; F85-R152 HydrophobicContact CE1-CB 3.91Å; F85-R152 HydrophobicContact CE1-CG 3.92Å; F85-R152 HydrophobicContact CE2-CB 3.81Å; F85-R152 HydrophobicContact CE2-CG 4.06Å; F85-R152 HydrophobicContact CG-CB 4.43Å; F85-R152 HydrophobicContact CG-CG 3.8Å; F85-R152 HydrophobicContact CZ-CB 3.65Å; F85-R152 HydrophobicContact CZ-CG 4.05Å
86S82.6Confident85.4Confident2 Ų269.5 Ų69.51%0.01437%0.371CS..PPolyproline II helixtrans-68.2166.7176.275.50000111.6Q88 E89 N90 D313S86-Q88 VanDerWaalsContact C-N 3.31Å; S86-E89 PolarHBondContact N-OE2 3.23Å; S86-E89 PolarHBondContact O-N 2.96Å; S86-E89 VanDerWaalsContact OG-CG 3.28Å; S86-E89 WeakPolarHBondContact OG-CG 3.49Å; S86-E89 PolarHBondContact OG-N 3.43Å; S86-N90 PolarHBondContact O-N 3.4Å; S86-N90 VanDerWaalsContact O-N 3.09Å; S86-N90 PolarHBondContact O-ND2 3.05Å; S86-D313 VanDerWaalsContact CB-OD2 3.26Å; S86-D313 WeakPolarHBondContact CB-OD2 3.42Å
87V78.4Confident85.8Confident109 Ų10964.2 Ų64.266%0.66135%0.346SS*.Hα-helixtrans-63.3-41.7175.6178.60000110.6N90 Q91V87-N90 PolarHBondContact O-N 2.91Å; V87-Q91 PolarHBondContact O-N 3.35Å
88Q84.9Confident86.2Confident134 Ų13464.3 Ų64.363%0.62634%0.337SS*.Hα-helixtrans-60.7-46.1176.7-65173.1-3.300111.7S86 N90 Q91 Q92S86-Q88 VanDerWaalsContact C-N 3.31Å; Q88-N90 VanDerWaalsContact C-N 3.3Å; Q88-N90 PolarHBondContact O-N 3.29Å; Q88-Q91 WeakPolarHBondContact O-CB 3.5Å; Q88-Q91 PolarHBondContact O-N 3.16Å; Q88-Q91 VanDerWaalsContact O-N 3.1Å; Q88-Q92 PolarHBondContact O-N 3.14Å
89E86.4Confident86.7Confident6 Ų666.8 Ų66.83%0.02835%0.348CS..Hα-helixtrans-61.4-40.9176.9-71.4176.1130.300111.3R81 F85 S86 Q91 Q92 I93 I142 R144R81-E89 WeakPolarHBondContact CD-OE1 3.12Å; F85-E89 VanDerWaalsContact CA-OE2 3.26Å; F85-E89 WeakPolarHBondContact CA-OE2 3.5Å; F85-E89 HydrophobicContact CD1-CB 4.03Å; S86-E89 PolarHBondContact N-OE2 3.23Å; S86-E89 PolarHBondContact O-N 2.96Å; S86-E89 VanDerWaalsContact OG-CG 3.28Å; S86-E89 WeakPolarHBondContact OG-CG 3.49Å; S86-E89 PolarHBondContact OG-N 3.43Å; E89-Q91 VanDerWaalsContact C-N 3.3Å; E89-Q91 PolarHBondContact O-N 2.95Å; E89-Q92 PolarHBondContact O-N 3.38Å; E89-I93 VanDerWaalsContact O-CG1 3.25Å; E89-I93 WeakPolarHBondContact O-CG1 3.46Å; E89-I93 PolarHBondContact O-N 3.39Å; E89-I142 HydrophobicContact CG-CG2 4.29Å; E89-R144 VanDerWaalsContact CD-NE 3.32Å; E89-R144 IonicContact OE1-CZ 2.6Å; E89-R144 IonicContact OE1-NE 3.96Å; E89-R144 PolarHBondContact OE1-NE 2.97Å; E89-R144 IonicContact OE1-NH2 3.48Å; E89-R144 PolarHBondContact OE1-NH2 3.33Å; E89-R144 IonicContact OE2-CZ 3.7Å; E89-R144 IonicContact OE2-NE 2.82Å; E89-R144 PolarHBondContact OE2-NE 2.92Å; E89-R144 IonicContact OE2-NH2 2.84Å; E89-R144 PolarHBondContact OE2-NH2 2.98Å
90N87.2Confident87.3Confident15 Ų1562.2 Ų62.28%0.0832%0.319CS..Hα-helixtrans-65.7-36176.4-64.8-45.1000111.8F85 S86 V87 Q88 I93 R94 R152 M156F85-N90 WeakPolarHBondContact CB-OD1 3.27Å; S86-N90 PolarHBondContact O-N 3.4Å; S86-N90 VanDerWaalsContact O-N 3.09Å; S86-N90 PolarHBondContact O-ND2 3.05Å; V87-N90 PolarHBondContact O-N 2.91Å; Q88-N90 VanDerWaalsContact C-N 3.3Å; Q88-N90 PolarHBondContact O-N 3.29Å; N90-I93 PolarHBondContact O-N 3.07Å; N90-R94 WeakPolarHBondContact O-CG 3.25Å; N90-R94 PolarHBondContact O-N 2.97Å; N90-R152 VanDerWaalsContact CG-NH2 3.32Å; N90-R152 PolarHBondContact ND2-NH2 3.3Å; N90-R152 VanDerWaalsContact OD1-CZ 3.32Å; N90-R152 PolarHBondContact OD1-NE 3.45Å; N90-R152 PolarHBondContact OD1-NH2 2.95Å; N90-M156 HydrophobicContact CB-CE 3.86Å; N90-M156 HydrophobicContact CB-SD 4.16Å; N90-M156 WeakPolarHBondContact O-CE 3.42Å; N90-M156 PolarHBondContact OD1-SD 3.12Å
91Q88.8Confident88Confident80 Ų8062 Ų6237%0.37431%0.313SS..Hα-helixtrans-67.9-45.3176.9-175.753.628.100111.4V87 Q88 E89 I93 R94 E95V87-Q91 PolarHBondContact O-N 3.35Å; Q88-Q91 WeakPolarHBondContact O-CB 3.5Å; Q88-Q91 PolarHBondContact O-N 3.16Å; Q88-Q91 VanDerWaalsContact O-N 3.1Å; E89-Q91 VanDerWaalsContact C-N 3.3Å; E89-Q91 PolarHBondContact O-N 2.95Å; Q91-I93 VanDerWaalsContact C-N 3.27Å; Q91-I93 PolarHBondContact O-N 3.5Å; Q91-R94 WeakPolarHBondContact O-CA 3.47Å; Q91-R94 WeakPolarHBondContact O-CB 3.37Å; Q91-R94 PolarHBondContact O-N 3.25Å; Q91-R94 VanDerWaalsContact OE1-NH1 3.15Å; Q91-E95 WeakPolarHBondContact CG-OE1 3.43Å; Q91-E95 PolarHBondContact NE2-OE1 3.28Å; Q91-E95 PolarHBondContact O-N 3.32Å; Q91-E95 VanDerWaalsContact O-N 3.1Å
92Q94.4Very high88.7Confident64 Ų6464.4 Ų64.430%0.29934%0.335SS..Hα-helixtrans-57.7-39.1174-166.964.463.500112.2Q88 E89 R94 E95 N96 I142Q88-Q92 PolarHBondContact O-N 3.14Å; E89-Q92 PolarHBondContact O-N 3.38Å; Q92-R94 VanDerWaalsContact C-N 3.28Å; Q92-R94 PolarHBondContact O-N 3.2Å; Q92-E95 PolarHBondContact O-N 3.16Å; Q92-N96 PolarHBondContact NE2-OD1 3.45Å; Q92-N96 WeakPolarHBondContact O-CB 3.34Å; Q92-N96 PolarHBondContact O-N 2.71Å; Q92-N96 PolarHBondContact O-ND2 3.06Å; Q92-N96 PolarHBondContact O-OD1 2.71Å; Q92-I142 HydrophobicContact CB-CD1 4.21Å; Q92-I142 HydrophobicContact CB-CG1 4.07Å; Q92-I142 HydrophobicContact CG-CD1 4.18Å; Q92-I142 HydrophobicContact CG-CG1 3.86Å
93I94.7Very high89.7Confident0 Ų062.9 Ų62.90%033%0.326CS..Hα-helixtrans-59.4-39.5174.3-69169.1000111.4F85 E89 N90 Q91 I97 I142 V149 R152 A153 M156 F157F85-I93 HydrophobicContact CD1-CD1 4.1Å; F85-I93 HydrophobicContact CE1-CD1 4.04Å; E89-I93 VanDerWaalsContact O-CG1 3.25Å; E89-I93 WeakPolarHBondContact O-CG1 3.46Å; E89-I93 PolarHBondContact O-N 3.39Å; N90-I93 PolarHBondContact O-N 3.07Å; Q91-I93 VanDerWaalsContact C-N 3.27Å; Q91-I93 PolarHBondContact O-N 3.5Å; I93-I97 HydrophobicContact CG2-CD1 3.87Å; I93-I97 WeakPolarHBondContact O-CB 3.3Å; I93-I97 WeakPolarHBondContact O-CD1 3.45Å; I93-I97 VanDerWaalsContact O-CG1 3.27Å; I93-I97 WeakPolarHBondContact O-CG1 3.38Å; I93-I97 PolarHBondContact O-N 3.42Å; I93-I97 VanDerWaalsContact O-N 3.15Å; I93-I142 HydrophobicContact CD1-CD1 4.31Å; I93-I142 HydrophobicContact CG1-CD1 3.42Å; I93-I142 VanDerWaalsContact CG1-CD1 3.42Å; I93-V149 HydrophobicContact CD1-CG1 3.83Å; I93-V149 HydrophobicContact CG1-CG1 3.69Å; I93-R152 HydrophobicContact CD1-CB 4.14Å; I93-R152 HydrophobicContact CD1-CG 3.66Å; I93-A153 HydrophobicContact CG2-CB 3.83Å; I93-M156 HydrophobicContact CD1-SD 4.29Å; I93-M156 HydrophobicContact CG2-SD 4.41Å; I93-F157 HydrophobicContact CG2-CE2 4.37Å
94R94.4Very high90.5Very high112 Ų11260.6 Ų60.642%0.42330%0.299SS..Hα-helixtrans-66.9-44.2179-63-172.6-175.893.21.1111.2N90 Q91 Q92 I97 S98 M156 F157N90-R94 WeakPolarHBondContact O-CG 3.25Å; N90-R94 PolarHBondContact O-N 2.97Å; Q91-R94 WeakPolarHBondContact O-CA 3.47Å; Q91-R94 WeakPolarHBondContact O-CB 3.37Å; Q91-R94 PolarHBondContact O-N 3.25Å; Q91-R94 VanDerWaalsContact OE1-NH1 3.15Å; Q92-R94 VanDerWaalsContact C-N 3.28Å; Q92-R94 PolarHBondContact O-N 3.2Å; R94-I97 PolarHBondContact O-N 2.96Å; R94-S98 WeakPolarHBondContact O-CB 3.48Å; R94-S98 PolarHBondContact O-N 2.8Å; R94-M156 HydrophobicContact CG-CE 4.16Å; R94-F157 HydrophobicContact CB-CZ 4.47Å; R94-F157 HydrophobicContact CG-CZ 3.93Å
95E96.8Very high91.4Very high79 Ų7953.5 Ų53.537%0.36929%0.292SS..Hα-helixtrans-62.6-51178.5-72163-162.100110.9Q91 Q92 I97 S98 D99Q91-E95 WeakPolarHBondContact CG-OE1 3.43Å; Q91-E95 PolarHBondContact NE2-OE1 3.28Å; Q91-E95 PolarHBondContact O-N 3.32Å; Q91-E95 VanDerWaalsContact O-N 3.1Å; Q92-E95 PolarHBondContact O-N 3.16Å; E95-I97 PolarHBondContact O-N 3.13Å; E95-I97 VanDerWaalsContact O-N 3.15Å; E95-S98 WeakPolarHBondContact O-CA 3.44Å; E95-S98 VanDerWaalsContact O-CB 3.32Å; E95-S98 WeakPolarHBondContact O-CB 3.38Å; E95-S98 PolarHBondContact O-N 2.84Å; E95-D99 PolarHBondContact O-N 3.21Å
96N97.1Very high92Very high11 Ų1152.4 Ų52.46%0.05929%0.288CS..Hα-helixtrans-58.5-34.3178.2-65.9-4.1000112.8Q92 F100 R137 I138 D140Q92-N96 PolarHBondContact NE2-OD1 3.45Å; Q92-N96 WeakPolarHBondContact O-CB 3.34Å; Q92-N96 PolarHBondContact O-N 2.71Å; Q92-N96 PolarHBondContact O-ND2 3.06Å; Q92-N96 PolarHBondContact O-OD1 2.71Å; N96-F100 WeakPolarHBondContact O-CB 3.43Å; N96-F100 PolarHBondContact O-N 2.78Å; N96-F100 VanDerWaalsContact O-N 3.15Å; N96-R137 WeakPolarHBondContact CB-O 3.39Å; N96-R137 PolarHBondContact ND2-O 3.31Å; N96-I138 PolarHBondContact ND2-O 3.2Å; N96-D140 PolarHBondContact ND2-N 3.45Å; N96-D140 PolarHBondContact ND2-O 2.85Å
97I95.8Very high92.3Very high2 Ų255.8 Ų55.81%0.0132%0.324CS..Hα-helixtrans-70.5-46174.5-75.4167.7000110.8I93 R94 E95 D99 F100 L101 V109 L112 L113 I138 A153 F157I93-I97 HydrophobicContact CG2-CD1 3.87Å; I93-I97 WeakPolarHBondContact O-CB 3.3Å; I93-I97 WeakPolarHBondContact O-CD1 3.45Å; I93-I97 VanDerWaalsContact O-CG1 3.27Å; I93-I97 WeakPolarHBondContact O-CG1 3.38Å; I93-I97 PolarHBondContact O-N 3.42Å; I93-I97 VanDerWaalsContact O-N 3.15Å; R94-I97 PolarHBondContact O-N 2.96Å; E95-I97 PolarHBondContact O-N 3.13Å; E95-I97 VanDerWaalsContact O-N 3.15Å; I97-D99 VanDerWaalsContact C-N 3.32Å; I97-D99 PolarHBondContact O-N 2.91Å; I97-F100 PolarHBondContact O-N 3.41Å; I97-L101 HydrophobicContact CG2-CD1 4.19Å; I97-L101 HydrophobicContact CG2-CG 4.41Å; I97-L101 WeakPolarHBondContact O-CG 3.43Å; I97-L101 PolarHBondContact O-N 3.09Å; I97-V109 HydrophobicContact CG2-CG1 3.99Å; I97-V109 HydrophobicContact CG2-CG2 3.92Å; I97-L112 HydrophobicContact CG2-CD2 4.14Å; I97-L113 HydrophobicContact CD1-CD1 4.35Å; I97-I138 HydrophobicContact CD1-CD1 3.98Å; I97-I138 HydrophobicContact CG1-CD1 3.87Å; I97-I138 HydrophobicContact CG1-CG1 4.08Å; I97-A153 HydrophobicContact CD1-CB 4.07Å; I97-F157 HydrophobicContact CD1-CD2 3.84Å; I97-F157 HydrophobicContact CD1-CE2 3.27Å; I97-F157 HydrophobicContact CD1-CZ 3.84Å
98S95.6Very high92.9Very high63 Ų6352.5 Ų52.544%0.44131%0.305SS..Hα-helixtrans-55.4-49.9177.1-176.70000110.6R94 E95 F100 L101 V102R94-S98 WeakPolarHBondContact O-CB 3.48Å; R94-S98 PolarHBondContact O-N 2.8Å; E95-S98 WeakPolarHBondContact O-CA 3.44Å; E95-S98 VanDerWaalsContact O-CB 3.32Å; E95-S98 WeakPolarHBondContact O-CB 3.38Å; E95-S98 PolarHBondContact O-N 2.84Å; S98-F100 VanDerWaalsContact C-N 3.29Å; S98-F100 PolarHBondContact O-N 2.82Å; S98-L101 WeakPolarHBondContact O-CB 3.38Å; S98-L101 PolarHBondContact O-N 3.43Å; S98-L101 VanDerWaalsContact O-N 3.11Å; S98-V102 WeakPolarHBondContact O-CG2 3.45Å; S98-V102 PolarHBondContact O-N 3.01Å
99D96.2Very high93.2Very high99 Ų9947.9 Ų47.953%0.52929%0.286SS..Hα-helixtrans-61.3-39178.9-65.8-14.1000112E95 I97 V102 L103E95-D99 PolarHBondContact O-N 3.21Å; I97-D99 VanDerWaalsContact C-N 3.32Å; I97-D99 PolarHBondContact O-N 2.91Å; D99-V102 PolarHBondContact O-N 3.13Å; D99-L103 WeakPolarHBondContact O-CB 3.42Å; D99-L103 PolarHBondContact O-N 3Å
100F95.9Very high93.4Very high1 Ų151 Ų510%0.00430%0.301CS..Hα-helixtrans-67.2-37.6176.7-166-88.8000112.6N96 I97 S98 L103 T104 I106 L112 K129 H132 F134 R137N96-F100 WeakPolarHBondContact O-CB 3.43Å; N96-F100 PolarHBondContact O-N 2.78Å; N96-F100 VanDerWaalsContact O-N 3.15Å; I97-F100 PolarHBondContact O-N 3.41Å; S98-F100 VanDerWaalsContact C-N 3.29Å; S98-F100 PolarHBondContact O-N 2.82Å; F100-L103 PolarHBondContact O-N 3.47Å; F100-T104 HydrophobicContact CD1-CG2 4.05Å; F100-T104 HydrophobicContact CE1-CG2 3.56Å; F100-T104 HydrophobicContact CE2-CG2 4.27Å; F100-T104 HydrophobicContact CZ-CG2 3.67Å; F100-T104 WeakPolarHBondContact O-CB 3.46Å; F100-T104 WeakPolarHBondContact O-CG2 3.34Å; F100-T104 PolarHBondContact O-N 3.37Å; F100-T104 VanDerWaalsContact O-N 3.08Å; F100-T104 PolarHBondContact O-OG1 2.82Å; F100-I106 HydrophobicContact CE1-CD1 4.4Å; F100-L112 HydrophobicContact CD1-CD1 3.68Å; F100-L112 HydrophobicContact CD1-CD2 3.94Å; F100-L112 HydrophobicContact CD1-CG 4.48Å; F100-L112 HydrophobicContact CE1-CD1 3.61Å; F100-K129 HydrophobicContact CE1-CG 4.44Å; F100-H132 HydrophobicContact CE2-CB 3.68Å; F100-H132 HydrophobicContact CZ-CB 3.95Å; F100-F134 AromaticContact CD1-CD2 3.7Å; F100-F134 HydrophobicContact CD1-CD2 3.7Å; F100-F134 HydrophobicContact CD1-CE2 4.12Å; F100-F134 AromaticContact CD2-CD2 3.89Å; F100-F134 HydrophobicContact CD2-CD2 3.89Å; F100-F134 HydrophobicContact CE1-CB 4.41Å; F100-F134 AromaticContact CE1-CD2 3.66Å; F100-F134 HydrophobicContact CE1-CD2 3.66Å; F100-F134 HydrophobicContact CE1-CE2 4.42Å; F100-F134 HydrophobicContact CE1-CG 4.4Å; F100-F134 HydrophobicContact CE2-CB 3.89Å; F100-F134 AromaticContact CE2-CD2 3.86Å; F100-F134 HydrophobicContact CE2-CD2 3.86Å; F100-F134 HydrophobicContact CE2-CG 4.39Å; F100-F134 AromaticContact CG-CD2 3.82Å; F100-F134 HydrophobicContact CG-CD2 3.82Å; F100-F134 HydrophobicContact CG-CE2 4.29Å; F100-F134 HydrophobicContact CZ-CB 3.75Å; F100-F134 AromaticContact CZ-CD2 3.76Å; F100-F134 HydrophobicContact CZ-CD2 3.76Å; F100-F134 HydrophobicContact CZ-CG 4.2Å; F100-R137 HydrophobicContact CD2-CB 4.04Å; F100-R137 HydrophobicContact CD2-CG 4.31Å
101L95.1Very high93.6Very high29 Ų2952.5 Ų52.515%0.15231%0.306CS..Hα-helixtrans-64.6-45.8175.1-68.8175.5000110.9I97 S98 L103 T104 G105 I106 V109 L112I97-L101 HydrophobicContact CG2-CD1 4.19Å; I97-L101 HydrophobicContact CG2-CG 4.41Å; I97-L101 WeakPolarHBondContact O-CG 3.43Å; I97-L101 PolarHBondContact O-N 3.09Å; S98-L101 WeakPolarHBondContact O-CB 3.38Å; S98-L101 PolarHBondContact O-N 3.43Å; S98-L101 VanDerWaalsContact O-N 3.11Å; L101-L103 VanDerWaalsContact C-N 3.34Å; L101-L103 PolarHBondContact O-N 2.98Å; L101-T104 PolarHBondContact O-N 3.38Å; L101-G105 WeakPolarHBondContact O-CA 3.43Å; L101-G105 PolarHBondContact O-N 3.03Å; L101-I106 HydrophobicContact CD2-CB 3.85Å; L101-I106 HydrophobicContact CD2-CG2 3.93Å; L101-I106 WeakPolarHBondContact CD2-O 3.28Å; L101-V109 HydrophobicContact CD1-CB 4.48Å; L101-V109 HydrophobicContact CD1-CG2 3.61Å; L101-L112 HydrophobicContact CD2-CB 3.99Å; L101-L112 HydrophobicContact CD2-CD2 3.7Å; L101-L112 HydrophobicContact CD2-CG 4.43Å; L101-L112 HydrophobicContact CG-CD2 4.14Å
102V95.3Very high93.8Very high118 Ų11848.7 Ų48.772%0.71529%0.289SS*.Hα-helixtrans-59.1-45.8176.3172.80000111S98 D99 T104S98-V102 WeakPolarHBondContact O-CG2 3.45Å; S98-V102 PolarHBondContact O-N 3.01Å; D99-V102 PolarHBondContact O-N 3.13Å; V102-T104 VanDerWaalsContact C-N 3.34Å; V102-T104 PolarHBondContact O-N 3Å
103L94.1Very high93.7Very high75 Ų7545.6 Ų45.639%0.39327%0.274SS..Hα-helixtrans-61.7-40.3179.3-178.277.7000113.2D99 F100 L101 H132D99-L103 WeakPolarHBondContact O-CB 3.42Å; D99-L103 PolarHBondContact O-N 3Å; F100-L103 PolarHBondContact O-N 3.47Å; L101-L103 VanDerWaalsContact C-N 3.34Å; L101-L103 PolarHBondContact O-N 2.98Å; L103-H132 HydrophobicContact CD2-CB 4.03Å
104T92.8Very high93.4Very high20 Ų2046 Ų4612%0.12328%0.276CS..Hα-helixtrans-100-11.6-169.5580000114.3F100 L101 V102 I106 H132F100-T104 HydrophobicContact CD1-CG2 4.05Å; F100-T104 HydrophobicContact CE1-CG2 3.56Å; F100-T104 HydrophobicContact CE2-CG2 4.27Å; F100-T104 HydrophobicContact CZ-CG2 3.67Å; F100-T104 WeakPolarHBondContact O-CB 3.46Å; F100-T104 WeakPolarHBondContact O-CG2 3.34Å; F100-T104 PolarHBondContact O-N 3.37Å; F100-T104 VanDerWaalsContact O-N 3.08Å; F100-T104 PolarHBondContact O-OG1 2.82Å; L101-T104 PolarHBondContact O-N 3.38Å; V102-T104 VanDerWaalsContact C-N 3.34Å; V102-T104 PolarHBondContact O-N 3Å; T104-I106 PolarHBondContact O-N 2.94Å; T104-I106 WeakPolarHBondContact OG1-CD1 3.08Å; T104-I106 WeakPolarHBondContact OG1-CG1 3.32Å; T104-H132 HydrophobicContact CG2-CB 4.47Å
105G91.9Very high93.2Very high65 Ų6541.1 Ų41.167%0.6726%0.259SS*.THydrogen-bonded Turntrans67.816.7-17600000114.2L101 G107L101-G105 WeakPolarHBondContact O-CA 3.43Å; L101-G105 PolarHBondContact O-N 3.03Å; G105-G107 PolarHBondContact O-N 3.48Å
106I93.2Very high92.6Very high17 Ų1741.5 Ų41.59%0.08726%0.26CS..  trans-69.6125.8177.3-65.7168.6000108.6F100 L101 T104 S108 K111 L112 I125 L128F100-I106 HydrophobicContact CE1-CD1 4.4Å; L101-I106 HydrophobicContact CD2-CB 3.85Å; L101-I106 HydrophobicContact CD2-CG2 3.93Å; L101-I106 WeakPolarHBondContact CD2-O 3.28Å; T104-I106 PolarHBondContact O-N 2.94Å; T104-I106 WeakPolarHBondContact OG1-CD1 3.08Å; T104-I106 WeakPolarHBondContact OG1-CG1 3.32Å; I106-S108 VanDerWaalsContact C-N 3.29Å; I106-S108 PolarHBondContact O-N 3.29Å; I106-K111 HydrophobicContact CG2-CB 3.95Å; I106-L112 HydrophobicContact CD1-CD1 3.88Å; I106-L112 HydrophobicContact CG2-CB 4.28Å; I106-I125 HydrophobicContact CD1-CG2 4.24Å; I106-L128 HydrophobicContact CD1-CD1 4.15Å; I106-L128 HydrophobicContact CG1-CD1 3.98Å
107G88.6Confident92Very high73 Ų7344.7 Ų44.775%0.75327%0.272SS*.SBendtrans-71.2-11.1-169.500000116.8G105G105-G107 PolarHBondContact O-N 3.48Å
108S92.4Very high91.6Very high39 Ų3947.1 Ų47.127%0.27328%0.282SS..  trans-158154.5175.676.10000114.1I106 E110 K111 L112I106-S108 VanDerWaalsContact C-N 3.29Å; I106-S108 PolarHBondContact O-N 3.29Å; S108-E110 PolarHBondContact O-N 2.77Å; S108-K111 PolarHBondContact O-N 3.48Å; S108-K111 WeakPolarHBondContact OG-CG 3.19Å; S108-K111 PolarHBondContact OG-N 3.37Å; S108-K111 VanDerWaalsContact OG-N 3.13Å; S108-L112 PolarHBondContact O-N 3.18Å
109V91.4Very high91.2Very high38 Ų3851 Ų5123%0.2330%0.297CS..Hα-helixtrans-59.7-37.2172.2-177.20000111I97 L101 K111 L112 L113 F157I97-V109 HydrophobicContact CG2-CG1 3.99Å; I97-V109 HydrophobicContact CG2-CG2 3.92Å; L101-V109 HydrophobicContact CD1-CB 4.48Å; L101-V109 HydrophobicContact CD1-CG2 3.61Å; V109-K111 PolarHBondContact O-N 3.05Å; V109-L112 PolarHBondContact O-N 3.45Å; V109-L113 HydrophobicContact CG1-CD1 3.65Å; V109-L113 HydrophobicContact CG1-CG 4.1Å; V109-L113 WeakPolarHBondContact O-CB 3.35Å; V109-L113 PolarHBondContact O-N 2.99Å; V109-F157 HydrophobicContact CB-CD1 4.36Å; V109-F157 HydrophobicContact CG1-CB 3.97Å; V109-F157 HydrophobicContact CG1-CD1 3.54Å; V109-F157 HydrophobicContact CG1-CD2 4.26Å; V109-F157 HydrophobicContact CG1-CE1 3.97Å; V109-F157 HydrophobicContact CG1-CG 3.67Å; V109-F157 HydrophobicContact CG1-CZ 4.5Å; V109-F157 HydrophobicContact CG2-CE1 4.39Å
110E90.4Very high90.9Very high71 Ų7155.4 Ų55.433%0.33231%0.314SS..Hα-helixtrans-63.3-43.9-180-164.2-170.8-178.600111.5S108 L112 L113 F114 R117 F118S108-E110 PolarHBondContact O-N 2.77Å; E110-L112 VanDerWaalsContact C-N 3.33Å; E110-L112 PolarHBondContact O-N 3.5Å; E110-L113 PolarHBondContact O-N 2.98Å; E110-F114 HydrophobicContact CG-CD2 3.88Å; E110-F114 CarbonylContact O-C 3.3Å; E110-F114 WeakPolarHBondContact O-CA 3.12Å; E110-F114 WeakPolarHBondContact O-CB 3.48Å; E110-F114 PolarHBondContact O-N 3.14Å; E110-R117 VanDerWaalsContact OE1-CD 3.24Å; E110-R117 WeakPolarHBondContact OE1-CD 3.25Å; E110-R117 IonicContact OE1-CZ 3.57Å; E110-R117 IonicContact OE1-NE 3.48Å; E110-R117 IonicContact OE1-NH1 2.74Å; E110-R117 PolarHBondContact OE1-NH1 3.02Å; E110-F118 HydrophobicContact CB-CE2 4.46Å; E110-F118 HydrophobicContact CG-CE2 4.1Å; E110-F118 HydrophobicContact CG-CZ 4.37Å
111K91.4Very high90.6Very high46 Ų4659.1 Ų59.120%0.233%0.332CS..Hα-helixtrans-60.9-42.8175-75.2179.4177-158.90111.5I106 S108 V109 P115 F118 E121 I125I106-K111 HydrophobicContact CG2-CB 3.95Å; S108-K111 PolarHBondContact O-N 3.48Å; S108-K111 WeakPolarHBondContact OG-CG 3.19Å; S108-K111 PolarHBondContact OG-N 3.37Å; S108-K111 VanDerWaalsContact OG-N 3.13Å; V109-K111 PolarHBondContact O-N 3.05Å; K111-P115 WeakPolarHBondContact O-CA 3.4Å; K111-F118 HydrophobicContact CB-CD2 4.3Å; K111-F118 HydrophobicContact CB-CE2 4.31Å; K111-F118 HydrophobicContact CG-CD1 4.15Å; K111-F118 HydrophobicContact CG-CD2 3.71Å; K111-F118 HydrophobicContact CG-CE1 4.08Å; K111-F118 HydrophobicContact CG-CE2 3.63Å; K111-F118 HydrophobicContact CG-CG 3.97Å; K111-F118 HydrophobicContact CG-CZ 3.83Å; K111-E121 WeakPolarHBondContact CE-OE1 3.22Å; K111-E121 IonicContact NZ-OE1 2.84Å; K111-E121 PolarHBondContact NZ-OE1 2.81Å; K111-E121 IonicContact NZ-OE2 2.8Å; K111-E121 PolarHBondContact NZ-OE2 3Å; K111-I125 HydrophobicContact CB-CD1 3.95Å
112L92.6Very high90.3Very high0 Ų059.9 Ų59.90%033%0.334CS..Hα-helixtrans-64.5-44180175.962.1000113.1I97 F100 L101 I106 S108 V109 E110 K129 F134I97-L112 HydrophobicContact CG2-CD2 4.14Å; F100-L112 HydrophobicContact CD1-CD1 3.68Å; F100-L112 HydrophobicContact CD1-CD2 3.94Å; F100-L112 HydrophobicContact CD1-CG 4.48Å; F100-L112 HydrophobicContact CE1-CD1 3.61Å; L101-L112 HydrophobicContact CD2-CB 3.99Å; L101-L112 HydrophobicContact CD2-CD2 3.7Å; L101-L112 HydrophobicContact CD2-CG 4.43Å; L101-L112 HydrophobicContact CG-CD2 4.14Å; I106-L112 HydrophobicContact CD1-CD1 3.88Å; I106-L112 HydrophobicContact CG2-CB 4.28Å; S108-L112 PolarHBondContact O-N 3.18Å; V109-L112 PolarHBondContact O-N 3.45Å; E110-L112 VanDerWaalsContact C-N 3.33Å; E110-L112 PolarHBondContact O-N 3.5Å; L112-K129 HydrophobicContact CD1-CD 4.1Å; L112-K129 HydrophobicContact CD1-CG 4.03Å; L112-K129 PolarHBondContact O-NZ 3.3Å; L112-F134 HydrophobicContact CD1-CD2 4Å; L112-F134 HydrophobicContact CD1-CE2 3.75Å; L112-F134 HydrophobicContact CD1-CZ 4.23Å; L112-F134 HydrophobicContact CD2-CE2 3.78Å; L112-F134 HydrophobicContact CD2-CZ 4.34Å; L112-F134 HydrophobicContact CG-CE2 3.89Å; L112-F134 HydrophobicContact CG-CZ 4.14Å
113L91.2Very high90.2Very high0 Ų057.8 Ų57.80%033%0.329CS..Hα-helixtrans-91.2-32.4-173.6-69.1-175.7000113.5I97 V109 E110 P115 F134 Y150 A153 L154 F157I97-L113 HydrophobicContact CD1-CD1 4.35Å; V109-L113 HydrophobicContact CG1-CD1 3.65Å; V109-L113 HydrophobicContact CG1-CG 4.1Å; V109-L113 WeakPolarHBondContact O-CB 3.35Å; V109-L113 PolarHBondContact O-N 2.99Å; E110-L113 PolarHBondContact O-N 2.98Å; L113-P115 WeakPolarHBondContact O-CD 3.46Å; L113-F134 HydrophobicContact CD2-CZ 3.89Å; L113-Y150 HydrophobicContact CD2-CE2 4.17Å; L113-A153 HydrophobicContact CD1-CB 4.43Å; L113-A153 HydrophobicContact CD2-CB 4.43Å; L113-L154 HydrophobicContact CB-CD2 4Å; L113-L154 HydrophobicContact CD2-CD2 4.38Å; L113-L154 WeakPolarHBondContact O-CD2 3.49Å; L113-F157 HydrophobicContact CD1-CB 3.55Å; L113-F157 HydrophobicContact CD1-CD2 3.72Å; L113-F157 HydrophobicContact CD1-CG 3.86Å
114F89.9Confident90.1Very high9 Ų957 Ų574%0.03933%0.333CS..  trans-122.454.3-178.7-47.4-78.1000112.7E110 Q116 R117 L154 F157 D158E110-F114 HydrophobicContact CG-CD2 3.88Å; E110-F114 CarbonylContact O-C 3.3Å; E110-F114 WeakPolarHBondContact O-CA 3.12Å; E110-F114 WeakPolarHBondContact O-CB 3.48Å; E110-F114 PolarHBondContact O-N 3.14Å; F114-Q116 VanDerWaalsContact C-OE1 3.28Å; F114-Q116 PolarHBondContact O-N 3.39Å; F114-R117 HydrophobicContact CB-CG 4.07Å; F114-R117 WeakPolarHBondContact O-CB 3.33Å; F114-R117 PolarHBondContact O-N 3.49Å; F114-L154 HydrophobicContact CD1-CD2 4.33Å; F114-L154 HydrophobicContact CE1-CD2 3.79Å; F114-L154 HydrophobicContact CZ-CD2 4.13Å; F114-L154 WeakPolarHBondContact CZ-O 3.28Å; F114-F157 WeakPolarHBondContact CE2-O 3.34Å; F114-D158 HydrophobicContact CE1-CB 4.1Å; F114-D158 HydrophobicContact CE2-CB 4.32Å; F114-D158 HydrophobicContact CZ-CB 3.57Å
115P88.7Confident90.1Very high9 Ų956.2 Ų56.26%0.05833%0.329CS..G310 helixtrans-60.9-19.5-176.927.5-36.8000113.1K111 L113 R117 F118 Q122 I125K111-P115 WeakPolarHBondContact O-CA 3.4Å; L113-P115 WeakPolarHBondContact O-CD 3.46Å; P115-R117 PolarHBondContact O-N 3.19Å; P115-F118 CarbonylContact O-C 3.5Å; P115-F118 PolarHBondContact O-N 2.85Å; P115-F118 VanDerWaalsContact O-N 3.1Å; P115-Q122 HydrophobicContact CB-CG 4.15Å; P115-I125 HydrophobicContact CB-CB 4.34Å; P115-I125 HydrophobicContact CB-CD1 4.35Å; P115-I125 HydrophobicContact CB-CG2 4.06Å
116Q83.8Confident90.2Very high86 Ų8659.8 Ų59.840%0.40232%0.322SS..G310 helixtrans-63.6-18.4173.167.3-82.76.400114.7F114 F118F114-Q116 VanDerWaalsContact C-OE1 3.28Å; F114-Q116 PolarHBondContact O-N 3.39Å; Q116-F118 VanDerWaalsContact C-N 3.3Å
117R84.9Confident90.2Very high78 Ų7865.3 Ų65.329%0.29435%0.345SS..G310 helixtrans-78.8-18.4174.6-62.2-179.8-176176.84111.6E110 F114 P115 D158E110-R117 VanDerWaalsContact OE1-CD 3.24Å; E110-R117 WeakPolarHBondContact OE1-CD 3.25Å; E110-R117 IonicContact OE1-CZ 3.57Å; E110-R117 IonicContact OE1-NE 3.48Å; E110-R117 IonicContact OE1-NH1 2.74Å; E110-R117 PolarHBondContact OE1-NH1 3.02Å; F114-R117 HydrophobicContact CB-CG 4.07Å; F114-R117 WeakPolarHBondContact O-CB 3.33Å; F114-R117 PolarHBondContact O-N 3.49Å; P115-R117 PolarHBondContact O-N 3.19Å; R117-D158 IonicContact CZ-OD1 3.36Å; R117-D158 IonicContact NH1-OD1 3.73Å; R117-D158 IonicContact NH2-OD1 2.84Å; R117-D158 PolarHBondContact NH2-OD1 3.08Å
118F88.1Confident90.4Very high53 Ų5364 Ų6423%0.23232%0.32CS..  trans-121.179.1-174.2-55.4-83.7000109.8E110 K111 P115 Q116 E120 E121 Q122E110-F118 HydrophobicContact CB-CE2 4.46Å; E110-F118 HydrophobicContact CG-CE2 4.1Å; E110-F118 HydrophobicContact CG-CZ 4.37Å; K111-F118 HydrophobicContact CB-CD2 4.3Å; K111-F118 HydrophobicContact CB-CE2 4.31Å; K111-F118 HydrophobicContact CG-CD1 4.15Å; K111-F118 HydrophobicContact CG-CD2 3.71Å; K111-F118 HydrophobicContact CG-CE1 4.08Å; K111-F118 HydrophobicContact CG-CE2 3.63Å; K111-F118 HydrophobicContact CG-CG 3.97Å; K111-F118 HydrophobicContact CG-CZ 3.83Å; P115-F118 CarbonylContact O-C 3.5Å; P115-F118 PolarHBondContact O-N 2.85Å; P115-F118 VanDerWaalsContact O-N 3.1Å; Q116-F118 VanDerWaalsContact C-N 3.3Å; F118-E120 VanDerWaalsContact C-N 3.28Å; F118-E120 PolarHBondContact O-N 3.12Å; F118-E121 HydrophobicContact CB-CB 4.42Å; F118-E121 PolarHBondContact O-N 3.22Å; F118-Q122 WeakPolarHBondContact O-CB 3.49Å; F118-Q122 PolarHBondContact O-N 3.29Å
119I86.9Confident90.5Very high145 Ų14563.5 Ų63.574%0.74431%0.313SS*.THydrogen-bonded Turntrans-57-41-169.4-66.1162.4000112.2Q122I119-Q122 WeakPolarHBondContact O-CB 3.35Å
120E89.3Confident90.5Very high192 Ų19270.4 Ų70.490%0.89734%0.34SS*.THydrogen-bonded Turntrans-66.2-45.7-178.1-62.9175.1-175.900112.1F118F118-E120 VanDerWaalsContact C-N 3.28Å; F118-E120 PolarHBondContact O-N 3.12Å
121E89.5Confident90.7Very high79 Ų7972.7 Ų72.737%0.36935%0.351SS..THydrogen-bonded Turntrans-85.7-11.5-177.3-64.8175.7-113.600113K111 F118 A123 A124 I125K111-E121 WeakPolarHBondContact CE-OE1 3.22Å; K111-E121 IonicContact NZ-OE1 2.84Å; K111-E121 PolarHBondContact NZ-OE1 2.81Å; K111-E121 IonicContact NZ-OE2 2.8Å; K111-E121 PolarHBondContact NZ-OE2 3Å; F118-E121 HydrophobicContact CB-CB 4.42Å; F118-E121 PolarHBondContact O-N 3.22Å; E121-A123 VanDerWaalsContact C-N 3.31Å; E121-A123 PolarHBondContact O-N 2.75Å; E121-A124 PolarHBondContact O-N 2.97Å; E121-A124 VanDerWaalsContact O-N 3.16Å; E121-I125 HydrophobicContact CB-CD1 3.85Å; E121-I125 HydrophobicContact CB-CG1 4.44Å; E121-I125 WeakPolarHBondContact O-CG1 3.24Å; E121-I125 PolarHBondContact O-N 3.26Å
122Q90.3Very high90.8Very high45 Ų4573.5 Ų73.521%0.2136%0.356CS..Hα-helixtrans-54.3-44-172.2-172-171.6-109.700113.1P115 F118 I119 R126P115-Q122 HydrophobicContact CB-CG 4.15Å; F118-Q122 WeakPolarHBondContact O-CB 3.49Å; F118-Q122 PolarHBondContact O-N 3.29Å; I119-Q122 WeakPolarHBondContact O-CB 3.35Å; Q122-R126 VanDerWaalsContact CD-CZ 3.49Å; Q122-R126 VanDerWaalsContact NE2-NH2 3.17Å; Q122-R126 WeakPolarHBondContact O-CB 3.24Å; Q122-R126 VanDerWaalsContact O-CG 3.28Å; Q122-R126 WeakPolarHBondContact O-CG 3.26Å; Q122-R126 PolarHBondContact O-N 3.33Å; Q122-R126 VanDerWaalsContact O-N 3.07Å
123A92Very high90.7Very high73 Ų7374.8 Ų74.860%0.60337%0.369SS*.Hα-helixtrans-68.7-42.3-177.600000111.6E121 R126 K127E121-A123 VanDerWaalsContact C-N 3.31Å; E121-A123 PolarHBondContact O-N 2.75Å; A123-R126 PolarHBondContact O-N 2.83Å; A123-K127 PolarHBondContact O-N 3.21Å
124A93.1Very high90.9Very high58 Ų5875 Ų7548%0.47937%0.37SS..Hα-helixtrans-63.5-47.1177.300000111.3E121 R126 K127 L128E121-A124 PolarHBondContact O-N 2.97Å; E121-A124 VanDerWaalsContact O-N 3.16Å; A124-R126 VanDerWaalsContact C-N 3.34Å; A124-R126 PolarHBondContact O-N 2.87Å; A124-K127 WeakPolarHBondContact O-CB 3.33Å; A124-K127 PolarHBondContact O-N 2.73Å; A124-K127 VanDerWaalsContact O-N 3.12Å; A124-L128 PolarHBondContact O-N 2.85Å
125I92.5Very high91Very high5 Ų578 Ų783%0.02639%0.385CS..Hα-helixtrans-61.3-42.9178.1-65.6163.1000111I106 K111 P115 E121 K127 L128 K129I106-I125 HydrophobicContact CD1-CG2 4.24Å; K111-I125 HydrophobicContact CB-CD1 3.95Å; P115-I125 HydrophobicContact CB-CB 4.34Å; P115-I125 HydrophobicContact CB-CD1 4.35Å; P115-I125 HydrophobicContact CB-CG2 4.06Å; E121-I125 HydrophobicContact CB-CD1 3.85Å; E121-I125 HydrophobicContact CB-CG1 4.44Å; E121-I125 WeakPolarHBondContact O-CG1 3.24Å; E121-I125 PolarHBondContact O-N 3.26Å; I125-K127 VanDerWaalsContact C-N 3.3Å; I125-K127 PolarHBondContact O-N 3.16Å; I125-L128 PolarHBondContact O-N 3.46Å; I125-K129 HydrophobicContact CG2-CD 4.01Å; I125-K129 HydrophobicContact CG2-CG 4.41Å; I125-K129 VanDerWaalsContact O-CG 3.3Å; I125-K129 WeakPolarHBondContact O-CG 3.28Å; I125-K129 PolarHBondContact O-N 3.18Å
126R92.7Very high91.2Very high139 Ų13981.4 Ų81.453%0.52540%0.4SS..Hα-helixtrans-62.4-37.6176.3-75.6178.1-173.1173.17.5112.4Q122 A123 A124 K130Q122-R126 VanDerWaalsContact CD-CZ 3.49Å; Q122-R126 VanDerWaalsContact NE2-NH2 3.17Å; Q122-R126 WeakPolarHBondContact O-CB 3.24Å; Q122-R126 VanDerWaalsContact O-CG 3.28Å; Q122-R126 WeakPolarHBondContact O-CG 3.26Å; Q122-R126 PolarHBondContact O-N 3.33Å; Q122-R126 VanDerWaalsContact O-N 3.07Å; A123-R126 PolarHBondContact O-N 2.83Å; A124-R126 VanDerWaalsContact C-N 3.34Å; A124-R126 PolarHBondContact O-N 2.87Å; R126-K130 PolarHBondContact O-N 3.43Å; R126-K130 VanDerWaalsContact O-N 3.16Å
127K93.8Very high91.7Very high134 Ų13482.7 Ų82.758%0.58340%0.401SS*.Hα-helixtrans-63.4-49176-173.3-178.3175.1-175.40110.7A123 A124 I125 K129 K130 Q131A123-K127 PolarHBondContact O-N 3.21Å; A124-K127 WeakPolarHBondContact O-CB 3.33Å; A124-K127 PolarHBondContact O-N 2.73Å; A124-K127 VanDerWaalsContact O-N 3.12Å; I125-K127 VanDerWaalsContact C-N 3.3Å; I125-K127 PolarHBondContact O-N 3.16Å; K127-K129 PolarHBondContact O-N 3.36Å; K127-K130 PolarHBondContact O-N 2.88Å; K127-K130 VanDerWaalsContact O-N 3.14Å; K127-Q131 HydrophobicContact CG-CG 4.43Å; K127-Q131 WeakPolarHBondContact O-CG 3.26Å; K127-Q131 PolarHBondContact O-N 3.03Å
128L93.9Very high92.2Very high44 Ų4479 Ų7923%0.2339%0.387CS..Hα-helixtrans-58.9-45177-70.8170.1000112.1I106 A124 I125 K130 Q131 H132I106-L128 HydrophobicContact CD1-CD1 4.15Å; I106-L128 HydrophobicContact CG1-CD1 3.98Å; A124-L128 PolarHBondContact O-N 2.85Å; I125-L128 PolarHBondContact O-N 3.46Å; L128-K130 VanDerWaalsContact C-N 3.26Å; L128-K130 PolarHBondContact O-N 3.14Å; L128-Q131 PolarHBondContact O-N 3Å; L128-H132 PolarHBondContact O-CD2 3.49Å; L128-H132 PolarHBondContact O-N 2.87Å
129K93.6Very high92.5Very high29 Ų2976.5 Ų76.513%0.12638%0.376CS..Hα-helixtrans-59.1-37.1176.9-70.8176.382.3161.90112.8F100 L112 I125 K127 G133 F134F100-K129 HydrophobicContact CE1-CG 4.44Å; L112-K129 HydrophobicContact CD1-CD 4.1Å; L112-K129 HydrophobicContact CD1-CG 4.03Å; L112-K129 PolarHBondContact O-NZ 3.3Å; I125-K129 HydrophobicContact CG2-CD 4.01Å; I125-K129 HydrophobicContact CG2-CG 4.41Å; I125-K129 VanDerWaalsContact O-CG 3.3Å; I125-K129 WeakPolarHBondContact O-CG 3.28Å; I125-K129 PolarHBondContact O-N 3.18Å; K127-K129 PolarHBondContact O-N 3.36Å; K129-G133 PolarHBondContact O-N 3.11Å; K129-F134 HydrophobicContact CB-CB 3.77Å; K129-F134 HydrophobicContact CB-CG 4.34Å; K129-F134 HydrophobicContact CD-CD1 4.33Å; K129-F134 HydrophobicContact CD-CG 4.44Å; K129-F134 HydrophobicContact CG-CB 3.97Å; K129-F134 HydrophobicContact CG-CD1 4.39Å; K129-F134 HydrophobicContact CG-CG 4.04Å; K129-F134 WeakPolarHBondContact O-CB 3.39Å; K129-F134 PolarHBondContact O-N 2.89Å
130K92.7Very high92.8Very high183 Ų18373.9 Ų73.980%0.79636%0.364SS*.Hα-helixtrans-73.7-44.1176.8-171.6-178.3178.8-173.20111.5R126 K127 L128 H132R126-K130 PolarHBondContact O-N 3.43Å; R126-K130 VanDerWaalsContact O-N 3.16Å; K127-K130 PolarHBondContact O-N 2.88Å; K127-K130 VanDerWaalsContact O-N 3.14Å; L128-K130 VanDerWaalsContact C-N 3.26Å; L128-K130 PolarHBondContact O-N 3.14Å; K130-H132 PolarHBondContact O-N 2.78Å
131Q93.8Very high92.9Very high119 Ų11966.9 Ų66.956%0.55634%0.343SS*.Hα-helixtrans-62.9-40.8-178.4-75.6175.7-46.300112.5K127 L128K127-Q131 HydrophobicContact CG-CG 4.43Å; K127-Q131 WeakPolarHBondContact O-CG 3.26Å; K127-Q131 PolarHBondContact O-N 3.03Å; L128-Q131 PolarHBondContact O-N 3Å
132H92.9Very high93Very high64 Ų6463.2 Ų63.230%0.29633%0.326SS..THydrogen-bonded Turntrans-99.910.5-175.9-65-80.2000114.3F100 L103 T104 L128 K130 R137F100-H132 HydrophobicContact CE2-CB 3.68Å; F100-H132 HydrophobicContact CZ-CB 3.95Å; L103-H132 HydrophobicContact CD2-CB 4.03Å; T104-H132 HydrophobicContact CG2-CB 4.47Å; L128-H132 PolarHBondContact O-CD2 3.49Å; L128-H132 PolarHBondContact O-N 2.87Å; K130-H132 PolarHBondContact O-N 2.78Å; H132-R137 PolarHBondContact O-NE 3.44Å
133G92Very high93Very high27 Ų2761.4 Ų61.428%0.27832%0.318SS..THydrogen-bonded Turntrans62.146.8175.700000113.7K129 M135 E136 R137K129-G133 PolarHBondContact O-N 3.11Å; G133-M135 VanDerWaalsContact C-N 3.25Å; G133-M135 PolarHBondContact O-N 3.44Å; G133-E136 PolarHBondContact O-N 3.49Å; G133-R137 PolarHBondContact O-N 3.08Å; G133-R137 VanDerWaalsContact O-N 3.17Å
134F94.4Very high93Very high5 Ų558.1 Ų58.12%0.02229%0.29CS..Hα-helixtrans-50.3-39.6-171.1173.5-106.5000115.1F100 L112 L113 K129 E136 R137 I138 Y150F100-F134 AromaticContact CD1-CD2 3.7Å; F100-F134 HydrophobicContact CD1-CD2 3.7Å; F100-F134 HydrophobicContact CD1-CE2 4.12Å; F100-F134 AromaticContact CD2-CD2 3.89Å; F100-F134 HydrophobicContact CD2-CD2 3.89Å; F100-F134 HydrophobicContact CE1-CB 4.41Å; F100-F134 AromaticContact CE1-CD2 3.66Å; F100-F134 HydrophobicContact CE1-CD2 3.66Å; F100-F134 HydrophobicContact CE1-CE2 4.42Å; F100-F134 HydrophobicContact CE1-CG 4.4Å; F100-F134 HydrophobicContact CE2-CB 3.89Å; F100-F134 AromaticContact CE2-CD2 3.86Å; F100-F134 HydrophobicContact CE2-CD2 3.86Å; F100-F134 HydrophobicContact CE2-CG 4.39Å; F100-F134 AromaticContact CG-CD2 3.82Å; F100-F134 HydrophobicContact CG-CD2 3.82Å; F100-F134 HydrophobicContact CG-CE2 4.29Å; F100-F134 HydrophobicContact CZ-CB 3.75Å; F100-F134 AromaticContact CZ-CD2 3.76Å; F100-F134 HydrophobicContact CZ-CD2 3.76Å; F100-F134 HydrophobicContact CZ-CG 4.2Å; L112-F134 HydrophobicContact CD1-CD2 4Å; L112-F134 HydrophobicContact CD1-CE2 3.75Å; L112-F134 HydrophobicContact CD1-CZ 4.23Å; L112-F134 HydrophobicContact CD2-CE2 3.78Å; L112-F134 HydrophobicContact CD2-CZ 4.34Å; L112-F134 HydrophobicContact CG-CE2 3.89Å; L112-F134 HydrophobicContact CG-CZ 4.14Å; L113-F134 HydrophobicContact CD2-CZ 3.89Å; K129-F134 HydrophobicContact CB-CB 3.77Å; K129-F134 HydrophobicContact CB-CG 4.34Å; K129-F134 HydrophobicContact CD-CD1 4.33Å; K129-F134 HydrophobicContact CD-CG 4.44Å; K129-F134 HydrophobicContact CG-CB 3.97Å; K129-F134 HydrophobicContact CG-CD1 4.39Å; K129-F134 HydrophobicContact CG-CG 4.04Å; K129-F134 WeakPolarHBondContact O-CB 3.39Å; K129-F134 PolarHBondContact O-N 2.89Å; F134-E136 VanDerWaalsContact C-N 3.32Å; F134-E136 PolarHBondContact O-N 2.85Å; F134-R137 PolarHBondContact O-N 3.01Å; F134-I138 HydrophobicContact CE1-CD1 4.34Å; F134-I138 HydrophobicContact CE2-CB 4.33Å; F134-I138 HydrophobicContact CE2-CD1 4.27Å; F134-I138 HydrophobicContact CZ-CB 4.35Å; F134-I138 HydrophobicContact CZ-CD1 3.7Å; F134-I138 WeakPolarHBondContact O-CG2 3.28Å; F134-I138 PolarHBondContact O-N 2.97Å; F134-Y150 AromaticContact CE1-CD2 3.74Å; F134-Y150 HydrophobicContact CE1-CD2 3.74Å; F134-Y150 AromaticContact CE1-CE2 3.69Å; F134-Y150 HydrophobicContact CE1-CE2 3.69Å; F134-Y150 HydrophobicContact CZ-CD2 4.45Å; F134-Y150 HydrophobicContact CZ-CE2 4.44Å
135M92.6Very high92.9Very high72 Ų7255.7 Ų55.736%0.35527%0.27SS..Hα-helixtrans-66.4-33.3-177.3-67.8-62.9-119.400112.9G133 I138 C146 Y150G133-M135 VanDerWaalsContact C-N 3.25Å; G133-M135 PolarHBondContact O-N 3.44Å; M135-I138 WeakPolarHBondContact O-CG2 3.48Å; M135-C146 HydrophobicContact CB-CB 4.4Å; M135-C146 WeakPolarHBondContact O-CB 3.33Å; M135-C146 PolarHBondContact O-SG 3.43Å; M135-Y150 HydrophobicContact CE-CD1 3.84Å; M135-Y150 HydrophobicContact CE-CE1 4.4Å; M135-Y150 HydrophobicContact CE-CG 3.98Å; M135-Y150 HydrophobicContact SD-CD1 4.25Å; M135-Y150 HydrophobicContact SD-CD2 4.06Å; M135-Y150 HydrophobicContact SD-CG 3.81Å
136E92.5Very high92.9Very high79 Ų7955.6 Ų55.637%0.36927%0.269SS..Hα-helixtrans-77.1-44.4176.6-72.4163.5-154.800110G133 F134 I138 A139 D140G133-E136 PolarHBondContact O-N 3.49Å; F134-E136 VanDerWaalsContact C-N 3.32Å; F134-E136 PolarHBondContact O-N 2.85Å; E136-I138 PolarHBondContact O-N 2.87Å; E136-A139 CarbonylContact O-C 3.31Å; E136-A139 PolarHBondContact O-N 3.13Å; E136-A139 VanDerWaalsContact O-N 3.11Å; E136-D140 PolarHBondContact O-N 3.29Å
137R94.2Very high92.8Very high113 Ų11354 Ų5443%0.42627%0.268SS..Hα-helixtrans-60.3-45.4179.2-67.7-129-171.6-172.3-1.1113.3N96 F100 H132 G133 F134 A139 D140N96-R137 WeakPolarHBondContact CB-O 3.39Å; N96-R137 PolarHBondContact ND2-O 3.31Å; F100-R137 HydrophobicContact CD2-CB 4.04Å; F100-R137 HydrophobicContact CD2-CG 4.31Å; H132-R137 PolarHBondContact O-NE 3.44Å; G133-R137 PolarHBondContact O-N 3.08Å; G133-R137 VanDerWaalsContact O-N 3.17Å; F134-R137 PolarHBondContact O-N 3.01Å; R137-A139 PolarHBondContact O-N 3.08Å; R137-D140 WeakPolarHBondContact O-CB 3.48Å; R137-D140 PolarHBondContact O-N 3.04Å
138I95.3Very high92.6Very high1 Ų151.3 Ų51.31%0.00526%0.257CS..Hα-helixtrans-63.8-27.5179.1-165.8168.8000112.2N96 I97 F134 M135 E136 V149 A153N96-I138 PolarHBondContact ND2-O 3.2Å; I97-I138 HydrophobicContact CD1-CD1 3.98Å; I97-I138 HydrophobicContact CG1-CD1 3.87Å; I97-I138 HydrophobicContact CG1-CG1 4.08Å; F134-I138 HydrophobicContact CE1-CD1 4.34Å; F134-I138 HydrophobicContact CE2-CB 4.33Å; F134-I138 HydrophobicContact CE2-CD1 4.27Å; F134-I138 HydrophobicContact CZ-CB 4.35Å; F134-I138 HydrophobicContact CZ-CD1 3.7Å; F134-I138 WeakPolarHBondContact O-CG2 3.28Å; F134-I138 PolarHBondContact O-N 2.97Å; M135-I138 WeakPolarHBondContact O-CG2 3.48Å; E136-I138 PolarHBondContact O-N 2.87Å; I138-V149 HydrophobicContact CG1-CG1 4.39Å; I138-A153 HydrophobicContact CD1-CB 3.56Å
139A94.6Very high92.6Very high0 Ų049.2 Ų49.20%025%0.246CC..THydrogen-bonded Turntrans-94.90.5-178.800000112.9R69 E136 R137 G141 I142 C146 V149R69-A139 VanDerWaalsContact CZ-CB 3.48Å; R69-A139 PolarHBondContact NH2-O 3.42Å; E136-A139 CarbonylContact O-C 3.31Å; E136-A139 PolarHBondContact O-N 3.13Å; E136-A139 VanDerWaalsContact O-N 3.11Å; R137-A139 PolarHBondContact O-N 3.08Å; A139-G141 PolarHBondContact O-N 3.45Å; A139-I142 PolarHBondContact O-N 2.78Å; A139-I142 VanDerWaalsContact O-N 3.07Å; A139-C146 HydrophobicContact CB-CB 4.23Å; A139-V149 HydrophobicContact CB-CB 4.13Å; A139-V149 HydrophobicContact CB-CG1 4.33Å; A139-V149 HydrophobicContact CB-CG2 4.03Å
140D93.8Very high92.5Very high91 Ų9150 Ų5049%0.48725%0.248SC..THydrogen-bonded Turntrans-58.9138.9-178-164.724.7000111.4N96 E136 R137 I142N96-D140 PolarHBondContact ND2-N 3.45Å; N96-D140 PolarHBondContact ND2-O 2.85Å; E136-D140 PolarHBondContact O-N 3.29Å; R137-D140 WeakPolarHBondContact O-CB 3.48Å; R137-D140 PolarHBondContact O-N 3.04Å; D140-I142 PolarHBondContact O-N 3.46Å; D140-I142 VanDerWaalsContact O-N 3.11Å
141G90.8Very high92.4Very high45 Ų4543.6 Ų43.646%0.46422%0.223SC..THydrogen-bonded Turntrans68.6-2.3-174.900000116.7A139A139-G141 PolarHBondContact O-N 3.45Å
142I92.6Very high92.2Very high1 Ų141.7 Ų41.71%0.00521%0.21CC..  trans-104.9120.1-177.1-58.6165000110.3R69 E89 Q92 I93 A139 D140 R144 V149R69-I142 PolarHBondContact NH2-O 2.71Å; E89-I142 HydrophobicContact CG-CG2 4.29Å; Q92-I142 HydrophobicContact CB-CD1 4.21Å; Q92-I142 HydrophobicContact CB-CG1 4.07Å; Q92-I142 HydrophobicContact CG-CD1 4.18Å; Q92-I142 HydrophobicContact CG-CG1 3.86Å; I93-I142 HydrophobicContact CD1-CD1 4.31Å; I93-I142 HydrophobicContact CG1-CD1 3.42Å; I93-I142 VanDerWaalsContact CG1-CD1 3.42Å; A139-I142 PolarHBondContact O-N 2.78Å; A139-I142 VanDerWaalsContact O-N 3.07Å; D140-I142 PolarHBondContact O-N 3.46Å; D140-I142 VanDerWaalsContact O-N 3.11Å; I142-R144 HydrophobicContact CG2-CB 4.06Å; I142-R144 HydrophobicContact CG2-CG 4.15Å; I142-R144 PolarHBondContact O-N 3.1Å; I142-V149 HydrophobicContact CB-CG2 4.31Å; I142-V149 HydrophobicContact CD1-CG1 3.76Å; I142-V149 HydrophobicContact CD1-CG2 4.47Å; I142-V149 HydrophobicContact CG2-CG2 3.85Å
143P90.4Very high92.2Very high7 Ų738.6 Ų38.65%0.04520%0.196CC..SBendtrans-78.549.4-176.434.2-37.1000112.7F73 V78 R81F73-P143 HydrophobicContact CD2-CB 4.38Å; F73-P143 HydrophobicContact CE2-CB 4.43Å; V78-P143 HydrophobicContact CG1-CB 3.82Å; V78-P143 HydrophobicContact CG1-CG 4.13Å; R81-P143 HydrophobicContact CB-CG 4.26Å; R81-P143 HydrophobicContact CG-CG 4Å; R81-P143 PolarHBondContact N-O 2.97Å
144R90.6Very high92Very high4 Ų438.2 Ų38.22%0.01519%0.187CC..SBendtrans-136.9158178.6-62.8-172.7-172.2-108.25.4111.7R69 R81 G83 R84 E89 I142 C146 V149R69-R144 PolarHBondContact NH1-O 3.27Å; R69-R144 PolarHBondContact NH2-O 3.05Å; R81-R144 HydrophobicContact CB-CG 4.34Å; R81-R144 PolarHBondContact O-NH1 3.07Å; G83-R144 PolarHBondContact O-NH1 3.24Å; G83-R144 VanDerWaalsContact O-NH1 3.13Å; R84-R144 PolarHBondContact O-NH2 3.36Å; E89-R144 VanDerWaalsContact CD-NE 3.32Å; E89-R144 IonicContact OE1-CZ 2.6Å; E89-R144 IonicContact OE1-NE 3.96Å; E89-R144 PolarHBondContact OE1-NE 2.97Å; E89-R144 IonicContact OE1-NH2 3.48Å; E89-R144 PolarHBondContact OE1-NH2 3.33Å; E89-R144 IonicContact OE2-CZ 3.7Å; E89-R144 IonicContact OE2-NE 2.82Å; E89-R144 PolarHBondContact OE2-NE 2.92Å; E89-R144 IonicContact OE2-NH2 2.84Å; E89-R144 PolarHBondContact OE2-NH2 2.98Å; I142-R144 HydrophobicContact CG2-CB 4.06Å; I142-R144 HydrophobicContact CG2-CG 4.15Å; I142-R144 PolarHBondContact O-N 3.1Å; R144-C146 PolarHBondContact O-N 2.93Å; R144-V149 HydrophobicContact CB-CG2 4.01Å
145P90.9Very high91.6Very high8 Ų841.7 Ų41.75%0.05220%0.203CC..  trans-60.7137.1176.6-22.832.5000112.2M48 D66 F70 H147 Q148 V149M48-P145 HydrophobicContact CE-CB 4.39Å; M48-P145 HydrophobicContact CE-CG 3.98Å; M48-P145 HydrophobicContact CG-CG 3.97Å; M48-P145 HydrophobicContact SD-CB 4.11Å; M48-P145 HydrophobicContact SD-CG 3.62Å; D66-P145 VanDerWaalsContact OD1-CA 3.28Å; D66-P145 WeakPolarHBondContact OD1-CA 3.4Å; F70-P145 HydrophobicContact CZ-CB 4.41Å; F70-P145 HydrophobicContact CZ-CG 3.98Å; P145-H147 PolarHBondContact O-N 2.95Å; P145-Q148 HydrophobicContact CB-CG 4.31Å; P145-Q148 HydrophobicContact CG-CG 4.38Å; P145-Q148 WeakPolarHBondContact O-CB 3.38Å; P145-Q148 PolarHBondContact O-N 3.34Å; P145-V149 PolarHBondContact O-N 3.26Å
146C92.7Very high91.2Very high2 Ų240 Ų401%0.01419%0.194CC..Hα-helixtrans-48.2-42.6-178.7-71.80000112.2D66 R69 M135 A139 R144 Q148 V149 Y150D66-C146 PolarHBondContact OD1-N 2.77Å; D66-C146 PolarHBondContact OD1-SG 2.75Å; R69-C146 PolarHBondContact NH1-SG 3.33Å; M135-C146 HydrophobicContact CB-CB 4.4Å; M135-C146 WeakPolarHBondContact O-CB 3.33Å; M135-C146 PolarHBondContact O-SG 3.43Å; A139-C146 HydrophobicContact CB-CB 4.23Å; R144-C146 PolarHBondContact O-N 2.93Å; C146-Q148 PolarHBondContact O-N 3.45Å; C146-V149 PolarHBondContact O-N 3.4Å; C146-Y150 WeakPolarHBondContact O-CB 3.48Å; C146-Y150 PolarHBondContact O-N 3.39Å
147H90.6Very high90.8Very high107 Ų10739 Ų3950%0.49519%0.189SC..Hα-helixtrans-64-37.9179.4-172.658.9000113.2P145 Y150 L151P145-H147 PolarHBondContact O-N 2.95Å; H147-Y150 PolarHBondContact O-N 3.41Å; H147-L151 VanDerWaalsContact O-CG 3.29Å; H147-L151 WeakPolarHBondContact O-CG 3.4Å; H147-L151 PolarHBondContact O-N 3.15Å
148Q89.8Confident90.2Very high76 Ų7634 Ų3436%0.35517%0.17SC..Hα-helixtrans-68.5-42.3177.6-67.2-173.40.800111.1F85 P145 C146 Y150 L151 R152F85-Q148 HydrophobicContact CZ-CB 4.36Å; P145-Q148 HydrophobicContact CB-CG 4.31Å; P145-Q148 HydrophobicContact CG-CG 4.38Å; P145-Q148 WeakPolarHBondContact O-CB 3.38Å; P145-Q148 PolarHBondContact O-N 3.34Å; C146-Q148 PolarHBondContact O-N 3.45Å; Q148-Y150 VanDerWaalsContact C-N 3.34Å; Q148-L151 PolarHBondContact O-N 3.21Å; Q148-R152 WeakPolarHBondContact O-CB 3.34Å; Q148-R152 PolarHBondContact O-N 3.49Å
149V93Very high89.4Confident0 Ų041.4 Ų41.40%021%0.205CC..Hα-helixtrans-60.8-45.7175.5-176.30000110.3F85 I93 I138 A139 I142 R144 P145 C146 L151 R152 A153F85-V149 HydrophobicContact CE1-CG2 4.35Å; I93-V149 HydrophobicContact CD1-CG1 3.83Å; I93-V149 HydrophobicContact CG1-CG1 3.69Å; I138-V149 HydrophobicContact CG1-CG1 4.39Å; A139-V149 HydrophobicContact CB-CB 4.13Å; A139-V149 HydrophobicContact CB-CG1 4.33Å; A139-V149 HydrophobicContact CB-CG2 4.03Å; I142-V149 HydrophobicContact CB-CG2 4.31Å; I142-V149 HydrophobicContact CD1-CG1 3.76Å; I142-V149 HydrophobicContact CD1-CG2 4.47Å; I142-V149 HydrophobicContact CG2-CG2 3.85Å; R144-V149 HydrophobicContact CB-CG2 4.01Å; P145-V149 PolarHBondContact O-N 3.26Å; C146-V149 PolarHBondContact O-N 3.4Å; V149-L151 PolarHBondContact O-N 3.15Å; V149-R152 WeakPolarHBondContact O-CB 3.41Å; V149-R152 PolarHBondContact O-N 3.35Å; V149-R152 VanDerWaalsContact O-N 3.11Å; V149-A153 PolarHBondContact O-N 3.24Å
150Y93.4Very high88.7Confident45 Ų4544 Ų4418%0.17622%0.216CC..Hα-helixtrans-59.5-45.8175.6178-115.1000112.6L113 F134 M135 C146 H147 Q148 R152 A153 L154L113-Y150 HydrophobicContact CD2-CE2 4.17Å; F134-Y150 AromaticContact CE1-CD2 3.74Å; F134-Y150 HydrophobicContact CE1-CD2 3.74Å; F134-Y150 AromaticContact CE1-CE2 3.69Å; F134-Y150 HydrophobicContact CE1-CE2 3.69Å; F134-Y150 HydrophobicContact CZ-CD2 4.45Å; F134-Y150 HydrophobicContact CZ-CE2 4.44Å; M135-Y150 HydrophobicContact CE-CD1 3.84Å; M135-Y150 HydrophobicContact CE-CE1 4.4Å; M135-Y150 HydrophobicContact CE-CG 3.98Å; M135-Y150 HydrophobicContact SD-CD1 4.25Å; M135-Y150 HydrophobicContact SD-CD2 4.06Å; M135-Y150 HydrophobicContact SD-CG 3.81Å; C146-Y150 WeakPolarHBondContact O-CB 3.48Å; C146-Y150 PolarHBondContact O-N 3.39Å; H147-Y150 PolarHBondContact O-N 3.41Å; Q148-Y150 VanDerWaalsContact C-N 3.34Å; Y150-R152 VanDerWaalsContact C-N 3.27Å; Y150-R152 PolarHBondContact O-N 3.4Å; Y150-A153 PolarHBondContact O-N 3.5Å; Y150-L154 HydrophobicContact CD1-CD1 4.16Å; Y150-L154 HydrophobicContact CE1-CD1 3.63Å; Y150-L154 HydrophobicContact CE1-CG 4.19Å; Y150-L154 HydrophobicContact CE2-CD1 4.46Å; Y150-L154 HydrophobicContact CE2-CD2 4.12Å; Y150-L154 HydrophobicContact CE2-CG 4.16Å; Y150-L154 WeakPolarHBondContact O-CG 3.47Å; Y150-L154 PolarHBondContact O-N 3.1Å
151L90Very high87.7Confident50 Ų5041.5 Ų41.526%0.26220%0.203SC..Hα-helixtrans-63.1-33.6175.4-71.5178.1000112.5H147 Q148 V149 L154 K155 F197H147-L151 VanDerWaalsContact O-CG 3.29Å; H147-L151 WeakPolarHBondContact O-CG 3.4Å; H147-L151 PolarHBondContact O-N 3.15Å; Q148-L151 PolarHBondContact O-N 3.21Å; V149-L151 PolarHBondContact O-N 3.15Å; L151-L154 HydrophobicContact CD2-CD1 4.4Å; L151-K155 WeakPolarHBondContact O-CG 3.46Å; L151-K155 PolarHBondContact O-N 2.74Å; L151-F197 HydrophobicContact CD2-CE1 3.87Å; L151-F197 HydrophobicContact CD2-CZ 3.68Å
152R90.1Very high86.7Confident78 Ų7845.6 Ų45.629%0.29421%0.21SC..Hα-helixtrans-66.5-47.6174.9177.357.6174.9171-1.6110.7F85 N90 I93 Q148 V149 Y150 L154 K155 M156F85-R152 HydrophobicContact CB-CG 4.46Å; F85-R152 HydrophobicContact CD1-CB 4.3Å; F85-R152 HydrophobicContact CD1-CG 3.8Å; F85-R152 HydrophobicContact CD2-CB 4.2Å; F85-R152 HydrophobicContact CD2-CG 3.93Å; F85-R152 HydrophobicContact CE1-CB 3.91Å; F85-R152 HydrophobicContact CE1-CG 3.92Å; F85-R152 HydrophobicContact CE2-CB 3.81Å; F85-R152 HydrophobicContact CE2-CG 4.06Å; F85-R152 HydrophobicContact CG-CB 4.43Å; F85-R152 HydrophobicContact CG-CG 3.8Å; F85-R152 HydrophobicContact CZ-CB 3.65Å; F85-R152 HydrophobicContact CZ-CG 4.05Å; N90-R152 VanDerWaalsContact CG-NH2 3.32Å; N90-R152 PolarHBondContact ND2-NH2 3.3Å; N90-R152 VanDerWaalsContact OD1-CZ 3.32Å; N90-R152 PolarHBondContact OD1-NE 3.45Å; N90-R152 PolarHBondContact OD1-NH2 2.95Å; I93-R152 HydrophobicContact CD1-CB 4.14Å; I93-R152 HydrophobicContact CD1-CG 3.66Å; Q148-R152 WeakPolarHBondContact O-CB 3.34Å; Q148-R152 PolarHBondContact O-N 3.49Å; V149-R152 WeakPolarHBondContact O-CB 3.41Å; V149-R152 PolarHBondContact O-N 3.35Å; V149-R152 VanDerWaalsContact O-N 3.11Å; Y150-R152 VanDerWaalsContact C-N 3.27Å; Y150-R152 PolarHBondContact O-N 3.4Å; R152-L154 PolarHBondContact O-N 3.26Å; R152-K155 PolarHBondContact O-N 2.96Å; R152-M156 HydrophobicContact CG-CG 4.4Å; R152-M156 HydrophobicContact CG-SD 3.8Å; R152-M156 WeakPolarHBondContact O-CG 3.35Å; R152-M156 PolarHBondContact O-N 2.87Å
153A91.2Very high85.8Confident0 Ų050.4 Ų50.40%023%0.233CC..Hα-helixtrans-57-47.2175.300000111.9I93 I97 L113 I138 V149 Y150 K155 M156 F157I93-A153 HydrophobicContact CG2-CB 3.83Å; I97-A153 HydrophobicContact CD1-CB 4.07Å; L113-A153 HydrophobicContact CD1-CB 4.43Å; L113-A153 HydrophobicContact CD2-CB 4.43Å; I138-A153 HydrophobicContact CD1-CB 3.56Å; V149-A153 PolarHBondContact O-N 3.24Å; Y150-A153 PolarHBondContact O-N 3.5Å; A153-K155 PolarHBondContact O-N 3.42Å; A153-K155 VanDerWaalsContact O-N 3.13Å; A153-M156 PolarHBondContact O-N 3.43Å; A153-M156 VanDerWaalsContact O-N 3.08Å; A153-F157 WeakPolarHBondContact O-CD2 3.28Å; A153-F157 PolarHBondContact O-N 2.83Å; A153-F157 VanDerWaalsContact O-N 3.08Å
154L89.6Confident85Confident18 Ų1852.7 Ų52.79%0.09426%0.259CS..Hα-helixtrans-55.9-32.6175.6-70179.9000113L113 F114 Y150 L151 R152 D158 F197L113-L154 HydrophobicContact CB-CD2 4Å; L113-L154 HydrophobicContact CD2-CD2 4.38Å; L113-L154 WeakPolarHBondContact O-CD2 3.49Å; F114-L154 HydrophobicContact CD1-CD2 4.33Å; F114-L154 HydrophobicContact CE1-CD2 3.79Å; F114-L154 HydrophobicContact CZ-CD2 4.13Å; F114-L154 WeakPolarHBondContact CZ-O 3.28Å; Y150-L154 HydrophobicContact CD1-CD1 4.16Å; Y150-L154 HydrophobicContact CE1-CD1 3.63Å; Y150-L154 HydrophobicContact CE1-CG 4.19Å; Y150-L154 HydrophobicContact CE2-CD1 4.46Å; Y150-L154 HydrophobicContact CE2-CD2 4.12Å; Y150-L154 HydrophobicContact CE2-CG 4.16Å; Y150-L154 WeakPolarHBondContact O-CG 3.47Å; Y150-L154 PolarHBondContact O-N 3.1Å; L151-L154 HydrophobicContact CD2-CD1 4.4Å; R152-L154 PolarHBondContact O-N 3.26Å; L154-D158 WeakPolarHBondContact O-CB 3.47Å; L154-D158 PolarHBondContact O-N 3.43Å; L154-F197 HydrophobicContact CB-CE2 3.88Å; L154-F197 HydrophobicContact CB-CZ 4.4Å; L154-F197 HydrophobicContact CD1-CE2 4.15Å; L154-F197 HydrophobicContact CD1-CZ 4.06Å
155K84.6Confident84.2Confident78 Ų7863.9 Ų63.934%0.33930%0.301SS..Hα-helixtrans-82.1-30.4178.4-70171.8-175.4175.10113.3L151 R152 A153 N161 H162 F197L151-K155 WeakPolarHBondContact O-CG 3.46Å; L151-K155 PolarHBondContact O-N 2.74Å; R152-K155 PolarHBondContact O-N 2.96Å; A153-K155 PolarHBondContact O-N 3.42Å; A153-K155 VanDerWaalsContact O-N 3.13Å; K155-N161 PolarHBondContact O-ND2 2.77Å; K155-H162 PolarHBondContact O-NE2 3.05Å; K155-F197 HydrophobicContact CG-CB 4.45Å; K155-F197 HydrophobicContact CG-CD2 3.9Å; K155-F197 HydrophobicContact CG-CE2 4.34Å; K155-F197 HydrophobicContact CG-CG 4.13Å
156M84.4Confident83.5Confident37 Ų3765.1 Ų65.118%0.18231%0.305CS..Hα-helixtrans-74.2-35-179-74.4173.258.100112.4N90 I93 R94 R152 A153N90-M156 HydrophobicContact CB-CE 3.86Å; N90-M156 HydrophobicContact CB-SD 4.16Å; N90-M156 WeakPolarHBondContact O-CE 3.42Å; N90-M156 PolarHBondContact OD1-SD 3.12Å; I93-M156 HydrophobicContact CD1-SD 4.29Å; I93-M156 HydrophobicContact CG2-SD 4.41Å; R94-M156 HydrophobicContact CG-CE 4.16Å; R152-M156 HydrophobicContact CG-CG 4.4Å; R152-M156 HydrophobicContact CG-SD 3.8Å; R152-M156 WeakPolarHBondContact O-CG 3.35Å; R152-M156 PolarHBondContact O-N 2.87Å; A153-M156 PolarHBondContact O-N 3.43Å; A153-M156 VanDerWaalsContact O-N 3.08Å
157F84.8Confident83Confident58 Ų5867.1 Ų67.125%0.25432%0.32SS..SBendtrans-107.66.6-173.7-66.9-81.8000113.5I93 R94 I97 V109 L113 F114 A153I93-F157 HydrophobicContact CG2-CE2 4.37Å; R94-F157 HydrophobicContact CB-CZ 4.47Å; R94-F157 HydrophobicContact CG-CZ 3.93Å; I97-F157 HydrophobicContact CD1-CD2 3.84Å; I97-F157 HydrophobicContact CD1-CE2 3.27Å; I97-F157 HydrophobicContact CD1-CZ 3.84Å; V109-F157 HydrophobicContact CB-CD1 4.36Å; V109-F157 HydrophobicContact CG1-CB 3.97Å; V109-F157 HydrophobicContact CG1-CD1 3.54Å; V109-F157 HydrophobicContact CG1-CD2 4.26Å; V109-F157 HydrophobicContact CG1-CE1 3.97Å; V109-F157 HydrophobicContact CG1-CG 3.67Å; V109-F157 HydrophobicContact CG1-CZ 4.5Å; V109-F157 HydrophobicContact CG2-CE1 4.39Å; L113-F157 HydrophobicContact CD1-CB 3.55Å; L113-F157 HydrophobicContact CD1-CD2 3.72Å; L113-F157 HydrophobicContact CD1-CG 3.86Å; F114-F157 WeakPolarHBondContact CE2-O 3.34Å; A153-F157 WeakPolarHBondContact O-CD2 3.28Å; A153-F157 PolarHBondContact O-N 2.83Å; A153-F157 VanDerWaalsContact O-N 3.08Å
158D82Confident82.5Confident7 Ų768 Ų684%0.03732%0.324CS..  trans-92.1104.8170.6-167.910.5000109.5F114 R117 L154 K160 N161 S195F114-D158 HydrophobicContact CE1-CB 4.1Å; F114-D158 HydrophobicContact CE2-CB 4.32Å; F114-D158 HydrophobicContact CZ-CB 3.57Å; R117-D158 IonicContact CZ-OD1 3.36Å; R117-D158 IonicContact NH1-OD1 3.73Å; R117-D158 IonicContact NH2-OD1 2.84Å; R117-D158 PolarHBondContact NH2-OD1 3.08Å; L154-D158 WeakPolarHBondContact O-CB 3.47Å; L154-D158 PolarHBondContact O-N 3.43Å; D158-K160 PolarHBondContact O-N 3.29Å; D158-K160 WeakPolarHBondContact OD1-CB 3.24Å; D158-K160 PolarHBondContact OD1-N 3.35Å; D158-N161 HydrophobicContact CB-CB 4.01Å; D158-N161 VanDerWaalsContact O-CB 3.22Å; D158-N161 WeakPolarHBondContact O-CB 3.47Å; D158-N161 PolarHBondContact O-N 3.49Å; D158-S195 WeakPolarHBondContact OD2-CB 3.44Å; D158-S195 PolarHBondContact OD2-OG 3.45Å
159E77.8Confident82.3Confident157 Ų15770.7 Ų70.773%0.73434%0.337SS*.G310 helixtrans-54-36.6174.6-63.8175.6179.800111.2N161 H162E159-N161 PolarHBondContact O-N 3.34Å; E159-H162 PolarHBondContact O-N 3.23Å; E159-H162 VanDerWaalsContact O-N 3.13Å
160K80.3Confident82Confident55 Ų5573 Ų7324%0.23935%0.347CS..G310 helixtrans-68.5-7.9179.7-52-171-177.6-167.90113.7D158 M163 D193 S195D158-K160 PolarHBondContact O-N 3.29Å; D158-K160 WeakPolarHBondContact OD1-CB 3.24Å; D158-K160 PolarHBondContact OD1-N 3.35Å; K160-M163 WeakPolarHBondContact O-CG 3.35Å; K160-D193 WeakPolarHBondContact CE-OD1 3.46Å; K160-D193 IonicContact NZ-OD1 2.85Å; K160-D193 PolarHBondContact NZ-OD1 2.88Å; K160-S195 WeakPolarHBondContact O-CB 3.34Å; K160-S195 PolarHBondContact O-N 3.15Å
161N72.9Confident81.6Confident38 Ų3871.1 Ų71.120%0.20334%0.34CS..G310 helixtrans-84.9-18.8177.1-174.457.5000112.1K155 D158 E159K155-N161 PolarHBondContact O-ND2 2.77Å; D158-N161 HydrophobicContact CB-CB 4.01Å; D158-N161 VanDerWaalsContact O-CB 3.22Å; D158-N161 WeakPolarHBondContact O-CB 3.47Å; D158-N161 PolarHBondContact O-N 3.49Å; E159-N161 PolarHBondContact O-N 3.34Å
162H70Confident81.4Confident132 Ų13270.6 Ų70.661%0.61134%0.343SS*.  trans-105.620.9-174.2-63.4-71.2000114.2K155 E159 G164K155-H162 PolarHBondContact O-NE2 3.05Å; E159-H162 PolarHBondContact O-N 3.23Å; E159-H162 VanDerWaalsContact O-N 3.13Å; H162-G164 PolarHBondContact O-N 2.98Å
163M72.1Confident81.4Confident101 Ų10167.5 Ų67.550%0.49833%0.334SS..  trans-71.810.8-177.4-59.7-65.9-78.800115.5K160 R194K160-M163 WeakPolarHBondContact O-CG 3.35Å; M163-R194 PolarHBondContact O-NH2 3.17Å
164G73.4Confident81.3Confident56 Ų5667.5 Ų67.558%0.57733%0.334SS*.  trans69.1-153.2176.500000115.4H162 R194H162-G164 PolarHBondContact O-N 2.98Å; G164-R194 PolarHBondContact O-NH1 3.41Å; G164-R194 VanDerWaalsContact O-NH1 3.11Å
165R74.6Confident81.1Confident238 Ų23869.7 Ų69.790%0.89835%0.345SS*.SBendtrans-64.9153.7-175.9-66.6-176.3-179.5-178.31.5111R194R165-R194 PolarHBondContact O-NH2 3.48Å
166F77.1Confident81.3Confident34 Ų3472.7 Ų72.715%0.14936%0.355CS..PPolyproline II helixtrans-87.3132.3173-77.3-98.8000109.4E170 L171 R194 S198 L199 R202F166-E170 VanDerWaalsContact CA-OE2 3.24Å; F166-E170 WeakPolarHBondContact CA-OE2 3.32Å; F166-E170 HydrophobicContact CD1-CB 4.07Å; F166-L171 HydrophobicContact CB-CD2 3.62Å; F166-L171 HydrophobicContact CB-CG 4.05Å; F166-L171 HydrophobicContact CD1-CD2 4.26Å; F166-L171 HydrophobicContact CG-CD2 4.08Å; F166-R194 VanDerWaalsContact CE1-CD 3.49Å; F166-S198 WeakPolarHBondContact CE2-OG 3.49Å; F166-S198 WeakPolarHBondContact CZ-OG 3.46Å; F166-L199 HydrophobicContact CE1-CD2 3.75Å; F166-L199 HydrophobicContact CZ-CD2 4.08Å; F166-R202 HydrophobicContact CD1-CG 4.26Å; F166-R202 HydrophobicContact CD2-CB 4.19Å; F166-R202 HydrophobicContact CD2-CG 3.77Å; F166-R202 HydrophobicContact CE1-CB 4.41Å; F166-R202 HydrophobicContact CE1-CG 4.27Å; F166-R202 HydrophobicContact CE2-CB 3.67Å; F166-R202 HydrophobicContact CE2-CG 3.78Å; F166-R202 HydrophobicContact CG-CG 4.02Å; F166-R202 HydrophobicContact CZ-CB 3.79Å; F166-R202 HydrophobicContact CZ-CG 4.03Å
167S82.3Confident81.6Confident45 Ų4573 Ų7332%0.31536%0.355SS..PPolyproline II helixtrans-76.2160.8169.986.60000111.1E169 E170 L171S167-E169 WeakPolarHBondContact CB-OE2 3.33Å; S167-E169 PolarHBondContact O-N 3.13Å; S167-E169 PolarHBondContact OG-N 3.26Å; S167-E169 PolarHBondContact OG-OE2 2.87Å; S167-E170 PolarHBondContact N-OE2 2.85Å; S167-E170 WeakPolarHBondContact O-CB 3.5Å; S167-E170 PolarHBondContact O-N 3.47Å; S167-E170 VanDerWaalsContact O-N 3.14Å; S167-E170 WeakPolarHBondContact OG-CG 3.41Å; S167-E170 PolarHBondContact OG-N 3.01Å; S167-L171 VanDerWaalsContact O-CG 3.29Å; S167-L171 WeakPolarHBondContact O-CG 3.35Å; S167-L171 PolarHBondContact O-N 3.32Å
168E79.9Confident81.9Confident125 Ų12571.7 Ų71.758%0.58435%0.35SS*.Hα-helixtrans-60.5-35.4178-68.4-60.8150.600111.8L171 A172E168-L171 PolarHBondContact O-N 3.47Å; E168-A172 WeakPolarHBondContact O-CB 3.4Å; E168-A172 PolarHBondContact O-N 2.86Å
169E85.4Confident82.1Confident133 Ų13377.2 Ų77.262%0.62138%0.379SS*.Hα-helixtrans-65.3-40.6175.7-54.575-160.200111.6S167 L171 A172 A173S167-E169 WeakPolarHBondContact CB-OE2 3.33Å; S167-E169 PolarHBondContact O-N 3.13Å; S167-E169 PolarHBondContact OG-N 3.26Å; S167-E169 PolarHBondContact OG-OE2 2.87Å; E169-L171 VanDerWaalsContact C-N 3.33Å; E169-A172 PolarHBondContact O-N 3.41Å; E169-A173 VanDerWaalsContact O-CB 3.31Å; E169-A173 WeakPolarHBondContact O-CB 3.4Å; E169-A173 PolarHBondContact O-N 3.18Å
170E86.3Confident82.7Confident47 Ų4775.5 Ų75.522%0.2237%0.374CS..Hα-helixtrans-66.4-36.4175.7-69.2177.4129.400111.5F166 S167 A173 L174 M192 R194F166-E170 VanDerWaalsContact CA-OE2 3.24Å; F166-E170 WeakPolarHBondContact CA-OE2 3.32Å; F166-E170 HydrophobicContact CD1-CB 4.07Å; S167-E170 PolarHBondContact N-OE2 2.85Å; S167-E170 WeakPolarHBondContact O-CB 3.5Å; S167-E170 PolarHBondContact O-N 3.47Å; S167-E170 VanDerWaalsContact O-N 3.14Å; S167-E170 WeakPolarHBondContact OG-CG 3.41Å; S167-E170 PolarHBondContact OG-N 3.01Å; E170-A173 PolarHBondContact O-N 3.08Å; E170-L174 WeakPolarHBondContact O-CB 3.17Å; E170-L174 PolarHBondContact O-N 3.46Å; E170-M192 HydrophobicContact CB-CE 4.17Å; E170-M192 WeakPolarHBondContact O-CE 3.22Å; E170-R194 IonicContact OE1-CZ 3.21Å; E170-R194 IonicContact OE1-NE 3.46Å; E170-R194 PolarHBondContact OE1-NE 2.68Å; E170-R194 IonicContact OE1-NH2 3.46Å; E170-R194 PolarHBondContact OE1-NH2 3.49Å; E170-R194 IonicContact OE2-CZ 2.73Å; E170-R194 IonicContact OE2-NE 2.85Å; E170-R194 IonicContact OE2-NH2 3.54Å; E170-R194 PolarHBondContact OE2-NH2 2.84Å
171L85.5Confident83.1Confident6 Ų677 Ų773%0.03138%0.379CS..Hα-helixtrans-67.3-46175.6-61.4173.8000111.4F166 S167 E168 E169 A173 L174 I175 R202 L206F166-L171 HydrophobicContact CB-CD2 3.62Å; F166-L171 HydrophobicContact CB-CG 4.05Å; F166-L171 HydrophobicContact CD1-CD2 4.26Å; F166-L171 HydrophobicContact CG-CD2 4.08Å; S167-L171 VanDerWaalsContact O-CG 3.29Å; S167-L171 WeakPolarHBondContact O-CG 3.35Å; S167-L171 PolarHBondContact O-N 3.32Å; E168-L171 PolarHBondContact O-N 3.47Å; E169-L171 VanDerWaalsContact C-N 3.33Å; L171-A173 VanDerWaalsContact C-N 3.3Å; L171-A173 PolarHBondContact O-N 3.02Å; L171-L174 WeakPolarHBondContact O-CB 3.39Å; L171-L174 PolarHBondContact O-N 2.78Å; L171-I175 WeakPolarHBondContact O-CG1 3.3Å; L171-I175 PolarHBondContact O-N 3.13Å; L171-R202 HydrophobicContact CD2-CG 3.92Å; L171-L206 HydrophobicContact CD2-CD1 3.9Å; L171-L206 HydrophobicContact CD2-CD2 4.16Å
172A85.9Confident83.8Confident39 Ų3976.6 Ų76.632%0.32238%0.384SS..Hα-helixtrans-59-43.5174.100000111E168 E169 I175 R176E168-A172 WeakPolarHBondContact O-CB 3.4Å; E168-A172 PolarHBondContact O-N 2.86Å; E169-A172 PolarHBondContact O-N 3.41Å; A172-I175 PolarHBondContact O-N 2.98Å; A172-R176 WeakPolarHBondContact O-CB 3.34Å; A172-R176 VanDerWaalsContact O-CG 3.26Å; A172-R176 WeakPolarHBondContact O-CG 3.35Å; A172-R176 PolarHBondContact O-N 3.31Å
173A88.9Confident84.6Confident13 Ų1375.9 Ų75.911%0.10739%0.385CS..Hα-helixtrans-62.5-42.4175.400000112.6E169 E170 L171 R176 F177 M192E169-A173 VanDerWaalsContact O-CB 3.31Å; E169-A173 WeakPolarHBondContact O-CB 3.4Å; E169-A173 PolarHBondContact O-N 3.18Å; E170-A173 PolarHBondContact O-N 3.08Å; L171-A173 VanDerWaalsContact C-N 3.3Å; L171-A173 PolarHBondContact O-N 3.02Å; A173-R176 PolarHBondContact O-N 3.07Å; A173-F177 HydrophobicContact CB-CD2 4.32Å; A173-F177 HydrophobicContact CB-CE2 4.08Å; A173-F177 WeakPolarHBondContact O-CB 3.18Å; A173-F177 WeakPolarHBondContact O-CD2 3.47Å; A173-F177 VanDerWaalsContact O-CG 3.3Å; A173-F177 WeakPolarHBondContact O-CG 3.31Å; A173-F177 PolarHBondContact O-N 3.13Å; A173-M192 HydrophobicContact CB-CE 4.35Å
174L88.8Confident85.4Confident0 Ų074.8 Ų74.80%038%0.381CS..Hα-helixtrans-59.9-46.8177.4178.952.2000111.9E170 L171 F177 H178 W185 I188 M192 L199 R202 F203 L206E170-L174 WeakPolarHBondContact O-CB 3.17Å; E170-L174 PolarHBondContact O-N 3.46Å; L171-L174 WeakPolarHBondContact O-CB 3.39Å; L171-L174 PolarHBondContact O-N 2.78Å; L174-F177 PolarHBondContact O-N 3.38Å; L174-H178 VanDerWaalsContact O-CB 3.32Å; L174-H178 WeakPolarHBondContact O-CB 3.45Å; L174-H178 PolarHBondContact O-N 3.05Å; L174-W185 HydrophobicContact CD1-CZ3 4.18Å; L174-I188 HydrophobicContact CD1-CG2 4.07Å; L174-M192 HydrophobicContact CB-CE 3.84Å; L174-M192 HydrophobicContact CB-SD 3.8Å; L174-M192 HydrophobicContact CD1-SD 3.89Å; L174-M192 HydrophobicContact CG-SD 4.42Å; L174-L199 HydrophobicContact CD1-CB 4.33Å; L174-L199 HydrophobicContact CD1-CD2 4.05Å; L174-L199 HydrophobicContact CD2-CD2 4.39Å; L174-R202 HydrophobicContact CD2-CB 4.24Å; L174-R202 HydrophobicContact CD2-CG 4.04Å; L174-F203 HydrophobicContact CD2-CB 4.28Å; L174-F203 HydrophobicContact CG-CD2 4.2Å; L174-L206 HydrophobicContact CD2-CD1 3.78Å
175I86.2Confident86.2Confident64 Ų6473.9 Ų73.933%0.32836%0.36SS..Hα-helixtrans-63.7-47.2177.7-65.5167.2000110.1L171 A172 F177 H178 N179L171-I175 WeakPolarHBondContact O-CG1 3.3Å; L171-I175 PolarHBondContact O-N 3.13Å; A172-I175 PolarHBondContact O-N 2.98Å; I175-F177 PolarHBondContact O-N 2.9Å; I175-H178 PolarHBondContact O-N 3.38Å; I175-N179 WeakPolarHBondContact O-CB 3.43Å; I175-N179 VanDerWaalsContact O-CG 3.24Å; I175-N179 PolarHBondContact O-N 3.3Å; I175-N179 PolarHBondContact O-ND2 2.97Å
176R89.4Confident86.8Confident141 Ų14169.5 Ų69.553%0.53235%0.347SS..Hα-helixtrans-57.9-48.5177.1-72.9-174.8-50.9-122.82.9112.1A172 A173 N179 L180A172-R176 WeakPolarHBondContact O-CB 3.34Å; A172-R176 VanDerWaalsContact O-CG 3.26Å; A172-R176 WeakPolarHBondContact O-CG 3.35Å; A172-R176 PolarHBondContact O-N 3.31Å; A173-R176 PolarHBondContact O-N 3.07Å; R176-N179 PolarHBondContact O-N 3.18Å; R176-L180 WeakPolarHBondContact O-CG 3.26Å; R176-L180 PolarHBondContact O-N 2.63Å
177F90.7Very high87.4Confident44 Ų4470.3 Ų70.319%0.19335%0.353CS..Hα-helixtrans-69.7-34.1-178.3-68.9-40.1000112.9A173 L174 I175 L180 Y181 I188 K191 M192A173-F177 HydrophobicContact CB-CD2 4.32Å; A173-F177 HydrophobicContact CB-CE2 4.08Å; A173-F177 WeakPolarHBondContact O-CB 3.18Å; A173-F177 WeakPolarHBondContact O-CD2 3.47Å; A173-F177 VanDerWaalsContact O-CG 3.3Å; A173-F177 WeakPolarHBondContact O-CG 3.31Å; A173-F177 PolarHBondContact O-N 3.13Å; L174-F177 PolarHBondContact O-N 3.38Å; I175-F177 PolarHBondContact O-N 2.9Å; F177-L180 PolarHBondContact O-N 3.39Å; F177-Y181 HydrophobicContact CB-CD2 4.18Å; F177-Y181 HydrophobicContact CB-CE2 4.45Å; F177-Y181 HydrophobicContact CD1-CD2 4.32Å; F177-Y181 AromaticContact CD1-CE2 3.74Å; F177-Y181 HydrophobicContact CD1-CE2 3.74Å; F177-Y181 HydrophobicContact CE1-CE2 4.46Å; F177-Y181 HydrophobicContact CG-CE2 4.43Å; F177-Y181 WeakPolarHBondContact O-CB 3.5Å; F177-Y181 VanDerWaalsContact O-CD2 3.28Å; F177-Y181 WeakPolarHBondContact O-CD2 3.46Å; F177-Y181 PolarHBondContact O-N 3.07Å; F177-I188 HydrophobicContact CB-CG1 4.11Å; F177-I188 HydrophobicContact CB-CG2 3.93Å; F177-I188 HydrophobicContact CD2-CG2 4.46Å; F177-K191 HydrophobicContact CD1-CD 4.07Å; F177-K191 HydrophobicContact CD2-CB 4.3Å; F177-K191 HydrophobicContact CE1-CB 4.43Å; F177-K191 HydrophobicContact CE1-CD 3.86Å; F177-K191 HydrophobicContact CE2-CB 3.89Å; F177-K191 HydrophobicContact CZ-CB 3.97Å; F177-K191 HydrophobicContact CZ-CD 4.21Å; F177-M192 HydrophobicContact CD2-CG 3.58Å; F177-M192 HydrophobicContact CD2-SD 4.09Å; F177-M192 HydrophobicContact CE2-CG 3.72Å
178H89.5Confident87.8Confident31 Ų3168.1 Ų68.114%0.14434%0.338CS..Hα-helixtrans-65.7-42.5172.4-174.6-87.4000111.5L174 I175 L180 G182 N183 W185 I188 F203L174-H178 VanDerWaalsContact O-CB 3.32Å; L174-H178 WeakPolarHBondContact O-CB 3.45Å; L174-H178 PolarHBondContact O-N 3.05Å; I175-H178 PolarHBondContact O-N 3.38Å; H178-L180 VanDerWaalsContact C-N 3.29Å; H178-L180 PolarHBondContact O-N 3Å; H178-G182 PolarHBondContact CD2-O 3.13Å; H178-G182 WeakPolarHBondContact O-CA 3.32Å; H178-G182 PolarHBondContact O-N 2.96Å; H178-N183 PolarHBondContact NE2-OD1 3.31Å; H178-W185 AromaticContact CD2-CH2 3.55Å; H178-W185 AromaticContact CD2-CZ2 3.88Å; H178-I188 HydrophobicContact CB-CD1 4.35Å; H178-F203 HydrophobicContact CB-CD2 4.25Å; H178-F203 HydrophobicContact CB-CE2 3.68Å; H178-F203 HydrophobicContact CB-CZ 4.13Å; H178-F203 AromaticContact CD2-CE1 3.84Å; H178-F203 AromaticContact CD2-CE2 3.94Å; H178-F203 AromaticContact CD2-CZ 3.67Å; H178-F203 AromaticContact CE1-CE1 3.62Å; H178-F203 AromaticContact CE1-CZ 3.33Å; H178-F203 WeakPolarHBondContact CE1-CZ 3.4Å; H178-F203 AromaticContact CG-CE2 3.44Å; H178-F203 VanDerWaalsContact CG-CE2 3.44Å; H178-F203 AromaticContact CG-CZ 3.37Å; H178-F203 AromaticContact ND1-CE1 3.92Å; H178-F203 AromaticContact ND1-CE2 3.64Å; H178-F203 AromaticContact ND1-CZ 3.16Å; H178-F203 WeakPolarHBondContact ND1-CZ 3.19Å; H178-F203 AromaticContact NE2-CE1 3.57Å; H178-F203 AromaticContact NE2-CZ 3.63Å
179N86.8Confident88.3Confident123 Ų12362.9 Ų62.966%0.65832%0.315SS*.Hα-helixtrans-61.8-35.7175.1-70.4-16.4000112.7I175 R176I175-N179 WeakPolarHBondContact O-CB 3.43Å; I175-N179 VanDerWaalsContact O-CG 3.24Å; I175-N179 PolarHBondContact O-N 3.3Å; I175-N179 PolarHBondContact O-ND2 2.97Å; R176-N179 PolarHBondContact O-N 3.18Å
180L90.2Very high88.4Confident120 Ų12063 Ų6363%0.62832%0.315SS*.Hα-helixtrans-79.6-40.5-179.4-71.6170.3000113.9R176 F177 H178R176-L180 WeakPolarHBondContact O-CG 3.26Å; R176-L180 PolarHBondContact O-N 2.63Å; F177-L180 PolarHBondContact O-N 3.39Å; H178-L180 VanDerWaalsContact C-N 3.29Å; H178-L180 PolarHBondContact O-N 3Å
181Y89.8Confident88.6Confident87 Ų8765.6 Ų65.634%0.34133%0.326SS..Hα-helixtrans-115.5-0.7-169.1-53.1-57.6000113.9F177 N184 L187 I188 K191F177-Y181 HydrophobicContact CB-CD2 4.18Å; F177-Y181 HydrophobicContact CB-CE2 4.45Å; F177-Y181 HydrophobicContact CD1-CD2 4.32Å; F177-Y181 AromaticContact CD1-CE2 3.74Å; F177-Y181 HydrophobicContact CD1-CE2 3.74Å; F177-Y181 HydrophobicContact CE1-CE2 4.46Å; F177-Y181 HydrophobicContact CG-CE2 4.43Å; F177-Y181 WeakPolarHBondContact O-CB 3.5Å; F177-Y181 VanDerWaalsContact O-CD2 3.28Å; F177-Y181 WeakPolarHBondContact O-CD2 3.46Å; F177-Y181 PolarHBondContact O-N 3.07Å; Y181-N184 WeakPolarHBondContact O-CB 3.33Å; Y181-N184 PolarHBondContact O-N 2.79Å; Y181-L187 HydrophobicContact CD1-CD2 3.59Å; Y181-L187 HydrophobicContact CD2-CD2 4.07Å; Y181-L187 HydrophobicContact CD2-CG 4.42Å; Y181-L187 HydrophobicContact CE1-CD2 3.96Å; Y181-L187 HydrophobicContact CE2-CD2 4.39Å; Y181-L187 HydrophobicContact CG-CD2 3.66Å; Y181-L187 HydrophobicContact CG-CG 4.44Å; Y181-I188 HydrophobicContact CD2-CG1 4.47Å; Y181-K191 HydrophobicContact CD2-CD 4.44Å; Y181-K191 HydrophobicContact CE2-CD 3.58Å; Y181-K191 VanDerWaalsContact OH-CE 3.26Å; Y181-K191 WeakPolarHBondContact OH-CE 3.39Å
182G87Confident88.7Confident29 Ų2966.4 Ų66.430%0.29933%0.33SS..THydrogen-bonded Turntrans59.6-142.8-174.700000112.6H178 N184 I188H178-G182 PolarHBondContact CD2-O 3.13Å; H178-G182 WeakPolarHBondContact O-CA 3.32Å; H178-G182 PolarHBondContact O-N 2.96Å; G182-N184 PolarHBondContact O-N 3.06Å; G182-I188 WeakPolarHBondContact O-CD1 3.45Å
183N87.3Confident88.8Confident118 Ų11868.8 Ų68.863%0.63134%0.337SS*.THydrogen-bonded Turntrans-76.323.4-179.7-66.2-31.6000114H178 W185H178-N183 PolarHBondContact NE2-OD1 3.31Å; N183-W185 PolarHBondContact O-N 2.64Å; N183-W185 PolarHBondContact O-NE1 3.17Å
184N89.6Confident88.6Confident78 Ų7868.7 Ų68.742%0.41733%0.334SS..  trans-8067.4176.4-166.3-7.7000111.5Y181 G182 K186 L187 I188Y181-N184 WeakPolarHBondContact O-CB 3.33Å; Y181-N184 PolarHBondContact O-N 2.79Å; G182-N184 PolarHBondContact O-N 3.06Å; N184-K186 PolarHBondContact O-N 2.65Å; N184-K186 VanDerWaalsContact O-N 3.11Å; N184-L187 HydrophobicContact CB-CB 4.4Å; N184-L187 PolarHBondContact O-N 3.2Å; N184-I188 WeakPolarHBondContact O-CG1 3.45Å; N184-I188 PolarHBondContact O-N 3.36Å; N184-I188 VanDerWaalsContact O-N 3.14Å
185W89.2Confident88.5Confident36 Ų3668.8 Ų68.814%0.13633%0.334CS..Hα-helixtrans-60.2-25.5-174.1-57.8103.7000114.4L174 H178 N183 I188 S189 I196 L199 Q200 F203L174-W185 HydrophobicContact CD1-CZ3 4.18Å; H178-W185 AromaticContact CD2-CH2 3.55Å; H178-W185 AromaticContact CD2-CZ2 3.88Å; N183-W185 PolarHBondContact O-N 2.64Å; N183-W185 PolarHBondContact O-NE1 3.17Å; W185-I188 HydrophobicContact CE3-CD1 4.19Å; W185-I188 HydrophobicContact CZ3-CD1 4.31Å; W185-S189 WeakPolarHBondContact O-CB 3.42Å; W185-S189 PolarHBondContact O-N 3.32Å; W185-I196 HydrophobicContact CB-CG2 3.8Å; W185-L199 HydrophobicContact CE3-CB 4.24Å; W185-L199 HydrophobicContact CZ3-CB 4.42Å; W185-Q200 HydrophobicContact CB-CG 4.32Å; W185-Q200 HydrophobicContact CD2-CG 3.44Å; W185-Q200 VanDerWaalsContact CD2-CG 3.44Å; W185-Q200 HydrophobicContact CE3-CG 3.93Å; W185-Q200 HydrophobicContact CG-CG 3.6Å; W185-Q200 HydrophobicContact CZ2-CG 4.3Å; W185-F203 HydrophobicContact CH2-CB 3.55Å; W185-F203 AromaticContact CH2-CD1 3.61Å; W185-F203 HydrophobicContact CH2-CD1 3.61Å; W185-F203 HydrophobicContact CH2-CD2 4.25Å; W185-F203 HydrophobicContact CH2-CE1 4.37Å; W185-F203 AromaticContact CH2-CG 3.53Å; W185-F203 HydrophobicContact CH2-CG 3.53Å; W185-F203 HydrophobicContact CZ2-CD1 4.15Å; W185-F203 HydrophobicContact CZ2-CG 4.49Å; W185-F203 HydrophobicContact CZ3-CB 3.99Å; W185-F203 HydrophobicContact CZ3-CG 4.27Å
186K88.3Confident88.6Confident147 Ų14767.8 Ų67.864%0.63933%0.329SS*.Hα-helixtrans-64.4-46.7175.2-69.2-179.4-179.9178.50111N184 Q190 I196N184-K186 PolarHBondContact O-N 2.65Å; N184-K186 VanDerWaalsContact O-N 3.11Å; K186-Q190 WeakPolarHBondContact O-CG 3.39Å; K186-Q190 PolarHBondContact O-N 3.03Å; K186-Q190 VanDerWaalsContact O-N 3.1Å; K186-I196 HydrophobicContact CB-CD1 4.49Å; K186-I196 HydrophobicContact CG-CD1 3.85Å
187L89.1Confident88.2Confident50 Ų5063.2 Ų63.226%0.26231%0.314SS..Hα-helixtrans-68.3-42.2178.6-179.461000111.4Y181 N184 S189 Q190 K191Y181-L187 HydrophobicContact CD1-CD2 3.59Å; Y181-L187 HydrophobicContact CD2-CD2 4.07Å; Y181-L187 HydrophobicContact CD2-CG 4.42Å; Y181-L187 HydrophobicContact CE1-CD2 3.96Å; Y181-L187 HydrophobicContact CE2-CD2 4.39Å; Y181-L187 HydrophobicContact CG-CD2 3.66Å; Y181-L187 HydrophobicContact CG-CG 4.44Å; N184-L187 HydrophobicContact CB-CB 4.4Å; N184-L187 PolarHBondContact O-N 3.2Å; L187-S189 VanDerWaalsContact C-N 3.34Å; L187-Q190 PolarHBondContact O-N 3.04Å; L187-K191 PolarHBondContact O-N 3.29Å
188I90.4Very high87.8Confident0 Ų062.1 Ų62.10%031%0.311CS..Hα-helixtrans-63.5-43.3177.7-57175.2000110.3L174 F177 H178 Y181 G182 N184 W185 Q190 K191 M192 L199L174-I188 HydrophobicContact CD1-CG2 4.07Å; F177-I188 HydrophobicContact CB-CG1 4.11Å; F177-I188 HydrophobicContact CB-CG2 3.93Å; F177-I188 HydrophobicContact CD2-CG2 4.46Å; H178-I188 HydrophobicContact CB-CD1 4.35Å; Y181-I188 HydrophobicContact CD2-CG1 4.47Å; G182-I188 WeakPolarHBondContact O-CD1 3.45Å; N184-I188 WeakPolarHBondContact O-CG1 3.45Å; N184-I188 PolarHBondContact O-N 3.36Å; N184-I188 VanDerWaalsContact O-N 3.14Å; W185-I188 HydrophobicContact CE3-CD1 4.19Å; W185-I188 HydrophobicContact CZ3-CD1 4.31Å; I188-Q190 VanDerWaalsContact C-N 3.33Å; I188-Q190 PolarHBondContact O-N 3.35Å; I188-K191 PolarHBondContact O-N 2.99Å; I188-K191 VanDerWaalsContact O-N 3.14Å; I188-M192 HydrophobicContact CG2-CG 4.2Å; I188-M192 HydrophobicContact CG2-SD 3.8Å; I188-M192 WeakPolarHBondContact O-CB 3.29Å; I188-M192 PolarHBondContact O-N 3.28Å; I188-L199 HydrophobicContact CG2-CD1 4.03Å
189S89.7Confident87.6Confident15 Ų1560.7 Ų60.711%0.10531%0.305CS..Hα-helixtrans-59.2-40.8175.6174.30000112.8W185 L187 D193 R194 I196W185-S189 WeakPolarHBondContact O-CB 3.42Å; W185-S189 PolarHBondContact O-N 3.32Å; L187-S189 VanDerWaalsContact C-N 3.34Å; S189-D193 WeakPolarHBondContact O-CA 3.06Å; S189-D193 PolarHBondContact O-N 3.24Å; S189-R194 WeakPolarHBondContact CA-O 3.19Å; S189-R194 VanDerWaalsContact CB-O 3.3Å; S189-R194 WeakPolarHBondContact CB-O 3.42Å; S189-R194 PolarHBondContact O-N 3.17Å; S189-R194 PolarHBondContact OG-O 3.2Å; S189-I196 VanDerWaalsContact CB-CG1 3.46Å
190Q88.9Confident87.5Confident134 Ų13458.3 Ų58.363%0.62629%0.289SS*.Hα-helixtrans-65.4-37.9174.6-73.2170.9-15.800112.4K186 L187 I188K186-Q190 WeakPolarHBondContact O-CG 3.39Å; K186-Q190 PolarHBondContact O-N 3.03Å; K186-Q190 VanDerWaalsContact O-N 3.1Å; L187-Q190 PolarHBondContact O-N 3.04Å; I188-Q190 VanDerWaalsContact C-N 3.33Å; I188-Q190 PolarHBondContact O-N 3.35Å
191K89.5Confident87Confident103 Ų10360.1 Ų60.145%0.44829%0.292SS..Hα-helixtrans-77-32.3-179.2-75.4-177.6172.8-74.70114.3F177 Y181 L187 I188F177-K191 HydrophobicContact CD1-CD 4.07Å; F177-K191 HydrophobicContact CD2-CB 4.3Å; F177-K191 HydrophobicContact CE1-CB 4.43Å; F177-K191 HydrophobicContact CE1-CD 3.86Å; F177-K191 HydrophobicContact CE2-CB 3.89Å; F177-K191 HydrophobicContact CZ-CB 3.97Å; F177-K191 HydrophobicContact CZ-CD 4.21Å; Y181-K191 HydrophobicContact CD2-CD 4.44Å; Y181-K191 HydrophobicContact CE2-CD 3.58Å; Y181-K191 VanDerWaalsContact OH-CE 3.26Å; Y181-K191 WeakPolarHBondContact OH-CE 3.39Å; L187-K191 PolarHBondContact O-N 3.29Å; I188-K191 PolarHBondContact O-N 2.99Å; I188-K191 VanDerWaalsContact O-N 3.14Å
192M87.5Confident86.6Confident23 Ų2359.2 Ų59.211%0.11329%0.288CS..Hα-helixtrans-95.1-4.6-179.5-67.9-169.669.600113.6E170 A173 L174 F177 I188 R194 L199E170-M192 HydrophobicContact CB-CE 4.17Å; E170-M192 WeakPolarHBondContact O-CE 3.22Å; A173-M192 HydrophobicContact CB-CE 4.35Å; L174-M192 HydrophobicContact CB-CE 3.84Å; L174-M192 HydrophobicContact CB-SD 3.8Å; L174-M192 HydrophobicContact CD1-SD 3.89Å; L174-M192 HydrophobicContact CG-SD 4.42Å; F177-M192 HydrophobicContact CD2-CG 3.58Å; F177-M192 HydrophobicContact CD2-SD 4.09Å; F177-M192 HydrophobicContact CE2-CG 3.72Å; I188-M192 HydrophobicContact CG2-CG 4.2Å; I188-M192 HydrophobicContact CG2-SD 3.8Å; I188-M192 WeakPolarHBondContact O-CB 3.29Å; I188-M192 PolarHBondContact O-N 3.28Å; M192-R194 PolarHBondContact O-N 3.08Å; M192-L199 HydrophobicContact CB-CD1 4.4Å; M192-L199 HydrophobicContact CB-CD2 4.47Å; M192-L199 HydrophobicContact CE-CD2 3.89Å; M192-L199 HydrophobicContact SD-CD1 4.34Å; M192-L199 HydrophobicContact SD-CD2 3.6Å
193D87.5Confident86.4Confident88 Ų8859.7 Ų59.747%0.47128%0.282SS..THydrogen-bonded Turntrans50.430.6-174.5-155.336000114.9K160 S189K160-D193 WeakPolarHBondContact CE-OD1 3.46Å; K160-D193 IonicContact NZ-OD1 2.85Å; K160-D193 PolarHBondContact NZ-OD1 2.88Å; S189-D193 WeakPolarHBondContact O-CA 3.06Å; S189-D193 PolarHBondContact O-N 3.24Å
194R85.9Confident85.8Confident12 Ų1257 Ų575%0.04528%0.277CS..SBendtrans-120.6155.1177.8-78.7-167.2177.3-126.1-0.3111.3M163 G164 R165 F166 E170 S189 M192 L199M163-R194 PolarHBondContact O-NH2 3.17Å; G164-R194 PolarHBondContact O-NH1 3.41Å; G164-R194 VanDerWaalsContact O-NH1 3.11Å; R165-R194 PolarHBondContact O-NH2 3.48Å; F166-R194 VanDerWaalsContact CE1-CD 3.49Å; E170-R194 IonicContact OE1-CZ 3.21Å; E170-R194 IonicContact OE1-NE 3.46Å; E170-R194 PolarHBondContact OE1-NE 2.68Å; E170-R194 IonicContact OE1-NH2 3.46Å; E170-R194 PolarHBondContact OE1-NH2 3.49Å; E170-R194 IonicContact OE2-CZ 2.73Å; E170-R194 IonicContact OE2-NE 2.85Å; E170-R194 IonicContact OE2-NH2 3.54Å; E170-R194 PolarHBondContact OE2-NH2 2.84Å; S189-R194 WeakPolarHBondContact CA-O 3.19Å; S189-R194 VanDerWaalsContact CB-O 3.3Å; S189-R194 WeakPolarHBondContact CB-O 3.42Å; S189-R194 PolarHBondContact O-N 3.17Å; S189-R194 PolarHBondContact OG-O 3.2Å; M192-R194 PolarHBondContact O-N 3.08Å; R194-L199 HydrophobicContact CB-CD1 4.47Å; R194-L199 HydrophobicContact CB-CD2 4.06Å; R194-L199 HydrophobicContact CB-CG 4.19Å
195S85.9Confident84.8Confident1 Ų155.9 Ų55.91%0.00727%0.272CS..  trans-58.8138.7179.8-173.90000112.8D158 K160 F197 S198 L199D158-S195 WeakPolarHBondContact OD2-CB 3.44Å; D158-S195 PolarHBondContact OD2-OG 3.45Å; K160-S195 WeakPolarHBondContact O-CB 3.34Å; K160-S195 PolarHBondContact O-N 3.15Å; S195-F197 PolarHBondContact O-N 3.49Å; S195-F197 PolarHBondContact OG-N 2.97Å; S195-S198 WeakPolarHBondContact O-CB 3.4Å; S195-S198 PolarHBondContact O-N 3.21Å; S195-S198 VanDerWaalsContact O-N 3.09Å; S195-L199 WeakPolarHBondContact O-CG 3.42Å; S195-L199 PolarHBondContact O-N 3.24Å
196I87.5Confident83.8Confident43 Ų4354.9 Ų54.922%0.22127%0.27CS..Hα-helixtrans-48.5-45173-66.4174.1000111.1W185 K186 S189 L199 Q200W185-I196 HydrophobicContact CB-CG2 3.8Å; K186-I196 HydrophobicContact CB-CD1 4.49Å; K186-I196 HydrophobicContact CG-CD1 3.85Å; S189-I196 VanDerWaalsContact CB-CG1 3.46Å; I196-L199 PolarHBondContact O-N 2.99Å; I196-Q200 HydrophobicContact CG2-CG 4.44Å; I196-Q200 WeakPolarHBondContact O-CB 3.46Å; I196-Q200 VanDerWaalsContact O-CG 3.3Å; I196-Q200 WeakPolarHBondContact O-CG 3.43Å; I196-Q200 PolarHBondContact O-N 2.81Å
197F81.8Confident82.2Confident46 Ų4648.8 Ų48.820%0.20225%0.249CC..Hα-helixtrans-69.5-38.1-176.7-63.9-70.9000112.4L151 L154 K155 S195 K201L151-F197 HydrophobicContact CD2-CE1 3.87Å; L151-F197 HydrophobicContact CD2-CZ 3.68Å; L154-F197 HydrophobicContact CB-CE2 3.88Å; L154-F197 HydrophobicContact CB-CZ 4.4Å; L154-F197 HydrophobicContact CD1-CE2 4.15Å; L154-F197 HydrophobicContact CD1-CZ 4.06Å; K155-F197 HydrophobicContact CG-CB 4.45Å; K155-F197 HydrophobicContact CG-CD2 3.9Å; K155-F197 HydrophobicContact CG-CE2 4.34Å; K155-F197 HydrophobicContact CG-CG 4.13Å; S195-F197 PolarHBondContact O-N 3.49Å; S195-F197 PolarHBondContact OG-N 2.97Å; F197-K201 VanDerWaalsContact O-CB 3.23Å; F197-K201 WeakPolarHBondContact O-CB 3.47Å; F197-K201 PolarHBondContact O-N 3.09Å
198S81.5Confident80.2Confident21 Ų2152 Ų5215%0.14728%0.276CS..Hα-helixtrans-63.8-45.7176.5-1740000110.6F166 S195 K201 R202F166-S198 WeakPolarHBondContact CE2-OG 3.49Å; F166-S198 WeakPolarHBondContact CZ-OG 3.46Å; S195-S198 WeakPolarHBondContact O-CB 3.4Å; S195-S198 PolarHBondContact O-N 3.21Å; S195-S198 VanDerWaalsContact O-N 3.09Å; S198-K201 PolarHBondContact O-N 3.23Å; S198-R202 VanDerWaalsContact O-CB 3.3Å; S198-R202 WeakPolarHBondContact O-CB 3.05Å; S198-R202 PolarHBondContact O-N 3.26Å
199L86.3Confident78.2Confident0 Ų055.5 Ų55.50%030%0.3CS..Hα-helixtrans-64.2-47.3177.7-64.1175.3000112.7F166 L174 W185 I188 M192 R194 S195 I196 K201 R202 F203F166-L199 HydrophobicContact CE1-CD2 3.75Å; F166-L199 HydrophobicContact CZ-CD2 4.08Å; L174-L199 HydrophobicContact CD1-CB 4.33Å; L174-L199 HydrophobicContact CD1-CD2 4.05Å; L174-L199 HydrophobicContact CD2-CD2 4.39Å; W185-L199 HydrophobicContact CE3-CB 4.24Å; W185-L199 HydrophobicContact CZ3-CB 4.42Å; I188-L199 HydrophobicContact CG2-CD1 4.03Å; M192-L199 HydrophobicContact CB-CD1 4.4Å; M192-L199 HydrophobicContact CB-CD2 4.47Å; M192-L199 HydrophobicContact CE-CD2 3.89Å; M192-L199 HydrophobicContact SD-CD1 4.34Å; M192-L199 HydrophobicContact SD-CD2 3.6Å; R194-L199 HydrophobicContact CB-CD1 4.47Å; R194-L199 HydrophobicContact CB-CD2 4.06Å; R194-L199 HydrophobicContact CB-CG 4.19Å; S195-L199 WeakPolarHBondContact O-CG 3.42Å; S195-L199 PolarHBondContact O-N 3.24Å; I196-L199 PolarHBondContact O-N 2.99Å; L199-K201 VanDerWaalsContact C-N 3.34Å; L199-K201 PolarHBondContact O-N 3.21Å; L199-R202 PolarHBondContact O-N 3.2Å; L199-F203 VanDerWaalsContact O-CB 3.27Å; L199-F203 WeakPolarHBondContact O-CB 3.18Å; L199-F203 PolarHBondContact O-N 3.11Å
200Q84.2Confident76Confident73 Ų7360.8 Ų60.834%0.34133%0.334SS..Hα-helixtrans-58.8-46.1176.2-77.8177.1-14.600111.9W185 I196 A204W185-Q200 HydrophobicContact CB-CG 4.32Å; W185-Q200 HydrophobicContact CD2-CG 3.44Å; W185-Q200 VanDerWaalsContact CD2-CG 3.44Å; W185-Q200 HydrophobicContact CE3-CG 3.93Å; W185-Q200 HydrophobicContact CG-CG 3.6Å; W185-Q200 HydrophobicContact CZ2-CG 4.3Å; I196-Q200 HydrophobicContact CG2-CG 4.44Å; I196-Q200 WeakPolarHBondContact O-CB 3.46Å; I196-Q200 VanDerWaalsContact O-CG 3.3Å; I196-Q200 WeakPolarHBondContact O-CG 3.43Å; I196-Q200 PolarHBondContact O-N 2.81Å; Q200-A204 VanDerWaalsContact O-CB 3.31Å; Q200-A204 WeakPolarHBondContact O-CB 3.18Å; Q200-A204 PolarHBondContact O-N 3.07Å
201K80.9Confident74.1Confident159 Ų15957.5 Ų57.569%0.69134%0.336SS*.Hα-helixtrans-62.7-47.5178.5-175.7-178.2-179.2-173.80110.5F197 S198 L199 A204 T205F197-K201 VanDerWaalsContact O-CB 3.23Å; F197-K201 WeakPolarHBondContact O-CB 3.47Å; F197-K201 PolarHBondContact O-N 3.09Å; S198-K201 PolarHBondContact O-N 3.23Å; L199-K201 VanDerWaalsContact C-N 3.34Å; L199-K201 PolarHBondContact O-N 3.21Å; K201-A204 PolarHBondContact O-N 2.9Å; K201-T205 WeakPolarHBondContact O-CG2 3.2Å; K201-T205 PolarHBondContact O-N 2.91Å; K201-T205 PolarHBondContact O-OG1 3.14Å
202R80.9Confident72.5Confident67 Ų6753.8 Ų53.825%0.25332%0.322SS..Hα-helixtrans-63.7-46.4-179.6-177.156.7178.9176.5-3111F166 L171 L174 S198 L199 A204 T205 L206F166-R202 HydrophobicContact CD1-CG 4.26Å; F166-R202 HydrophobicContact CD2-CB 4.19Å; F166-R202 HydrophobicContact CD2-CG 3.77Å; F166-R202 HydrophobicContact CE1-CB 4.41Å; F166-R202 HydrophobicContact CE1-CG 4.27Å; F166-R202 HydrophobicContact CE2-CB 3.67Å; F166-R202 HydrophobicContact CE2-CG 3.78Å; F166-R202 HydrophobicContact CG-CG 4.02Å; F166-R202 HydrophobicContact CZ-CB 3.79Å; F166-R202 HydrophobicContact CZ-CG 4.03Å; L171-R202 HydrophobicContact CD2-CG 3.92Å; L174-R202 HydrophobicContact CD2-CB 4.24Å; L174-R202 HydrophobicContact CD2-CG 4.04Å; S198-R202 VanDerWaalsContact O-CB 3.3Å; S198-R202 WeakPolarHBondContact O-CB 3.05Å; S198-R202 PolarHBondContact O-N 3.26Å; L199-R202 PolarHBondContact O-N 3.2Å; R202-A204 PolarHBondContact O-N 2.64Å; R202-T205 WeakPolarHBondContact CA-OG1 3.35Å; R202-T205 CarbonylContact O-C 3.59Å; R202-T205 PolarHBondContact O-N 2.77Å; R202-T205 VanDerWaalsContact O-N 3.08Å; R202-T205 PolarHBondContact O-OG1 2.84Å; R202-L206 HydrophobicContact CG-CD1 3.86Å; R202-L206 HydrophobicContact CG-CG 4.33Å; R202-L206 VanDerWaalsContact O-CG 3.32Å; R202-L206 WeakPolarHBondContact O-CG 3.28Å; R202-L206 PolarHBondContact O-N 3.17Å
203F82.2Confident70.8Confident39 Ų3953.9 Ų53.917%0.17133%0.329CS..Hα-helixtrans-62-41177-169.6-95000112.7L174 H178 W185 L199 T205 L206L174-F203 HydrophobicContact CD2-CB 4.28Å; L174-F203 HydrophobicContact CG-CD2 4.2Å; H178-F203 HydrophobicContact CB-CD2 4.25Å; H178-F203 HydrophobicContact CB-CE2 3.68Å; H178-F203 HydrophobicContact CB-CZ 4.13Å; H178-F203 AromaticContact CD2-CE1 3.84Å; H178-F203 AromaticContact CD2-CE2 3.94Å; H178-F203 AromaticContact CD2-CZ 3.67Å; H178-F203 AromaticContact CE1-CE1 3.62Å; H178-F203 AromaticContact CE1-CZ 3.33Å; H178-F203 WeakPolarHBondContact CE1-CZ 3.4Å; H178-F203 AromaticContact CG-CE2 3.44Å; H178-F203 VanDerWaalsContact CG-CE2 3.44Å; H178-F203 AromaticContact CG-CZ 3.37Å; H178-F203 AromaticContact ND1-CE1 3.92Å; H178-F203 AromaticContact ND1-CE2 3.64Å; H178-F203 AromaticContact ND1-CZ 3.16Å; H178-F203 WeakPolarHBondContact ND1-CZ 3.19Å; H178-F203 AromaticContact NE2-CE1 3.57Å; H178-F203 AromaticContact NE2-CZ 3.63Å; W185-F203 HydrophobicContact CH2-CB 3.55Å; W185-F203 AromaticContact CH2-CD1 3.61Å; W185-F203 HydrophobicContact CH2-CD1 3.61Å; W185-F203 HydrophobicContact CH2-CD2 4.25Å; W185-F203 HydrophobicContact CH2-CE1 4.37Å; W185-F203 AromaticContact CH2-CG 3.53Å; W185-F203 HydrophobicContact CH2-CG 3.53Å; W185-F203 HydrophobicContact CZ2-CD1 4.15Å; W185-F203 HydrophobicContact CZ2-CG 4.49Å; W185-F203 HydrophobicContact CZ3-CB 3.99Å; W185-F203 HydrophobicContact CZ3-CG 4.27Å; L199-F203 VanDerWaalsContact O-CB 3.27Å; L199-F203 WeakPolarHBondContact O-CB 3.18Å; L199-F203 PolarHBondContact O-N 3.11Å; F203-T205 PolarHBondContact O-N 3.23Å; F203-L206 CarbonylContact O-C 3.37Å; F203-L206 PolarHBondContact O-N 3.4Å; F203-L206 VanDerWaalsContact O-N 3.14Å
204A75.1Confident69.1Low62 Ų6254.9 Ų54.951%0.51233%0.33SS..Hα-helixtrans-63.4-24.2175.700000113.5Q200 K201 R202Q200-A204 VanDerWaalsContact O-CB 3.31Å; Q200-A204 WeakPolarHBondContact O-CB 3.18Å; Q200-A204 PolarHBondContact O-N 3.07Å; K201-A204 PolarHBondContact O-N 2.9Å; R202-A204 PolarHBondContact O-N 2.64Å
205T68.1Low67.9Low54 Ų5456.9 Ų56.933%0.33136%0.355SS..Hα-helixtrans-91-23174.7590000113.8K201 R202 F203 G207K201-T205 WeakPolarHBondContact O-CG2 3.2Å; K201-T205 PolarHBondContact O-N 2.91Å; K201-T205 PolarHBondContact O-OG1 3.14Å; R202-T205 WeakPolarHBondContact CA-OG1 3.35Å; R202-T205 CarbonylContact O-C 3.59Å; R202-T205 PolarHBondContact O-N 2.77Å; R202-T205 VanDerWaalsContact O-N 3.08Å; R202-T205 PolarHBondContact O-OG1 2.84Å; F203-T205 PolarHBondContact O-N 3.23Å; T205-G207 PolarHBondContact O-N 3.22Å
206L68.8Low66.9Low16 Ų1663.3 Ų63.38%0.08439%0.394CS..SBendtrans-75102.8169.6-70.2163.3000106L171 L174 R202 F203 S208L171-L206 HydrophobicContact CD2-CD1 3.9Å; L171-L206 HydrophobicContact CD2-CD2 4.16Å; L174-L206 HydrophobicContact CD2-CD1 3.78Å; R202-L206 HydrophobicContact CG-CD1 3.86Å; R202-L206 HydrophobicContact CG-CG 4.33Å; R202-L206 VanDerWaalsContact O-CG 3.32Å; R202-L206 WeakPolarHBondContact O-CG 3.28Å; R202-L206 PolarHBondContact O-N 3.17Å; F203-L206 CarbonylContact O-C 3.37Å; F203-L206 PolarHBondContact O-N 3.4Å; F203-L206 VanDerWaalsContact O-N 3.14Å; L206-S208 PolarHBondContact O-N 3.48Å
207G54.7Low66.2Low19 Ų1963.3 Ų63.320%0.19639%0.391CS..  trans-50.4142.9177.200000110.4T205 S209T205-G207 PolarHBondContact O-N 3.22Å; G207-S209 PolarHBondContact O-N 2.93Å
208S47.7Very low66.1Low118 Ų11864.2 Ų64.283%0.82540%0.4SS*.SBendtrans-66.619.6-166.4-52.10000116.3L206L206-S208 PolarHBondContact O-N 3.48Å
209S47.8Very low65.8Low72 Ų7266.2 Ų66.250%0.50342%0.418SS..SBendtrans-136132.5-178.3-66.80000112.1G207 G211 V212G207-S209 PolarHBondContact O-N 2.93Å; S209-G211 PolarHBondContact O-N 3.15Å; S209-V212 PolarHBondContact O-N 3.04Å
210P43.2Very low65.4Low127 Ų12771.6 Ų71.683%0.82544%0.443SS*.THydrogen-bonded Turntrans-59.3120160.8-3.316.5000107.6
211G50Low65.1Low65 Ų6568.7 Ų68.767%0.6743%0.43SS*.THydrogen-bonded Turntrans119.5-1.5-174.100000114.9S209 G213S209-G211 PolarHBondContact O-N 3.15Å; G211-G213 PolarHBondContact O-N 2.87Å; G211-G213 VanDerWaalsContact O-N 3.15Å
212V55.1Low64.9Low24 Ų2463.1 Ų63.115%0.14541%0.406CS..  trans-68.9109.1167172.60000109S209 H214 T264S209-V212 PolarHBondContact O-N 3.04Å; V212-H214 PolarHBondContact O-N 3.29Å; V212-T264 CarbonylContact C-O 3.55Å; V212-T264 WeakPolarHBondContact CA-O 3.37Å
213G52.7Low64.8Low26 Ų2665 Ų6527%0.26842%0.418SS..  trans-59.3121.3-177.700000112G211 T264 R265 Q269G211-G213 PolarHBondContact O-N 2.87Å; G211-G213 VanDerWaalsContact O-N 3.15Å; G213-T264 PolarHBondContact N-O 3.14Å; G213-R265 PolarHBondContact O-NH1 2.82Å; G213-Q269 PolarHBondContact O-NE2 2.66Å
214H50.6Low64.8Low108 Ų10867.5 Ų67.550%0.543%0.426SS..  trans-92.1114.1159-74.4-57.3000107.5V212V212-H214 PolarHBondContact O-N 3.29Å
215G60.5Low65.2Low54 Ų5464.6 Ų64.656%0.55740%0.402SS*.SBendtrans154.4-179.4-175.200000113.8R265G215-R265 PolarHBondContact O-NH1 3.16Å; G215-R265 PolarHBondContact O-NH2 3.23Å
216V65.6Low65.8Low137 Ų13763.8 Ų63.883%0.8339%0.394SS*.SBendtrans-57.5144.6174.3-176.90000109.7R265V216-R265 PolarHBondContact O-NH2 2.93Å
217W73.5Confident66.4Low43 Ų4366.7 Ų66.716%0.16341%0.407CS..PPolyproline II helixtrans-71.4128.8176.8-78.970.8000109.7E221 E222 L225 R265 Q269 K273W217-E221 WeakPolarHBondContact CA-OE2 3.25Å; W217-E221 HydrophobicContact CE3-CB 3.7Å; W217-E221 HydrophobicContact CZ3-CB 4.11Å; W217-E222 HydrophobicContact CB-CG 4.01Å; W217-E222 HydrophobicContact CE3-CG 4.03Å; W217-L225 HydrophobicContact CH2-CD2 3.79Å; W217-L225 HydrophobicContact CZ3-CB 4.07Å; W217-L225 HydrophobicContact CZ3-CD2 3.83Å; W217-R265 HydrophobicContact CH2-CB 3.9Å; W217-R265 HydrophobicContact CH2-CG 3.66Å; W217-R265 HydrophobicContact CZ2-CB 4.14Å; W217-R265 HydrophobicContact CZ2-CG 3.8Å; W217-R265 HydrophobicContact CZ3-CG 4.04Å; W217-Q269 HydrophobicContact CZ2-CB 4.22Å; W217-K273 HydrophobicContact CD2-CB 4.2Å; W217-K273 HydrophobicContact CD2-CD 3.88Å; W217-K273 HydrophobicContact CD2-CG 3.64Å; W217-K273 HydrophobicContact CE3-CG 3.9Å; W217-K273 HydrophobicContact CG-CD 3.9Å; W217-K273 HydrophobicContact CG-CG 4.21Å; W217-K273 HydrophobicContact CH2-CB 3.81Å; W217-K273 HydrophobicContact CH2-CG 3.99Å; W217-K273 HydrophobicContact CZ2-CB 3.32Å; W217-K273 HydrophobicContact CZ2-CG 3.72Å; W217-K273 HydrophobicContact CZ3-CB 4.4Å; W217-K273 HydrophobicContact CZ3-CG 4.08Å
218T78.4Confident67.8Low64 Ų6466 Ų6639%0.39340%0.399SS..PPolyproline II helixtrans-79.9159.6170.881.70000110.5E220 E221 E222T218-E220 WeakPolarHBondContact CB-OE2 3.3Å; T218-E220 PolarHBondContact O-N 3.22Å; T218-E220 PolarHBondContact OG1-OE2 2.95Å; T218-E221 PolarHBondContact N-OE2 3.18Å; T218-E221 PolarHBondContact O-N 3.47Å; T218-E221 WeakPolarHBondContact OG1-CG 3.49Å; T218-E221 PolarHBondContact OG1-N 3.34Å; T218-E222 PolarHBondContact O-N 2.82Å
219A75.6Confident69.3Low64 Ų6460.3 Ų60.353%0.52936%0.36SS..Hα-helixtrans-58.4-37178.200000111.6E222 Q223A219-E222 PolarHBondContact O-N 3.27Å; A219-Q223 WeakPolarHBondContact O-CB 3.2Å; A219-Q223 WeakPolarHBondContact O-CG 3.46Å; A219-Q223 PolarHBondContact O-N 3.5Å
220E77.4Confident70.6Confident112 Ų11259.6 Ų59.652%0.52335%0.346SS..Hα-helixtrans-71.5-33.9179.1-50.275.4-162.600112.2T218 R224T218-E220 WeakPolarHBondContact CB-OE2 3.3Å; T218-E220 PolarHBondContact O-N 3.22Å; T218-E220 PolarHBondContact OG1-OE2 2.95Å; E220-R224 WeakPolarHBondContact O-CB 3.37Å; E220-R224 WeakPolarHBondContact O-CG 3.38Å; E220-R224 PolarHBondContact O-N 3.2Å; E220-R224 VanDerWaalsContact O-N 3.1Å; E220-R224 PolarHBondContact O-NE 3.03Å
221E78.1Confident72.4Confident12 Ų1257.3 Ų57.36%0.05632%0.324CS..Hα-helixtrans-66.8-41.7172-68.8-178.8126.700111.3W217 T218 L225 T264 R265W217-E221 WeakPolarHBondContact CA-OE2 3.25Å; W217-E221 HydrophobicContact CE3-CB 3.7Å; W217-E221 HydrophobicContact CZ3-CB 4.11Å; T218-E221 PolarHBondContact N-OE2 3.18Å; T218-E221 PolarHBondContact O-N 3.47Å; T218-E221 WeakPolarHBondContact OG1-CG 3.49Å; T218-E221 PolarHBondContact OG1-N 3.34Å; E221-L225 WeakPolarHBondContact O-CB 3.37Å; E221-L225 PolarHBondContact O-N 3.11Å; E221-T264 WeakPolarHBondContact OE1-CB 3.43Å; E221-T264 PolarHBondContact OE1-OG1 2.9Å; E221-R265 IonicContact OE1-CZ 3.97Å; E221-R265 IonicContact OE1-NE 2.72Å; E221-R265 PolarHBondContact OE1-NE 2.8Å; E221-R265 IonicContact OE1-NH2 3.16Å; E221-R265 PolarHBondContact OE1-NH2 3.06Å; E221-R265 IonicContact OE2-CZ 2.79Å; E221-R265 IonicContact OE2-NE 3.34Å; E221-R265 PolarHBondContact OE2-NE 2.84Å; E221-R265 IonicContact OE2-NH2 2.64Å; E221-R265 PolarHBondContact OE2-NH2 3.38Å
222E77.9Confident73.6Confident42 Ų4257.4 Ų57.420%0.19630%0.304CS..Hα-helixtrans-66.2-43.4176.2-72.9-167.3-172.700112.5W217 T218 A219 L225 K226 K273W217-E222 HydrophobicContact CB-CG 4.01Å; W217-E222 HydrophobicContact CE3-CG 4.03Å; T218-E222 PolarHBondContact O-N 2.82Å; A219-E222 PolarHBondContact O-N 3.27Å; E222-L225 PolarHBondContact O-N 3.07Å; E222-K226 WeakPolarHBondContact O-CB 3.42Å; E222-K226 WeakPolarHBondContact O-CG 3.33Å; E222-K226 PolarHBondContact O-N 3.09Å; E222-K273 VanDerWaalsContact CD-CE 3.43Å; E222-K273 WeakPolarHBondContact OE1-CE 3.47Å; E222-K273 IonicContact OE1-NZ 3.83Å; E222-K273 PolarHBondContact OE1-NZ 2.67Å
223Q77.6Confident74.4Confident108 Ų10856.3 Ų56.351%0.50530%0.298SS..Hα-helixtrans-62.1-44.5176.7-78.5-174.1-19.100111.6A219 L225 K226 Q227A219-Q223 WeakPolarHBondContact O-CB 3.2Å; A219-Q223 WeakPolarHBondContact O-CG 3.46Å; A219-Q223 PolarHBondContact O-N 3.5Å; Q223-L225 VanDerWaalsContact C-N 3.32Å; Q223-L225 PolarHBondContact O-N 3.42Å; Q223-K226 PolarHBondContact O-N 2.6Å; Q223-Q227 WeakPolarHBondContact O-CB 3.38Å; Q223-Q227 PolarHBondContact O-N 3.1Å
224R83.1Confident75.1Confident91 Ų9159.4 Ų59.434%0.34331%0.305SS..Hα-helixtrans-60.8-40.2174.7-76.8-175.5-68.8175.3-4.2112.6E220 A228 V262E220-R224 WeakPolarHBondContact O-CB 3.37Å; E220-R224 WeakPolarHBondContact O-CG 3.38Å; E220-R224 PolarHBondContact O-N 3.2Å; E220-R224 VanDerWaalsContact O-N 3.1Å; E220-R224 PolarHBondContact O-NE 3.03Å; R224-A228 VanDerWaalsContact O-CB 3.31Å; R224-A228 WeakPolarHBondContact O-CB 3.41Å; R224-A228 PolarHBondContact O-N 3.3Å; R224-V262 PolarHBondContact NH1-O 3.11Å; R224-V262 VanDerWaalsContact NH1-O 3.15Å
225L83.8Confident75.7Confident0 Ų058.6 Ų58.60%031%0.312CS..Hα-helixtrans-64.1-46.2175177.566.2000111.5W217 E221 E222 Q223 Q227 V229 I258 V262 C270 K273 W274 L277W217-L225 HydrophobicContact CH2-CD2 3.79Å; W217-L225 HydrophobicContact CZ3-CB 4.07Å; W217-L225 HydrophobicContact CZ3-CD2 3.83Å; E221-L225 WeakPolarHBondContact O-CB 3.37Å; E221-L225 PolarHBondContact O-N 3.11Å; E222-L225 PolarHBondContact O-N 3.07Å; Q223-L225 VanDerWaalsContact C-N 3.32Å; Q223-L225 PolarHBondContact O-N 3.42Å; L225-Q227 VanDerWaalsContact C-N 3.33Å; L225-Q227 PolarHBondContact O-N 3.01Å; L225-V229 HydrophobicContact CD1-CG2 4.12Å; L225-V229 WeakPolarHBondContact O-CB 3.48Å; L225-V229 VanDerWaalsContact O-CG2 3.26Å; L225-V229 WeakPolarHBondContact O-CG2 3.41Å; L225-V229 PolarHBondContact O-N 3.06Å; L225-I258 HydrophobicContact CD1-CG2 3.76Å; L225-V262 HydrophobicContact CB-CG2 4.07Å; L225-V262 HydrophobicContact CD1-CG2 4.14Å; L225-C270 HydrophobicContact CD1-CB 3.71Å; L225-K273 HydrophobicContact CD2-CB 3.8Å; L225-K273 HydrophobicContact CD2-CG 3.74Å; L225-W274 HydrophobicContact CD2-CB 4.39Å; L225-L277 HydrophobicContact CD2-CD1 4.47Å
226K80.6Confident75.7Confident37 Ų3760.9 Ų60.916%0.16130%0.303CS..Hα-helixtrans-59.2-44.6177.8-74.5172.1-177.3172.60110.8E222 Q223 V229 R230 L277 F399E222-K226 WeakPolarHBondContact O-CB 3.42Å; E222-K226 WeakPolarHBondContact O-CG 3.33Å; E222-K226 PolarHBondContact O-N 3.09Å; Q223-K226 PolarHBondContact O-N 2.6Å; K226-V229 PolarHBondContact O-N 3.44Å; K226-R230 VanDerWaalsContact O-CB 3.25Å; K226-R230 WeakPolarHBondContact O-CB 3.39Å; K226-R230 PolarHBondContact O-N 3.32Å; K226-L277 HydrophobicContact CG-CD1 4.47Å; K226-F399 HydrophobicContact CB-CE1 4.19Å
227Q81.3Confident75.2Confident78 Ų7855.7 Ų55.736%0.36428%0.275SS..Hα-helixtrans-64.9-50.4179.2-175.160.72800112.2Q223 L225 V229 R230 E231Q223-Q227 WeakPolarHBondContact O-CB 3.38Å; Q223-Q227 PolarHBondContact O-N 3.1Å; L225-Q227 VanDerWaalsContact C-N 3.33Å; L225-Q227 PolarHBondContact O-N 3.01Å; Q227-V229 VanDerWaalsContact C-N 3.25Å; Q227-V229 PolarHBondContact O-N 3.02Å; Q227-R230 WeakPolarHBondContact O-CB 3.5Å; Q227-R230 PolarHBondContact O-N 3.33Å; Q227-R230 VanDerWaalsContact O-N 3.08Å; Q227-E231 WeakPolarHBondContact CG-OE1 3.18Å; Q227-E231 PolarHBondContact NE2-OE1 3.42Å; Q227-E231 WeakPolarHBondContact O-CG 3.38Å; Q227-E231 PolarHBondContact O-N 3.31Å
228A82.6Confident74.3Confident3 Ų355.3 Ų55.33%0.02529%0.285CS..Hα-helixtrans-58.6-37.8178.400000112.5R224 R232 I258 E261R224-A228 VanDerWaalsContact O-CB 3.31Å; R224-A228 WeakPolarHBondContact O-CB 3.41Å; R224-A228 PolarHBondContact O-N 3.3Å; A228-R232 WeakPolarHBondContact O-CG 3.3Å; A228-I258 HydrophobicContact CB-CG2 4.11Å; A228-E261 HydrophobicContact CB-CB 4.18Å; A228-E261 WeakPolarHBondContact CB-OE2 3.45Å
229V80.6Confident73Confident0 Ų058.8 Ų58.80%031%0.308CS..Hα-helixtrans-74.9-39.6175.8178.60000111.2L225 K226 Q227 R232 L233 L253 W255 I258 W274L225-V229 HydrophobicContact CD1-CG2 4.12Å; L225-V229 WeakPolarHBondContact O-CB 3.48Å; L225-V229 VanDerWaalsContact O-CG2 3.26Å; L225-V229 WeakPolarHBondContact O-CG2 3.41Å; L225-V229 PolarHBondContact O-N 3.06Å; K226-V229 PolarHBondContact O-N 3.44Å; Q227-V229 VanDerWaalsContact C-N 3.25Å; Q227-V229 PolarHBondContact O-N 3.02Å; V229-R232 PolarHBondContact O-N 3.24Å; V229-L233 HydrophobicContact CG1-CD1 3.59Å; V229-L233 HydrophobicContact CG1-CG 4.09Å; V229-L233 WeakPolarHBondContact O-CB 3.35Å; V229-L233 VanDerWaalsContact O-CG 3.24Å; V229-L233 WeakPolarHBondContact O-CG 3.32Å; V229-L233 PolarHBondContact O-N 3.3Å; V229-L253 HydrophobicContact CG1-CD1 4.09Å; V229-W255 HydrophobicContact CG2-CZ3 4.3Å; V229-I258 HydrophobicContact CG2-CD1 4.15Å; V229-I258 HydrophobicContact CG2-CG2 4.25Å; V229-W274 HydrophobicContact CB-CD2 4.3Å; V229-W274 HydrophobicContact CB-CE3 4.09Å; V229-W274 HydrophobicContact CB-CH2 4.2Å; V229-W274 HydrophobicContact CB-CZ2 4.39Å; V229-W274 HydrophobicContact CB-CZ3 4.04Å; V229-W274 HydrophobicContact CG1-CD2 3.82Å; V229-W274 VanDerWaalsContact CG1-CE2 3.48Å; V229-W274 HydrophobicContact CG1-CE3 3.99Å; V229-W274 HydrophobicContact CG1-CH2 3.57Å; V229-W274 HydrophobicContact CG1-CZ2 3.36Å; V229-W274 HydrophobicContact CG1-CZ3 3.87Å; V229-W274 HydrophobicContact CG2-CD2 4.09Å; V229-W274 HydrophobicContact CG2-CE3 4.07Å; V229-W274 HydrophobicContact CG2-CG 4.45Å
230R75.7Confident71.6Confident57 Ų5762.8 Ų62.822%0.21532%0.321CS..Hα-helixtrans-55.5-52.7176.5-174.1-177.6-60.1169.57.5111.4K226 Q227 R232 L233 E234 F399K226-R230 VanDerWaalsContact O-CB 3.25Å; K226-R230 WeakPolarHBondContact O-CB 3.39Å; K226-R230 PolarHBondContact O-N 3.32Å; Q227-R230 WeakPolarHBondContact O-CB 3.5Å; Q227-R230 PolarHBondContact O-N 3.33Å; Q227-R230 VanDerWaalsContact O-N 3.08Å; R230-R232 PolarHBondContact O-N 3.29Å; R230-L233 CarbonylContact O-C 3.54Å; R230-L233 WeakPolarHBondContact O-CA 3.07Å; R230-L233 PolarHBondContact O-N 3.05Å; R230-E234 WeakPolarHBondContact CD-OE1 3.44Å; R230-E234 HydrophobicContact CG-CG 4.02Å; R230-E234 WeakPolarHBondContact CG-OE1 3.45Å; R230-E234 WeakPolarHBondContact O-CB 3.37Å; R230-E234 WeakPolarHBondContact O-CG 3.41Å; R230-E234 PolarHBondContact O-N 2.95Å; R230-F399 HydrophobicContact CB-CE1 3.92Å; R230-F399 HydrophobicContact CB-CE2 3.81Å; R230-F399 HydrophobicContact CB-CZ 3.41Å; R230-F399 VanDerWaalsContact CB-CZ 3.41Å; R230-F399 HydrophobicContact CG-CD2 3.96Å; R230-F399 HydrophobicContact CG-CE1 4.31Å; R230-F399 HydrophobicContact CG-CE2 3.48Å; R230-F399 VanDerWaalsContact CG-CE2 3.48Å; R230-F399 HydrophobicContact CG-CZ 3.66Å; R230-F399 VanDerWaalsContact CZ-CB 3.49Å; R230-F399 VanDerWaalsContact CZ-CD1 3.47Å
231E79.5Confident70.3Confident78 Ų7860.2 Ų60.236%0.36433%0.325SS..Hα-helixtrans-58.5-36.6-178.5-69.7171.6-166.700112.7Q227 L233 S235Q227-E231 WeakPolarHBondContact CG-OE1 3.18Å; Q227-E231 PolarHBondContact NE2-OE1 3.42Å; Q227-E231 WeakPolarHBondContact O-CG 3.38Å; Q227-E231 PolarHBondContact O-N 3.31Å; E231-L233 VanDerWaalsContact C-N 3.33Å; E231-S235 PolarHBondContact O-N 2.84Å; E231-S235 PolarHBondContact O-OG 3.3Å
232R76.6Confident68.9Low67 Ų6763.3 Ų63.325%0.25335%0.347SS..Hα-helixtrans-79.3-15.9178.2-65-59.8-172.8-78.6-7.9113.7A228 V229 R230 S235 R236 L253 E261A228-R232 WeakPolarHBondContact O-CG 3.3Å; V229-R232 PolarHBondContact O-N 3.24Å; R230-R232 PolarHBondContact O-N 3.29Å; R232-S235 WeakPolarHBondContact CA-OG 3.36Å; R232-S235 PolarHBondContact O-OG 2.91Å; R232-R236 VanDerWaalsContact O-CD 3.31Å; R232-R236 WeakPolarHBondContact O-CD 3.2Å; R232-R236 WeakPolarHBondContact O-CG 3.43Å; R232-R236 PolarHBondContact O-NE 3.4Å; R232-L253 HydrophobicContact CB-CD2 4.35Å; R232-E261 IonicContact CZ-OE1 3.47Å; R232-E261 IonicContact NH1-OE1 3.56Å; R232-E261 IonicContact NH2-OE1 2.69Å; R232-E261 PolarHBondContact NH2-OE1 3.45Å
233L71.4Confident67.7Low1 Ų162.9 Ų62.91%0.00535%0.354CS..Hα-helixtrans-93.6-36.4174-70.6175.6000111.4V229 R230 E231 R236 A237 L244 L249 L253 W274V229-L233 HydrophobicContact CG1-CD1 3.59Å; V229-L233 HydrophobicContact CG1-CG 4.09Å; V229-L233 WeakPolarHBondContact O-CB 3.35Å; V229-L233 VanDerWaalsContact O-CG 3.24Å; V229-L233 WeakPolarHBondContact O-CG 3.32Å; V229-L233 PolarHBondContact O-N 3.3Å; R230-L233 CarbonylContact O-C 3.54Å; R230-L233 WeakPolarHBondContact O-CA 3.07Å; R230-L233 PolarHBondContact O-N 3.05Å; E231-L233 VanDerWaalsContact C-N 3.33Å; L233-R236 CarbonylContact O-C 3.5Å; L233-R236 WeakPolarHBondContact O-CA 3.4Å; L233-R236 WeakPolarHBondContact O-CB 3.43Å; L233-R236 PolarHBondContact O-N 3Å; L233-A237 PolarHBondContact O-N 3.33Å; L233-L244 HydrophobicContact CB-CD1 3.77Å; L233-L244 HydrophobicContact CD2-CD1 4.14Å; L233-L244 HydrophobicContact CG-CD1 4.4Å; L233-L249 HydrophobicContact CD1-CD2 3.73Å; L233-L249 HydrophobicContact CD2-CD2 4.33Å; L233-L253 HydrophobicContact CD2-CD2 4.09Å; L233-L253 HydrophobicContact CG-CD2 4.43Å; L233-W274 HydrophobicContact CD1-CH2 4.37Å; L233-W274 HydrophobicContact CD1-CZ2 3.95Å
234E67.9Low66.8Low92 Ų9258.2 Ų58.243%0.4333%0.333SS..Hα-helixtrans-63.4-41.5174.2-76.5173.2171.300111.6R230 R236 A237 L395R230-E234 WeakPolarHBondContact CD-OE1 3.44Å; R230-E234 HydrophobicContact CG-CG 4.02Å; R230-E234 WeakPolarHBondContact CG-OE1 3.45Å; R230-E234 WeakPolarHBondContact O-CB 3.37Å; R230-E234 WeakPolarHBondContact O-CG 3.41Å; R230-E234 PolarHBondContact O-N 2.95Å; E234-R236 PolarHBondContact O-N 2.87Å; E234-A237 PolarHBondContact O-N 3.35Å; E234-A237 VanDerWaalsContact O-N 3.13Å; E234-L395 HydrophobicContact CG-CD1 4.01Å
235S62.2Low65.4Low90 Ų9056.6 Ų56.663%0.62934%0.336SS*.THydrogen-bonded Turntrans-62.2-8.7170.748.60000114.4E231 R232E231-S235 PolarHBondContact O-N 2.84Å; E231-S235 PolarHBondContact O-OG 3.3Å; R232-S235 WeakPolarHBondContact CA-OG 3.36Å; R232-S235 PolarHBondContact O-OG 2.91Å
236R60.4Low64.1Low102 Ų10258.8 Ų58.839%0.38534%0.344SS..THydrogen-bonded Turntrans-112.3-11.4177.3-62176.9-178.1-169.2-1.5113.6R232 L233 E234 Q251 R252R232-R236 VanDerWaalsContact O-CD 3.31Å; R232-R236 WeakPolarHBondContact O-CD 3.2Å; R232-R236 WeakPolarHBondContact O-CG 3.43Å; R232-R236 PolarHBondContact O-NE 3.4Å; L233-R236 CarbonylContact O-C 3.5Å; L233-R236 WeakPolarHBondContact O-CA 3.4Å; L233-R236 WeakPolarHBondContact O-CB 3.43Å; L233-R236 PolarHBondContact O-N 3Å; E234-R236 PolarHBondContact O-N 2.87Å; R236-Q251 PolarHBondContact NH1-O 2.89Å; R236-Q251 VanDerWaalsContact NH1-O 3.15Å; R236-R252 PolarHBondContact NH2-O 3.08Å
237A55Low62.9Low28 Ų2861.1 Ų61.123%0.23136%0.358CS..SBendtrans-76.8134.5171.900000108.1L233 E234 L244 L395L233-A237 PolarHBondContact O-N 3.33Å; E234-A237 PolarHBondContact O-N 3.35Å; E234-A237 VanDerWaalsContact O-N 3.13Å; A237-L244 HydrophobicContact CB-CD2 4.12Å; A237-L395 HydrophobicContact CB-CD1 4.49Å
238G55.3Low61.8Low36 Ų3661.6 Ų61.637%0.37136%0.36SS..  trans-62.7161.4172.400000111.1D240 G241G238-D240 PolarHBondContact O-N 3.16Å; G238-G241 PolarHBondContact O-N 3.32Å
239P50.3Low60.8Low137 Ų13762 Ų6289%0.8936%0.362SS*.THydrogen-bonded Turntrans-57.2-14.9-178.720.8-31.2000114.7
240D46.6Very low59.7Low147 Ų14762.9 Ų62.979%0.78637%0.368SS*.THydrogen-bonded Turntrans-94.510.2-171.8-62.9-21.8000115.1G238 S242G238-D240 PolarHBondContact O-N 3.16Å; D240-S242 PolarHBondContact O-N 2.86Å
241G50.4Low59Low59 Ų5965.1 Ų65.161%0.60838%0.381SS*.  trans63.113.4177.300000114.4G238 G243G238-G241 PolarHBondContact O-N 3.32Å; G241-G243 PolarHBondContact O-N 3.16Å; G241-G243 VanDerWaalsContact O-N 3.07Å
242S48.6Very low58.2Low76 Ų7671.7 Ų71.753%0.53140%0.403SS..  trans-63.2110.5172.653.90000108.7D240D240-S242 PolarHBondContact O-N 2.86Å
243G53.4Low58.2Low33 Ų3369 Ų6934%0.3439%0.393SS..PPolyproline II helixtrans-46.6150-175.800000114.3G241 Y393G241-G243 PolarHBondContact O-N 3.16Å; G241-G243 VanDerWaalsContact O-N 3.07Å; G243-Y393 WeakPolarHBondContact CA-O 3.44Å
244L56.9Low58.5Low11 Ų1170.8 Ų70.86%0.05840%0.404CS..PPolyproline II helixtrans-79.3135.2-177.6-65.1173.7000110.8L233 A237 Q248 L249 L395L233-L244 HydrophobicContact CB-CD1 3.77Å; L233-L244 HydrophobicContact CD2-CD1 4.14Å; L233-L244 HydrophobicContact CG-CD1 4.4Å; A237-L244 HydrophobicContact CB-CD2 4.12Å; L244-Q248 HydrophobicContact CB-CB 4.28Å; L244-Q248 HydrophobicContact CD2-CB 4.34Å; L244-L249 HydrophobicContact CB-CD2 3.97Å; L244-L249 HydrophobicContact CB-CG 4.19Å; L244-L249 HydrophobicContact CD1-CD2 3.95Å; L244-L395 HydrophobicContact CD1-CD2 4.13Å
245S55.2Low59.1Low57 Ų5767.6 Ų67.640%0.39939%0.388SS..PPolyproline II helixtrans-65.2154.7171.765.50000111.9N247 Q248 L249S245-N247 PolarHBondContact O-N 2.94Å; S245-N247 VanDerWaalsContact O-N 3.11Å; S245-Q248 WeakPolarHBondContact O-CA 3.32Å; S245-Q248 WeakPolarHBondContact O-CB 3.44Å; S245-Q248 PolarHBondContact O-N 3.11Å; S245-Q248 VanDerWaalsContact OG-CD 3.28Å; S245-Q248 VanDerWaalsContact OG-CG 3.28Å; S245-Q248 WeakPolarHBondContact OG-CG 3.21Å; S245-Q248 PolarHBondContact OG-N 3.48Å; S245-Q248 PolarHBondContact OG-OE1 3.02Å; S245-L249 PolarHBondContact O-N 3.31Å; S245-L249 VanDerWaalsContact O-N 3.12Å
246R55.4Low59.9Low46 Ų4671.5 Ų71.517%0.17439%0.39CS..Hα-helixtrans-52.1-34.8176.9-172.2-176-171.61439.3113.5S250 M282 D328R246-S250 PolarHBondContact O-N 3.46Å; R246-S250 PolarHBondContact O-OG 3.24Å; R246-M282 HydrophobicContact CG-CE 4.01Å; R246-M282 HydrophobicContact CG-SD 4.46Å; R246-D328 VanDerWaalsContact CD-O 3.24Å; R246-D328 WeakPolarHBondContact CD-O 3.28Å; R246-D328 PolarHBondContact NE-O 2.88Å; R246-D328 PolarHBondContact NH1-O 2.82Å
247N55.2Low60.8Low86 Ų8671.1 Ų71.146%0.4639%0.392SS..Hα-helixtrans-71.5-35.4176.6-76.8-33.3000112.2S245 S250 Q251S245-N247 PolarHBondContact O-N 2.94Å; S245-N247 VanDerWaalsContact O-N 3.11Å; N247-S250 PolarHBondContact O-N 3.36Å; N247-S250 PolarHBondContact O-OG 3.03Å; N247-Q251 VanDerWaalsContact O-CB 3.3Å; N247-Q251 WeakPolarHBondContact O-CB 3.29Å; N247-Q251 WeakPolarHBondContact O-CG 3.43Å; N247-Q251 PolarHBondContact O-N 3.48Å
248Q59.8Low62Low88 Ų8869.8 Ų69.841%0.41138%0.381SS..Hα-helixtrans-69.5-31.3175.2-72.3166-48.500112.6L244 S245 S250L244-Q248 HydrophobicContact CB-CB 4.28Å; L244-Q248 HydrophobicContact CD2-CB 4.34Å; S245-Q248 WeakPolarHBondContact O-CA 3.32Å; S245-Q248 WeakPolarHBondContact O-CB 3.44Å; S245-Q248 PolarHBondContact O-N 3.11Å; S245-Q248 VanDerWaalsContact OG-CD 3.28Å; S245-Q248 VanDerWaalsContact OG-CG 3.28Å; S245-Q248 WeakPolarHBondContact OG-CG 3.21Å; S245-Q248 PolarHBondContact OG-N 3.48Å; S245-Q248 PolarHBondContact OG-OE1 3.02Å; Q248-S250 VanDerWaalsContact C-N 3.34Å
249L60.3Low63.3Low10 Ų1069 Ų695%0.05237%0.37CS..Hα-helixtrans-73.5-21.9176.2-65.3175.1000114L233 L244 S245 W274 I398L233-L249 HydrophobicContact CD1-CD2 3.73Å; L233-L249 HydrophobicContact CD2-CD2 4.33Å; L244-L249 HydrophobicContact CB-CD2 3.97Å; L244-L249 HydrophobicContact CB-CG 4.19Å; L244-L249 HydrophobicContact CD1-CD2 3.95Å; S245-L249 PolarHBondContact O-N 3.31Å; S245-L249 VanDerWaalsContact O-N 3.12Å; L249-W274 PolarHBondContact O-NE1 2.87Å; L249-I398 HydrophobicContact CD1-CD1 4.24Å; L249-I398 HydrophobicContact CD2-CD1 4.29Å
250S58.3Low64.8Low20 Ų2069.3 Ų69.314%0.1436%0.359CS..Hα-helixtrans-112-26.6-170.856.60000114.3R246 N247 Q248R246-S250 PolarHBondContact O-N 3.46Å; R246-S250 PolarHBondContact O-OG 3.24Å; N247-S250 PolarHBondContact O-N 3.36Å; N247-S250 PolarHBondContact O-OG 3.03Å; Q248-S250 VanDerWaalsContact C-N 3.34Å
251Q59.6Low66.3Low103 Ų10365.5 Ų65.548%0.48134%0.337SS..SBendtrans-99146.6-173.7-59.7-17313.900113.4R236 N247 L253R236-Q251 PolarHBondContact NH1-O 2.89Å; R236-Q251 VanDerWaalsContact NH1-O 3.15Å; N247-Q251 VanDerWaalsContact O-CB 3.3Å; N247-Q251 WeakPolarHBondContact O-CB 3.29Å; N247-Q251 WeakPolarHBondContact O-CG 3.43Å; N247-Q251 PolarHBondContact O-N 3.48Å; Q251-L253 PolarHBondContact O-N 3.3Å
252R63.8Low67.7Low217 Ų21762.7 Ų62.782%0.81931%0.308SS*.SBendtrans63.124170.5-53.2-179.1-178176.40.6116.9R236R236-R252 PolarHBondContact NH2-O 3.08Å
253L76Confident68.9Low11 Ų1168.3 Ų68.36%0.05832%0.318CS..  trans-74.8131.3173.5-70.9172.3000111.6V229 R232 L233 Q251 W255 I258V229-L253 HydrophobicContact CG1-CD1 4.09Å; R232-L253 HydrophobicContact CB-CD2 4.35Å; L233-L253 HydrophobicContact CD2-CD2 4.09Å; L233-L253 HydrophobicContact CG-CD2 4.43Å; Q251-L253 PolarHBondContact O-N 3.3Å; L253-W255 VanDerWaalsContact C-N 3.28Å; L253-W255 HydrophobicContact CB-CD2 4.4Å; L253-W255 HydrophobicContact CB-CH2 4.39Å; L253-W255 HydrophobicContact CB-CZ2 3.83Å; L253-W255 HydrophobicContact CD1-CH2 3.72Å; L253-W255 HydrophobicContact CD1-CZ2 3.58Å; L253-W255 HydrophobicContact CG-CZ2 4.35Å; L253-W255 PolarHBondContact O-N 3.05Å; L253-I258 HydrophobicContact CB-CD1 4.12Å
254P78.4Confident69.8Low37 Ų3768.1 Ų68.124%0.2431%0.31CS..  trans-78.474.8179.733-35.1000110.9R256 E257 I258P254-R256 PolarHBondContact O-N 2.94Å; P254-E257 HydrophobicContact CB-CB 4.35Å; P254-E257 HydrophobicContact CB-CG 4.33Å; P254-E257 PolarHBondContact O-N 3.13Å; P254-I258 PolarHBondContact O-N 3.02Å; P254-I258 VanDerWaalsContact O-N 3.16Å
255W81.2Confident70.5Confident25 Ų2568 Ų6810%0.09531%0.309CS..Hα-helixtrans-54.7-25.7-174.8-65.4107.1000115.2V229 L253 I258 S259 W267 C270 R271 W274 F275V229-W255 HydrophobicContact CG2-CZ3 4.3Å; L253-W255 VanDerWaalsContact C-N 3.28Å; L253-W255 HydrophobicContact CB-CD2 4.4Å; L253-W255 HydrophobicContact CB-CH2 4.39Å; L253-W255 HydrophobicContact CB-CZ2 3.83Å; L253-W255 HydrophobicContact CD1-CH2 3.72Å; L253-W255 HydrophobicContact CD1-CZ2 3.58Å; L253-W255 HydrophobicContact CG-CZ2 4.35Å; L253-W255 PolarHBondContact O-N 3.05Å; W255-I258 HydrophobicContact CD2-CD1 4.44Å; W255-I258 HydrophobicContact CE3-CD1 3.91Å; W255-I258 HydrophobicContact CE3-CG2 4.36Å; W255-I258 HydrophobicContact CZ3-CD1 4.03Å; W255-I258 HydrophobicContact CZ3-CG2 4.41Å; W255-S259 VanDerWaalsContact O-CB 3.26Å; W255-S259 WeakPolarHBondContact O-CB 3.38Å; W255-S259 PolarHBondContact O-N 2.93Å; W255-W267 HydrophobicContact CB-CB 3.99Å; W255-W267 HydrophobicContact CB-CE3 4.1Å; W255-W267 WeakPolarHBondContact O-CB 3.49Å; W255-C270 HydrophobicContact CE3-CB 4.25Å; W255-R271 HydrophobicContact CD2-CB 3.58Å; W255-R271 HydrophobicContact CD2-CG 3.93Å; W255-R271 HydrophobicContact CE3-CB 3.84Å; W255-R271 HydrophobicContact CG-CB 3.98Å; W255-R271 HydrophobicContact CG-CG 4.29Å; W255-R271 HydrophobicContact CZ2-CB 4.25Å; W255-R271 HydrophobicContact CZ2-CG 3.95Å; W255-R271 HydrophobicContact CZ3-CB 4.31Å; W255-W274 HydrophobicContact CH2-CB 3.56Å; W255-W274 AromaticContact CH2-CD1 3.39Å; W255-W274 AromaticContact CH2-CG 3.59Å; W255-W274 HydrophobicContact CH2-CG 3.59Å; W255-W274 AromaticContact CZ2-CD1 3.96Å; W255-W274 HydrophobicContact CZ3-CB 3.94Å; W255-W274 HydrophobicContact CZ3-CG 4.32Å; W255-F275 HydrophobicContact CZ2-CE2 4.17Å
256R78.1Confident71.5Confident173 Ų17365.4 Ų65.465%0.65329%0.291SS*.Hα-helixtrans-69.1-41176.9-68.3-178-176.2-91.70.2112.1P254 Q260 W267P254-R256 PolarHBondContact O-N 2.94Å; R256-Q260 WeakPolarHBondContact O-CG 3.13Å; R256-Q260 PolarHBondContact O-N 3.33Å; R256-W267 HydrophobicContact CG-CB 4.5Å; R256-W267 HydrophobicContact CG-CG 4.41Å
257E78.4Confident72.5Confident93 Ų9367.5 Ų67.544%0.43530%0.298SS..Hα-helixtrans-71.6-45.3176.5-66.8165.4-147.200110.2P254 S259 Q260 E261P254-E257 HydrophobicContact CB-CB 4.35Å; P254-E257 HydrophobicContact CB-CG 4.33Å; P254-E257 PolarHBondContact O-N 3.13Å; E257-S259 PolarHBondContact O-N 3.42Å; E257-Q260 WeakPolarHBondContact O-CA 3.35Å; E257-Q260 WeakPolarHBondContact O-CB 3.44Å; E257-Q260 PolarHBondContact O-N 2.86Å; E257-E261 PolarHBondContact O-N 3.31Å
258I81.6Confident73.3Confident0 Ų066.2 Ų66.20%029%0.294CS..Hα-helixtrans-56.1-40.2175.6-64.9165.7000110.9L225 A228 V229 L253 P254 W255 Q260 E261 V262 C270L225-I258 HydrophobicContact CD1-CG2 3.76Å; A228-I258 HydrophobicContact CB-CG2 4.11Å; V229-I258 HydrophobicContact CG2-CD1 4.15Å; V229-I258 HydrophobicContact CG2-CG2 4.25Å; L253-I258 HydrophobicContact CB-CD1 4.12Å; P254-I258 PolarHBondContact O-N 3.02Å; P254-I258 VanDerWaalsContact O-N 3.16Å; W255-I258 HydrophobicContact CD2-CD1 4.44Å; W255-I258 HydrophobicContact CE3-CD1 3.91Å; W255-I258 HydrophobicContact CE3-CG2 4.36Å; W255-I258 HydrophobicContact CZ3-CD1 4.03Å; W255-I258 HydrophobicContact CZ3-CG2 4.41Å; I258-Q260 VanDerWaalsContact C-N 3.32Å; I258-Q260 PolarHBondContact O-N 3.44Å; I258-E261 PolarHBondContact O-N 2.99Å; I258-V262 HydrophobicContact CG2-CG2 4.41Å; I258-V262 VanDerWaalsContact O-CG2 3.28Å; I258-V262 WeakPolarHBondContact O-CG2 3.32Å; I258-V262 PolarHBondContact O-N 2.92Å; I258-C270 HydrophobicContact CG2-CB 4.37Å
259S82Confident73.9Confident20 Ų2064.2 Ų64.214%0.1428%0.284CS..Hα-helixtrans-63.7-36175.4179.70000113.1W255 E257 R263 R265 S266 W267W255-S259 VanDerWaalsContact O-CB 3.26Å; W255-S259 WeakPolarHBondContact O-CB 3.38Å; W255-S259 PolarHBondContact O-N 2.93Å; E257-S259 PolarHBondContact O-N 3.42Å; S259-R263 PolarHBondContact O-N 2.91Å; S259-R265 PolarHBondContact OG-O 3.06Å; S259-S266 VanDerWaalsContact OG-C 3.25Å; S259-S266 WeakPolarHBondContact OG-CA 3.3Å; S259-W267 PolarHBondContact OG-N 3.35Å
260Q81.8Confident74.8Confident143 Ų14363.8 Ų63.867%0.66828%0.282SS*.Hα-helixtrans-69.4-36.2176.5-69.1169.6-10.900111.5R256 E257 I258 R263R256-Q260 WeakPolarHBondContact O-CG 3.13Å; R256-Q260 PolarHBondContact O-N 3.33Å; E257-Q260 WeakPolarHBondContact O-CA 3.35Å; E257-Q260 WeakPolarHBondContact O-CB 3.44Å; E257-Q260 PolarHBondContact O-N 2.86Å; I258-Q260 VanDerWaalsContact C-N 3.32Å; I258-Q260 PolarHBondContact O-N 3.44Å; Q260-R263 WeakPolarHBondContact O-CG 3.37Å; Q260-R263 PolarHBondContact O-N 2.72Å
261E78.9Confident75.8Confident67 Ų6768.2 Ų68.231%0.31330%0.296SS..Hα-helixtrans-70.8-40.4175.8-69.5173.8-16400112.2A228 R232 E257 I258 R263A228-E261 HydrophobicContact CB-CB 4.18Å; A228-E261 WeakPolarHBondContact CB-OE2 3.45Å; R232-E261 IonicContact CZ-OE1 3.47Å; R232-E261 IonicContact NH1-OE1 3.56Å; R232-E261 IonicContact NH2-OE1 2.69Å; R232-E261 PolarHBondContact NH2-OE1 3.45Å; E257-E261 PolarHBondContact O-N 3.31Å; I258-E261 PolarHBondContact O-N 2.99Å; E261-R263 PolarHBondContact O-N 2.95Å
262V78.3Confident76.5Confident0 Ų065.2 Ų65.20%029%0.293CS..Hα-helixtrans-68-27.2174.5174.80000111.5R224 L225 I258 T264 R265R224-V262 PolarHBondContact NH1-O 3.11Å; R224-V262 VanDerWaalsContact NH1-O 3.15Å; L225-V262 HydrophobicContact CB-CG2 4.07Å; L225-V262 HydrophobicContact CD1-CG2 4.14Å; I258-V262 HydrophobicContact CG2-CG2 4.41Å; I258-V262 VanDerWaalsContact O-CG2 3.28Å; I258-V262 WeakPolarHBondContact O-CG2 3.32Å; I258-V262 PolarHBondContact O-N 2.92Å; V262-T264 WeakPolarHBondContact CG1-OG1 3.23Å; V262-T264 PolarHBondContact O-N 2.87Å; V262-T264 PolarHBondContact O-OG1 3.14Å; V262-R265 HydrophobicContact CG1-CB 3.99Å; V262-R265 HydrophobicContact CG1-CG 4.23Å
263R75.2Confident77.3Confident195 Ų19556.5 Ų56.574%0.73626%0.261SS*.  trans61.6-32.9177.8-62.1178-177172.71.8116.2S259 Q260 E261S259-R263 PolarHBondContact O-N 2.91Å; Q260-R263 WeakPolarHBondContact O-CG 3.37Å; Q260-R263 PolarHBondContact O-N 2.72Å; E261-R263 PolarHBondContact O-N 2.95Å
264T71.8Confident77.5Confident29 Ų2956.2 Ų56.218%0.17826%0.259CS..SBendtrans-98-12.3-169.649.80000113.3V212 G213 E221 V262V212-T264 CarbonylContact C-O 3.55Å; V212-T264 WeakPolarHBondContact CA-O 3.37Å; G213-T264 PolarHBondContact N-O 3.14Å; E221-T264 WeakPolarHBondContact OE1-CB 3.43Å; E221-T264 PolarHBondContact OE1-OG1 2.9Å; V262-T264 WeakPolarHBondContact CG1-OG1 3.23Å; V262-T264 PolarHBondContact O-N 2.87Å; V262-T264 PolarHBondContact O-OG1 3.14Å
265R71.7Confident77.3Confident8 Ų856.1 Ų56.13%0.0326%0.255CS..SBendtrans-134.2143.5-174.2-63.3-64.3-179.6147.514.5111.2G213 G215 V216 W217 E221 S259 V262 Q269G213-R265 PolarHBondContact O-NH1 2.82Å; G215-R265 PolarHBondContact O-NH1 3.16Å; G215-R265 PolarHBondContact O-NH2 3.23Å; V216-R265 PolarHBondContact O-NH2 2.93Å; W217-R265 HydrophobicContact CH2-CB 3.9Å; W217-R265 HydrophobicContact CH2-CG 3.66Å; W217-R265 HydrophobicContact CZ2-CB 4.14Å; W217-R265 HydrophobicContact CZ2-CG 3.8Å; W217-R265 HydrophobicContact CZ3-CG 4.04Å; E221-R265 IonicContact OE1-CZ 3.97Å; E221-R265 IonicContact OE1-NE 2.72Å; E221-R265 PolarHBondContact OE1-NE 2.8Å; E221-R265 IonicContact OE1-NH2 3.16Å; E221-R265 PolarHBondContact OE1-NH2 3.06Å; E221-R265 IonicContact OE2-CZ 2.79Å; E221-R265 IonicContact OE2-NE 3.34Å; E221-R265 PolarHBondContact OE2-NE 2.84Å; E221-R265 IonicContact OE2-NH2 2.64Å; E221-R265 PolarHBondContact OE2-NH2 3.38Å; S259-R265 PolarHBondContact OG-O 3.06Å; V262-R265 HydrophobicContact CG1-CB 3.99Å; V262-R265 HydrophobicContact CG1-CG 4.23Å; R265-Q269 HydrophobicContact CB-CB 4.19Å
266S76.7Confident76.8Confident3 Ų359.8 Ų59.82%0.02127%0.272CS..  trans-70.1156.4174.867.20000111.7S259 V268 Q269 C270S259-S266 VanDerWaalsContact OG-C 3.25Å; S259-S266 WeakPolarHBondContact OG-CA 3.3Å; S266-V268 PolarHBondContact O-N 3.28Å; S266-V268 VanDerWaalsContact O-N 3.1Å; S266-Q269 WeakPolarHBondContact O-CA 3.43Å; S266-Q269 WeakPolarHBondContact O-CB 3.3Å; S266-Q269 PolarHBondContact O-N 3.49Å; S266-Q269 WeakPolarHBondContact OG-CG 3.45Å; S266-Q269 PolarHBondContact OG-N 2.79Å; S266-Q269 PolarHBondContact OG-OE1 3.02Å; S266-C270 PolarHBondContact O-N 2.84Å; S266-C270 PolarHBondContact O-SG 3.22Å
267W75.2Confident76.4Confident89 Ų8952.8 Ų52.834%0.33725%0.247SC..Hα-helixtrans-55-32.2178.771.3-89.3000113.7W255 R256 S259 R271W255-W267 HydrophobicContact CB-CB 3.99Å; W255-W267 HydrophobicContact CB-CE3 4.1Å; W255-W267 WeakPolarHBondContact O-CB 3.49Å; R256-W267 HydrophobicContact CG-CB 4.5Å; R256-W267 HydrophobicContact CG-CG 4.41Å; S259-W267 PolarHBondContact OG-N 3.35Å; W267-R271 VanDerWaalsContact O-CB 3.23Å; W267-R271 WeakPolarHBondContact O-CB 3.45Å; W267-R271 PolarHBondContact O-N 2.99Å
268V72.6Confident75.9Confident60 Ų6049.3 Ų49.336%0.36423%0.231SC..Hα-helixtrans-69.9-42175.6-176.60000111S266 G272S266-V268 PolarHBondContact O-N 3.28Å; S266-V268 VanDerWaalsContact O-N 3.1Å; V268-G272 PolarHBondContact O-N 3.39Å
269Q71.4Confident74.9Confident46 Ų4650.3 Ų50.322%0.21524%0.237CC..Hα-helixtrans-66.7-46.4177.1-71.5165.7-58.300110.8G213 W217 R265 S266 R271 G272 K273G213-Q269 PolarHBondContact O-NE2 2.66Å; W217-Q269 HydrophobicContact CZ2-CB 4.22Å; R265-Q269 HydrophobicContact CB-CB 4.19Å; S266-Q269 WeakPolarHBondContact O-CA 3.43Å; S266-Q269 WeakPolarHBondContact O-CB 3.3Å; S266-Q269 PolarHBondContact O-N 3.49Å; S266-Q269 WeakPolarHBondContact OG-CG 3.45Å; S266-Q269 PolarHBondContact OG-N 2.79Å; S266-Q269 PolarHBondContact OG-OE1 3.02Å; Q269-R271 PolarHBondContact O-N 2.91Å; Q269-G272 PolarHBondContact O-N 3.45Å; Q269-K273 WeakPolarHBondContact O-CB 3.24Å; Q269-K273 PolarHBondContact O-N 3.34Å
270C79.1Confident73.8Confident0 Ų053.9 Ų53.90%025%0.251CS..Hα-helixtrans-57.9-47.7175.6-64.40000111.5L225 W255 I258 S266 G272 K273 W274L225-C270 HydrophobicContact CD1-CB 3.71Å; W255-C270 HydrophobicContact CE3-CB 4.25Å; I258-C270 HydrophobicContact CG2-CB 4.37Å; S266-C270 PolarHBondContact O-N 2.84Å; S266-C270 PolarHBondContact O-SG 3.22Å; C270-G272 PolarHBondContact O-N 2.92Å; C270-K273 PolarHBondContact O-N 3.42Å; C270-W274 WeakPolarHBondContact O-CB 3.06Å; C270-W274 PolarHBondContact O-N 2.81Å
271R80.1Confident72.7Confident113 Ų11350.2 Ų50.243%0.42623%0.231SC..Hα-helixtrans-57.8-51.5175.5-176.7174.7-177.1-85.2-2.6111.3W255 W267 Q269 K273 W274 F275W255-R271 HydrophobicContact CD2-CB 3.58Å; W255-R271 HydrophobicContact CD2-CG 3.93Å; W255-R271 HydrophobicContact CE3-CB 3.84Å; W255-R271 HydrophobicContact CG-CB 3.98Å; W255-R271 HydrophobicContact CG-CG 4.29Å; W255-R271 HydrophobicContact CZ2-CB 4.25Å; W255-R271 HydrophobicContact CZ2-CG 3.95Å; W255-R271 HydrophobicContact CZ3-CB 4.31Å; W267-R271 VanDerWaalsContact O-CB 3.23Å; W267-R271 WeakPolarHBondContact O-CB 3.45Å; W267-R271 PolarHBondContact O-N 2.99Å; Q269-R271 PolarHBondContact O-N 2.91Å; R271-K273 VanDerWaalsContact C-N 3.35Å; R271-K273 PolarHBondContact O-N 3.2Å; R271-W274 PolarHBondContact O-N 3.08Å; R271-F275 HydrophobicContact CG-CD2 3.73Å; R271-F275 HydrophobicContact CG-CE2 3.67Å; R271-F275 WeakPolarHBondContact O-CD2 3.26Å; R271-F275 PolarHBondContact O-N 3.46Å
272G75.4Confident71.5Confident41 Ų4148.1 Ų48.142%0.42322%0.222SC..Hα-helixtrans-60.2-43.1-179.200000112.8V268 Q269 C270 F276V268-G272 PolarHBondContact O-N 3.39Å; Q269-G272 PolarHBondContact O-N 3.45Å; C270-G272 PolarHBondContact O-N 2.92Å; G272-F276 WeakPolarHBondContact O-CB 3.24Å; G272-F276 PolarHBondContact O-N 3.4Å
273K79.3Confident70.1Confident34 Ų3450 Ų5015%0.14823%0.233CC..Hα-helixtrans-68.4-42.6178.9-175.365.4172.6-179.90112.2W217 E222 L225 Q269 C270 R271 F275 F276 L277W217-K273 HydrophobicContact CD2-CB 4.2Å; W217-K273 HydrophobicContact CD2-CD 3.88Å; W217-K273 HydrophobicContact CD2-CG 3.64Å; W217-K273 HydrophobicContact CE3-CG 3.9Å; W217-K273 HydrophobicContact CG-CD 3.9Å; W217-K273 HydrophobicContact CG-CG 4.21Å; W217-K273 HydrophobicContact CH2-CB 3.81Å; W217-K273 HydrophobicContact CH2-CG 3.99Å; W217-K273 HydrophobicContact CZ2-CB 3.32Å; W217-K273 HydrophobicContact CZ2-CG 3.72Å; W217-K273 HydrophobicContact CZ3-CB 4.4Å; W217-K273 HydrophobicContact CZ3-CG 4.08Å; E222-K273 VanDerWaalsContact CD-CE 3.43Å; E222-K273 WeakPolarHBondContact OE1-CE 3.47Å; E222-K273 IonicContact OE1-NZ 3.83Å; E222-K273 PolarHBondContact OE1-NZ 2.67Å; L225-K273 HydrophobicContact CD2-CB 3.8Å; L225-K273 HydrophobicContact CD2-CG 3.74Å; Q269-K273 WeakPolarHBondContact O-CB 3.24Å; Q269-K273 PolarHBondContact O-N 3.34Å; C270-K273 PolarHBondContact O-N 3.42Å; R271-K273 VanDerWaalsContact C-N 3.35Å; R271-K273 PolarHBondContact O-N 3.2Å; K273-F275 PolarHBondContact O-N 2.9Å; K273-F276 WeakPolarHBondContact O-CB 3.03Å; K273-F276 PolarHBondContact O-N 2.97Å; K273-L277 HydrophobicContact CG-CD1 4.21Å; K273-L277 HydrophobicContact CG-CG 4.45Å; K273-L277 WeakPolarHBondContact O-CG 3.31Å; K273-L277 PolarHBondContact O-N 2.93Å
274W79.6Confident68.6Low5 Ų547.9 Ų47.92%0.01923%0.23CC..Hα-helixtrans-59.7-46.9175.1176.8-108.5000111.8L225 V229 L233 L249 W255 C270 R271 F276 L277 L278 F399L225-W274 HydrophobicContact CD2-CB 4.39Å; V229-W274 HydrophobicContact CB-CD2 4.3Å; V229-W274 HydrophobicContact CB-CE3 4.09Å; V229-W274 HydrophobicContact CB-CH2 4.2Å; V229-W274 HydrophobicContact CB-CZ2 4.39Å; V229-W274 HydrophobicContact CB-CZ3 4.04Å; V229-W274 HydrophobicContact CG1-CD2 3.82Å; V229-W274 VanDerWaalsContact CG1-CE2 3.48Å; V229-W274 HydrophobicContact CG1-CE3 3.99Å; V229-W274 HydrophobicContact CG1-CH2 3.57Å; V229-W274 HydrophobicContact CG1-CZ2 3.36Å; V229-W274 HydrophobicContact CG1-CZ3 3.87Å; V229-W274 HydrophobicContact CG2-CD2 4.09Å; V229-W274 HydrophobicContact CG2-CE3 4.07Å; V229-W274 HydrophobicContact CG2-CG 4.45Å; L233-W274 HydrophobicContact CD1-CH2 4.37Å; L233-W274 HydrophobicContact CD1-CZ2 3.95Å; L249-W274 PolarHBondContact O-NE1 2.87Å; W255-W274 HydrophobicContact CH2-CB 3.56Å; W255-W274 AromaticContact CH2-CD1 3.39Å; W255-W274 AromaticContact CH2-CG 3.59Å; W255-W274 HydrophobicContact CH2-CG 3.59Å; W255-W274 AromaticContact CZ2-CD1 3.96Å; W255-W274 HydrophobicContact CZ3-CB 3.94Å; W255-W274 HydrophobicContact CZ3-CG 4.32Å; C270-W274 WeakPolarHBondContact O-CB 3.06Å; C270-W274 PolarHBondContact O-N 2.81Å; R271-W274 PolarHBondContact O-N 3.08Å; W274-F276 VanDerWaalsContact C-N 3.28Å; W274-F276 PolarHBondContact O-N 3.45Å; W274-L277 PolarHBondContact O-N 3.48Å; W274-L278 HydrophobicContact CD2-CD1 4.37Å; W274-L278 HydrophobicContact CD2-CG 4.17Å; W274-L278 HydrophobicContact CG-CD1 4.37Å; W274-L278 HydrophobicContact CG-CG 4.48Å; W274-L278 HydrophobicContact CH2-CD2 4.26Å; W274-L278 HydrophobicContact CZ2-CD1 4.09Å; W274-L278 HydrophobicContact CZ2-CD2 3.69Å; W274-L278 HydrophobicContact CZ2-CG 3.89Å; W274-L278 WeakPolarHBondContact O-CB 3.5Å; W274-L278 WeakPolarHBondContact O-CG 3.32Å; W274-L278 PolarHBondContact O-N 3.41Å; W274-F399 HydrophobicContact CH2-CZ 4.4Å
275F74.3Confident67.1Low35 Ų3552.9 Ų52.915%0.15425%0.246CC..Hα-helixtrans-63.9-33.1176.1-82.2-69.1000112.7W255 R271 K273 L278 D279W255-F275 HydrophobicContact CZ2-CE2 4.17Å; R271-F275 HydrophobicContact CG-CD2 3.73Å; R271-F275 HydrophobicContact CG-CE2 3.67Å; R271-F275 WeakPolarHBondContact O-CD2 3.26Å; R271-F275 PolarHBondContact O-N 3.46Å; K273-F275 PolarHBondContact O-N 2.9Å; F275-L278 HydrophobicContact CD1-CD1 4.45Å; F275-D279 WeakPolarHBondContact O-CB 3.27Å; F275-D279 PolarHBondContact O-N 3.32Å
276F71.4Confident65.6Low102 Ų10252.8 Ų52.845%0.44725%0.247SC..Hα-helixtrans-67-44.5172.2176.4-92.4000112.1G272 K273 W274 D279 H280G272-F276 WeakPolarHBondContact O-CB 3.24Å; G272-F276 PolarHBondContact O-N 3.4Å; K273-F276 WeakPolarHBondContact O-CB 3.03Å; K273-F276 PolarHBondContact O-N 2.97Å; W274-F276 VanDerWaalsContact C-N 3.28Å; W274-F276 PolarHBondContact O-N 3.45Å; F276-D279 PolarHBondContact O-N 2.63Å; F276-H280 VanDerWaalsContact O-CB 3.31Å; F276-H280 WeakPolarHBondContact O-CB 3.44Å; F276-H280 PolarHBondContact O-N 3.23Å
277L70.1Confident64.1Low25 Ų2557.1 Ų57.113%0.13127%0.27CS..Hα-helixtrans-63.9-43.5177.1-71.7172.4000111.4L225 K226 K273 W274 H280 R281L225-L277 HydrophobicContact CD2-CD1 4.47Å; K226-L277 HydrophobicContact CG-CD1 4.47Å; K273-L277 HydrophobicContact CG-CD1 4.21Å; K273-L277 HydrophobicContact CG-CG 4.45Å; K273-L277 WeakPolarHBondContact O-CG 3.31Å; K273-L277 PolarHBondContact O-N 2.93Å; W274-L277 PolarHBondContact O-N 3.48Å; L277-H280 PolarHBondContact O-N 3Å; L277-R281 WeakPolarHBondContact O-CB 3.46Å; L277-R281 VanDerWaalsContact O-CG 3.29Å; L277-R281 WeakPolarHBondContact O-CG 3.29Å; L277-R281 PolarHBondContact O-N 3.14Å
278L67.9Low62.7Low21 Ų2154.8 Ų54.811%0.1127%0.265CS..Hα-helixtrans-59.6-51.3172.3-78.4-179.6000111.1W274 F275 H280 R281 M282W274-L278 HydrophobicContact CD2-CD1 4.37Å; W274-L278 HydrophobicContact CD2-CG 4.17Å; W274-L278 HydrophobicContact CG-CD1 4.37Å; W274-L278 HydrophobicContact CG-CG 4.48Å; W274-L278 HydrophobicContact CH2-CD2 4.26Å; W274-L278 HydrophobicContact CZ2-CD1 4.09Å; W274-L278 HydrophobicContact CZ2-CD2 3.69Å; W274-L278 HydrophobicContact CZ2-CG 3.89Å; W274-L278 WeakPolarHBondContact O-CB 3.5Å; W274-L278 WeakPolarHBondContact O-CG 3.32Å; W274-L278 PolarHBondContact O-N 3.41Å; F275-L278 HydrophobicContact CD1-CD1 4.45Å; L278-H280 VanDerWaalsContact C-N 3.31Å; L278-H280 PolarHBondContact O-N 2.92Å; L278-R281 PolarHBondContact O-N 3.44Å; L278-M282 WeakPolarHBondContact O-CB 3.32Å; L278-M282 WeakPolarHBondContact O-CG 3.47Å; L278-M282 PolarHBondContact O-N 3.43Å
279D60.8Low61.6Low21 Ų2154.4 Ų54.411%0.11226%0.259CS..Hα-helixtrans-58-44.3178.8-174.263.2000111.1F275 F276 M282 T283 R336F275-D279 WeakPolarHBondContact O-CB 3.27Å; F275-D279 PolarHBondContact O-N 3.32Å; F276-D279 PolarHBondContact O-N 2.63Å; D279-M282 PolarHBondContact O-N 3.46Å; D279-T283 WeakPolarHBondContact O-CB 3.34Å; D279-T283 WeakPolarHBondContact O-CG2 3.28Å; D279-T283 PolarHBondContact O-N 3.34Å; D279-T283 PolarHBondContact O-OG1 3.1Å; D279-R336 IonicContact OD1-NH2 3.87Å; D279-R336 IonicContact OD2-CZ 3.67Å; D279-R336 IonicContact OD2-NH1 3.08Å; D279-R336 PolarHBondContact OD2-NH1 2.74Å; D279-R336 IonicContact OD2-NH2 2.71Å; D279-R336 PolarHBondContact OD2-NH2 3.48Å
280H59.1Low60.4Low95 Ų9556.3 Ų56.344%0.4427%0.271SS..Hα-helixtrans-64.5-46.5177.9-167.2-81.4000112.3F276 L277 L278 T283 F284F276-H280 VanDerWaalsContact O-CB 3.31Å; F276-H280 WeakPolarHBondContact O-CB 3.44Å; F276-H280 PolarHBondContact O-N 3.23Å; L277-H280 PolarHBondContact O-N 3Å; L278-H280 VanDerWaalsContact C-N 3.31Å; L278-H280 PolarHBondContact O-N 2.92Å; H280-T283 VanDerWaalsContact C-OG1 3.27Å; H280-T283 VanDerWaalsContact CA-OG1 3.22Å; H280-T283 WeakPolarHBondContact CA-OG1 3.45Å; H280-T283 PolarHBondContact O-N 2.85Å; H280-T283 PolarHBondContact O-OG1 2.95Å; H280-F284 VanDerWaalsContact O-CB 3.28Å; H280-F284 WeakPolarHBondContact O-CB 3.36Å; H280-F284 PolarHBondContact O-N 3.11Å
281R58.8Low58.9Low65 Ų6566.8 Ų66.825%0.24531%0.31CS..Hα-helixtrans-68-36.5177.4-71.4-73-167.4174.60.8111.6L277 L278 F284 Y285 S401L277-R281 WeakPolarHBondContact O-CB 3.46Å; L277-R281 VanDerWaalsContact O-CG 3.29Å; L277-R281 WeakPolarHBondContact O-CG 3.29Å; L277-R281 PolarHBondContact O-N 3.14Å; L278-R281 PolarHBondContact O-N 3.44Å; R281-F284 PolarHBondContact O-N 3.4Å; R281-Y285 PolarHBondContact O-N 2.85Å; R281-S401 PolarHBondContact NH1-OG 3.27Å; R281-S401 VanDerWaalsContact NH1-OG 3.07Å; R281-S401 PolarHBondContact NH2-OG 2.86Å
282M52.8Low57.7Low24 Ų2462.3 Ų62.312%0.11830%0.3CS..Hα-helixtrans-71.4-27.5174.5-70-17084.700113R246 L278 D279 G286 Y393R246-M282 HydrophobicContact CG-CE 4.01Å; R246-M282 HydrophobicContact CG-SD 4.46Å; L278-M282 WeakPolarHBondContact O-CB 3.32Å; L278-M282 WeakPolarHBondContact O-CG 3.47Å; L278-M282 PolarHBondContact O-N 3.43Å; D279-M282 PolarHBondContact O-N 3.46Å; M282-G286 CarbonylContact O-C 3.56Å; M282-G286 VanDerWaalsContact O-C 3.3Å; M282-G286 WeakPolarHBondContact O-CA 3.49Å; M282-G286 PolarHBondContact O-N 2.87Å; M282-G286 VanDerWaalsContact O-N 3.1Å; M282-Y393 HydrophobicContact CE-CE2 4.32Å
283T49.8Very low56.8Low39 Ų3961.6 Ų61.624%0.23929%0.29CS..Hα-helixtrans-78.1-26.4169.240.70000113.3D279 H280 F289D279-T283 WeakPolarHBondContact O-CB 3.34Å; D279-T283 WeakPolarHBondContact O-CG2 3.28Å; D279-T283 PolarHBondContact O-N 3.34Å; D279-T283 PolarHBondContact O-OG1 3.1Å; H280-T283 VanDerWaalsContact C-OG1 3.27Å; H280-T283 VanDerWaalsContact CA-OG1 3.22Å; H280-T283 WeakPolarHBondContact CA-OG1 3.45Å; H280-T283 PolarHBondContact O-N 2.85Å; H280-T283 PolarHBondContact O-OG1 2.95Å; T283-F289 HydrophobicContact CG2-CB 3.5Å; T283-F289 HydrophobicContact CG2-CD2 3.92Å; T283-F289 HydrophobicContact CG2-CG 4.11Å
284F42Very low56Low151 Ų15165.1 Ų65.166%0.66231%0.307SS*.Hα-helixtrans-92.9-36.6-174.1-151.3-90.1000112.7H280 R281H280-F284 VanDerWaalsContact O-CB 3.28Å; H280-F284 WeakPolarHBondContact O-CB 3.36Å; H280-F284 PolarHBondContact O-N 3.11Å; R281-F284 PolarHBondContact O-N 3.4Å
285Y40.3Very low55.3Low134 Ų13465.1 Ų65.153%0.52531%0.308SS..THydrogen-bonded Turntrans-110.4-14.6177.6-68.5-88.4000113.6R281R281-Y285 PolarHBondContact O-N 2.85Å
286G40.6Very low55.1Low5 Ų564.9 Ų64.95%0.05231%0.307CS..SBendtrans-102.7129.817200000110.8M282 V288M282-G286 CarbonylContact O-C 3.56Å; M282-G286 VanDerWaalsContact O-C 3.3Å; M282-G286 WeakPolarHBondContact O-CA 3.49Å; M282-G286 PolarHBondContact O-N 2.87Å; M282-G286 VanDerWaalsContact O-N 3.1Å; G286-V288 PolarHBondContact O-N 3.35Å
287N45.8Very low55.2Low95 Ų9563.7 Ų63.751%0.50831%0.305SS..G310 helixtrans-60.9-5.8178.2-99.6-18.8000115.2F289N287-F289 VanDerWaalsContact C-N 3.3Å; N287-F289 PolarHBondContact O-N 3Å; N287-F289 VanDerWaalsContact O-N 3.1Å
288V45.5Very low55.5Low39 Ų3963.1 Ų63.124%0.23630%0.303CS..G310 helixtrans-72.7-12.5-161.8-171.90000114.7G286 V329G286-V288 PolarHBondContact O-N 3.35Å; V288-V329 HydrophobicContact CG1-CG1 4.4Å
289F49.3Very low56Low52 Ų5264.9 Ų64.923%0.22831%0.31CS..G310 helixtrans-139.420.6-176.5-62-61.8000115.7T283 N287 V329 M337T283-F289 HydrophobicContact CG2-CB 3.5Å; T283-F289 HydrophobicContact CG2-CD2 3.92Å; T283-F289 HydrophobicContact CG2-CG 4.11Å; N287-F289 VanDerWaalsContact C-N 3.3Å; N287-F289 PolarHBondContact O-N 3Å; N287-F289 VanDerWaalsContact O-N 3.1Å; F289-V329 HydrophobicContact CE1-CG1 4.36Å; F289-V329 HydrophobicContact CZ-CG1 3.74Å; F289-M337 HydrophobicContact CD1-CE 4.26Å; F289-M337 HydrophobicContact CE1-CE 3.75Å
290N45.6Very low57Low87 Ų8764.7 Ų64.747%0.46531%0.309SS..SBendtrans-70.5159.7169.4-82.5-40.8000111.6G292N290-G292 PolarHBondContact O-N 3.4Å
291R48.9Very low58.1Low219 Ų21962.3 Ų62.383%0.82630%0.303SS*.SBendtrans-63.123.6171.7-61.9175.5177.4177-0.3112.9F378R291-F378 WeakPolarHBondContact O-CE2 3.39Å; R291-F378 WeakPolarHBondContact O-CZ 3.25Å
292G53.7Low59.3Low20 Ų2059.2 Ų59.221%0.20629%0.292CS..SBendtrans-100.3-173.918000000113.2N290 E294 G295 Y296N290-G292 PolarHBondContact O-N 3.4Å; G292-E294 PolarHBondContact O-N 3.32Å; G292-G295 PolarHBondContact O-N 3.1Å; G292-G295 VanDerWaalsContact O-N 3.16Å; G292-Y296 WeakPolarHBondContact O-CD2 3.31Å; G292-Y296 PolarHBondContact O-N 2.85Å
293A56.9Low60.7Low26 Ų2658.2 Ų58.222%0.21529%0.287CS..Hα-helixtrans-55.8-44.1-172.600000113.6G295 Y296 N297 L375A293-G295 VanDerWaalsContact C-N 3.33Å; A293-G295 PolarHBondContact O-N 2.73Å; A293-Y296 PolarHBondContact O-N 2.84Å; A293-Y296 VanDerWaalsContact O-N 3.08Å; A293-N297 PolarHBondContact O-N 3.17Å; A293-L375 HydrophobicContact CB-CD1 3.54Å; A293-L375 WeakPolarHBondContact O-CD1 3.45Å
294E63.3Low62.3Low107 Ų10757.6 Ų57.650%0.528%0.284SS..Hα-helixtrans-59.3-40.5178.1-65.6177.7-172.700112.7G292 Y296 N297 A298G292-E294 PolarHBondContact O-N 3.32Å; E294-Y296 VanDerWaalsContact C-N 3.3Å; E294-Y296 PolarHBondContact O-N 3.44Å; E294-N297 PolarHBondContact O-N 3Å; E294-A298 WeakPolarHBondContact O-CB 3.16Å; E294-A298 PolarHBondContact O-N 2.85Å
295G65.3Low64.2Low5 Ų551.7 Ų51.75%0.05226%0.26CS..Hα-helixtrans-72.3-20.1177.700000114G292 A293 K299G292-G295 PolarHBondContact O-N 3.1Å; G292-G295 VanDerWaalsContact O-N 3.16Å; A293-G295 VanDerWaalsContact C-N 3.33Å; A293-G295 PolarHBondContact O-N 2.73Å; G295-K299 VanDerWaalsContact O-CD 3.25Å; G295-K299 WeakPolarHBondContact O-CD 3.37Å; G295-K299 VanDerWaalsContact O-CE 3.29Å; G295-K299 WeakPolarHBondContact O-CE 3.3Å; G295-K299 VanDerWaalsContact O-CG 3.3Å; G295-K299 WeakPolarHBondContact O-CG 3.4Å; G295-K299 PolarHBondContact O-NZ 3.04Å
296Y68.8Low66.1Low31 Ų3145.4 Ų45.412%0.12224%0.236CC..Hα-helixtrans-81.5-43168.6-71.9-71.5000110.8G292 A293 E294 A298 K299 I300 L371 R374 F378G292-Y296 WeakPolarHBondContact O-CD2 3.31Å; G292-Y296 PolarHBondContact O-N 2.85Å; A293-Y296 PolarHBondContact O-N 2.84Å; A293-Y296 VanDerWaalsContact O-N 3.08Å; E294-Y296 VanDerWaalsContact C-N 3.3Å; E294-Y296 PolarHBondContact O-N 3.44Å; Y296-A298 PolarHBondContact O-N 3.36Å; Y296-K299 PolarHBondContact O-N 2.89Å; Y296-I300 WeakPolarHBondContact O-CD1 3.2Å; Y296-I300 VanDerWaalsContact O-CG1 3.28Å; Y296-I300 WeakPolarHBondContact O-CG1 3.12Å; Y296-I300 PolarHBondContact O-N 3.37Å; Y296-L371 HydrophobicContact CD1-CB 4.33Å; Y296-L371 HydrophobicContact CD1-CD2 3.66Å; Y296-L371 HydrophobicContact CE1-CD2 3.9Å; Y296-R374 HydrophobicContact CD1-CB 4.33Å; Y296-R374 HydrophobicContact CE1-CB 3.91Å; Y296-F378 HydrophobicContact CD2-CD2 4.47Å; Y296-F378 AromaticContact CE2-CD2 3.9Å; Y296-F378 HydrophobicContact CE2-CD2 3.9Å; Y296-F378 AromaticContact CE2-CE2 3.92Å; Y296-F378 HydrophobicContact CE2-CE2 3.92Å
297N73.9Confident67.9Low77 Ų7748.5 Ų48.541%0.41225%0.247SC..Hα-helixtrans-57.4-48.5174.3-81.3-25.4000111.9A293 E294 K299 I300 S301 L375A293-N297 PolarHBondContact O-N 3.17Å; E294-N297 PolarHBondContact O-N 3Å; N297-K299 VanDerWaalsContact C-N 3.27Å; N297-K299 PolarHBondContact O-N 3.49Å; N297-I300 PolarHBondContact O-N 3.44Å; N297-I300 VanDerWaalsContact O-N 3.09Å; N297-S301 WeakPolarHBondContact O-CB 3.22Å; N297-S301 PolarHBondContact O-N 2.86Å; N297-S301 PolarHBondContact O-OG 3.4Å; N297-L375 WeakPolarHBondContact OD1-CD2 3.14Å
298A76.3Confident69.4Low12 Ų1249.4 Ų49.410%0.09925%0.251CS..Hα-helixtrans-58.6-36.617800000113E294 Y296 L302 V326 M337E294-A298 WeakPolarHBondContact O-CB 3.16Å; E294-A298 PolarHBondContact O-N 2.85Å; Y296-A298 PolarHBondContact O-N 3.36Å; A298-L302 WeakPolarHBondContact O-CB 3.3Å; A298-L302 PolarHBondContact O-N 3.27Å; A298-V326 HydrophobicContact CB-CG1 3.87Å; A298-M337 HydrophobicContact CB-CE 4.42Å
299K79.4Confident70.8Confident58 Ų5849.8 Ų49.825%0.25225%0.251SS..Hα-helixtrans-72.4-38.6176.4-68.7167-167.3150.50112.1G295 Y296 N297 I303 M337 L341 L371G295-K299 VanDerWaalsContact O-CD 3.25Å; G295-K299 WeakPolarHBondContact O-CD 3.37Å; G295-K299 VanDerWaalsContact O-CE 3.29Å; G295-K299 WeakPolarHBondContact O-CE 3.3Å; G295-K299 VanDerWaalsContact O-CG 3.3Å; G295-K299 WeakPolarHBondContact O-CG 3.4Å; G295-K299 PolarHBondContact O-NZ 3.04Å; Y296-K299 PolarHBondContact O-N 2.89Å; N297-K299 VanDerWaalsContact C-N 3.27Å; N297-K299 PolarHBondContact O-N 3.49Å; K299-I303 WeakPolarHBondContact O-CD1 3.31Å; K299-I303 VanDerWaalsContact O-CG1 3.26Å; K299-I303 WeakPolarHBondContact O-CG1 3.15Å; K299-I303 PolarHBondContact O-N 2.92Å; K299-I303 VanDerWaalsContact O-N 3.08Å; K299-M337 HydrophobicContact CB-SD 4.49Å; K299-M337 HydrophobicContact CG-CG 4.33Å; K299-M337 HydrophobicContact CG-SD 3.71Å; K299-L341 HydrophobicContact CB-CD1 4.44Å; K299-L341 HydrophobicContact CD-CD2 4.36Å; K299-L341 HydrophobicContact CG-CD1 4.35Å; K299-L371 HydrophobicContact CB-CD1 3.84Å; K299-L371 HydrophobicContact CD-CD2 4.35Å
300I81.1Confident71.3Confident17 Ų1751.3 Ų51.39%0.08727%0.268CS..Hα-helixtrans-67-48.3177.6-67.9161.9000109.7Y296 N297 L302 I303 S304 V368 L371 Q372 L375Y296-I300 WeakPolarHBondContact O-CD1 3.2Å; Y296-I300 VanDerWaalsContact O-CG1 3.28Å; Y296-I300 WeakPolarHBondContact O-CG1 3.12Å; Y296-I300 PolarHBondContact O-N 3.37Å; N297-I300 PolarHBondContact O-N 3.44Å; N297-I300 VanDerWaalsContact O-N 3.09Å; I300-L302 VanDerWaalsContact C-N 3.33Å; I300-L302 PolarHBondContact O-N 3.41Å; I300-I303 PolarHBondContact O-N 3.5Å; I300-S304 WeakPolarHBondContact O-CB 3.19Å; I300-S304 PolarHBondContact O-N 2.99Å; I300-S304 PolarHBondContact O-OG 2.93Å; I300-V368 HydrophobicContact CG1-CG1 4.33Å; I300-V368 HydrophobicContact CG2-CG1 3.93Å; I300-L371 HydrophobicContact CD1-CB 4Å; I300-L371 HydrophobicContact CG1-CB 3.77Å; I300-L371 HydrophobicContact CG1-CD1 4.31Å; I300-Q372 HydrophobicContact CD1-CB 4.46Å; I300-Q372 HydrophobicContact CD1-CG 3.7Å; I300-Q372 HydrophobicContact CG1-CG 4.36Å; I300-L375 HydrophobicContact CD1-CD2 4.19Å
301S82.9Confident72.2Confident46 Ų4648 Ų4832%0.32225%0.251SS..Hα-helixtrans-60.7-42.3176.4-600000111.4N297 I303 S304 T305N297-S301 WeakPolarHBondContact O-CB 3.22Å; N297-S301 PolarHBondContact O-N 2.86Å; N297-S301 PolarHBondContact O-OG 3.4Å; S301-I303 PolarHBondContact O-N 3.47Å; S301-S304 PolarHBondContact O-N 3.43Å; S301-T305 VanDerWaalsContact O-CB 3.31Å; S301-T305 WeakPolarHBondContact O-CB 3.49Å; S301-T305 PolarHBondContact O-N 2.76Å; S301-T305 PolarHBondContact O-OG1 3.2Å
302L84.1Confident72.3Confident0 Ų043.2 Ų43.20%024%0.242CC..Hα-helixtrans-58.1-50.4175.4173.961.3000112A298 I300 L306 V322 V326 V334 M337 F338 L341A298-L302 WeakPolarHBondContact O-CB 3.3Å; A298-L302 PolarHBondContact O-N 3.27Å; I300-L302 VanDerWaalsContact C-N 3.33Å; I300-L302 PolarHBondContact O-N 3.41Å; L302-L306 HydrophobicContact CD1-CD1 3.82Å; L302-L306 HydrophobicContact CD1-CG 4.29Å; L302-L306 HydrophobicContact CG-CD1 4.16Å; L302-L306 WeakPolarHBondContact O-CB 3.23Å; L302-L306 WeakPolarHBondContact O-CD1 3.49Å; L302-L306 WeakPolarHBondContact O-CG 3.5Å; L302-L306 PolarHBondContact O-N 3.08Å; L302-L306 VanDerWaalsContact O-N 3.15Å; L302-V322 HydrophobicContact CD1-CG1 3.26Å; L302-V326 HydrophobicContact CB-CG2 3.77Å; L302-V326 HydrophobicContact CD1-CG2 4.27Å; L302-V334 HydrophobicContact CD1-CB 4.06Å; L302-V334 HydrophobicContact CD1-CG1 4.46Å; L302-M337 HydrophobicContact CD2-CB 3.82Å; L302-M337 HydrophobicContact CD2-CG 3.72Å; L302-M337 HydrophobicContact CD2-SD 3.6Å; L302-M337 VanDerWaalsContact CD2-SD 3.6Å; L302-F338 HydrophobicContact CD2-CB 4.21Å; L302-L341 HydrophobicContact CD2-CD1 4.16Å
303I81.9Confident72.6Confident2 Ų244 Ų441%0.0124%0.242CC..Hα-helixtrans-69.2-38.8-177.8-63.3163.8000110.9K299 I300 S301 L306 Y307 L341 L363 Y364 V367 V368 L371K299-I303 WeakPolarHBondContact O-CD1 3.31Å; K299-I303 VanDerWaalsContact O-CG1 3.26Å; K299-I303 WeakPolarHBondContact O-CG1 3.15Å; K299-I303 PolarHBondContact O-N 2.92Å; K299-I303 VanDerWaalsContact O-N 3.08Å; I300-I303 PolarHBondContact O-N 3.5Å; S301-I303 PolarHBondContact O-N 3.47Å; I303-L306 PolarHBondContact O-N 3.1Å; I303-Y307 WeakPolarHBondContact O-CB 3.37Å; I303-Y307 PolarHBondContact O-N 3.45Å; I303-L341 HydrophobicContact CD1-CD1 4.13Å; I303-L341 HydrophobicContact CG1-CD1 4.22Å; I303-L363 HydrophobicContact CD1-CB 4.25Å; I303-L363 HydrophobicContact CG1-CB 4.32Å; I303-L363 HydrophobicContact CG2-CB 3.85Å; I303-Y364 HydrophobicContact CG2-CD2 4.26Å; I303-V367 HydrophobicContact CD1-CG1 4.46Å; I303-V368 HydrophobicContact CB-CG2 3.73Å; I303-V368 HydrophobicContact CD1-CG2 3.89Å; I303-V368 HydrophobicContact CG1-CG2 4.43Å; I303-V368 HydrophobicContact CG2-CG2 3.53Å; I303-L371 HydrophobicContact CD1-CD1 4.1Å
304S82.3Confident72.8Confident26 Ų2645.7 Ų45.718%0.18225%0.246CC..Hα-helixtrans-68.9-45.2-179.1-50.50000111.5I300 S301 L306 Y307 D308I300-S304 WeakPolarHBondContact O-CB 3.19Å; I300-S304 PolarHBondContact O-N 2.99Å; I300-S304 PolarHBondContact O-OG 2.93Å; S301-S304 PolarHBondContact O-N 3.43Å; S304-L306 VanDerWaalsContact C-N 3.29Å; S304-L306 PolarHBondContact O-N 3.44Å; S304-Y307 WeakPolarHBondContact O-CB 3.36Å; S304-Y307 PolarHBondContact O-N 3.14Å; S304-Y307 VanDerWaalsContact O-N 3.09Å; S304-D308 VanDerWaalsContact O-CG 3.3Å; S304-D308 PolarHBondContact O-N 3.43Å
305T82.3Confident72.8Confident27 Ų2742.3 Ų42.317%0.16624%0.236CC..Hα-helixtrans-58.5-43.7174.8-490000110.6S301 Y307 D308 M309 V322 A325S301-T305 VanDerWaalsContact O-CB 3.31Å; S301-T305 WeakPolarHBondContact O-CB 3.49Å; S301-T305 PolarHBondContact O-N 2.76Å; S301-T305 PolarHBondContact O-OG1 3.2Å; T305-Y307 VanDerWaalsContact C-N 3.3Å; T305-Y307 PolarHBondContact O-N 3.21Å; T305-D308 PolarHBondContact O-N 3.02Å; T305-M309 HydrophobicContact CG2-SD 4.25Å; T305-M309 WeakPolarHBondContact O-CG 3.44Å; T305-M309 PolarHBondContact O-N 2.94Å; T305-V322 HydrophobicContact CG2-CG2 4.45Å; T305-A325 HydrophobicContact CG2-CB 3.75Å
306L80.4Confident72.8Confident2 Ų245.3 Ų45.31%0.0125%0.251CS..Hα-helixtrans-65.3-32.8178.1-73173.9000113.1L302 I303 S304 I317 W319 V322 F338 I360L302-L306 HydrophobicContact CD1-CD1 3.82Å; L302-L306 HydrophobicContact CD1-CG 4.29Å; L302-L306 HydrophobicContact CG-CD1 4.16Å; L302-L306 WeakPolarHBondContact O-CB 3.23Å; L302-L306 WeakPolarHBondContact O-CD1 3.49Å; L302-L306 WeakPolarHBondContact O-CG 3.5Å; L302-L306 PolarHBondContact O-N 3.08Å; L302-L306 VanDerWaalsContact O-N 3.15Å; I303-L306 PolarHBondContact O-N 3.1Å; S304-L306 VanDerWaalsContact C-N 3.29Å; S304-L306 PolarHBondContact O-N 3.44Å; L306-I317 HydrophobicContact CD2-CD1 4.07Å; L306-I317 HydrophobicContact CD2-CG1 4.39Å; L306-I317 HydrophobicContact CD2-CG2 3.56Å; L306-W319 HydrophobicContact CD2-CZ3 4.47Å; L306-V322 HydrophobicContact CD2-CG1 4.3Å; L306-V322 HydrophobicContact CD2-CG2 3.71Å; L306-V322 HydrophobicContact CG-CG1 4.39Å; L306-V322 HydrophobicContact CG-CG2 4.45Å; L306-F338 HydrophobicContact CD1-CD2 3.42Å; L306-F338 VanDerWaalsContact CD1-CD2 3.42Å; L306-F338 HydrophobicContact CD1-CE2 3.7Å; L306-F338 HydrophobicContact CD1-CG 4.14Å; L306-I360 HydrophobicContact CB-CD1 4.16Å; L306-I360 HydrophobicContact CB-CG1 4.35Å; L306-I360 HydrophobicContact CB-CG2 4.03Å
307Y78.1Confident72.9Confident71 Ų7144.2 Ų44.228%0.27825%0.247SC..Hα-helixtrans-70.8-47.2176-177.3-98.3000111.1I303 S304 T305 M309 S310 I360 D361 Y364 H365I303-Y307 WeakPolarHBondContact O-CB 3.37Å; I303-Y307 PolarHBondContact O-N 3.45Å; S304-Y307 WeakPolarHBondContact O-CB 3.36Å; S304-Y307 PolarHBondContact O-N 3.14Å; S304-Y307 VanDerWaalsContact O-N 3.09Å; T305-Y307 VanDerWaalsContact C-N 3.3Å; T305-Y307 PolarHBondContact O-N 3.21Å; Y307-M309 VanDerWaalsContact C-N 3.27Å; Y307-M309 PolarHBondContact O-N 3.36Å; Y307-S310 PolarHBondContact O-N 3.21Å; Y307-S310 PolarHBondContact O-OG 3.45Å; Y307-I360 HydrophobicContact CD2-CG2 4.36Å; Y307-D361 WeakPolarHBondContact CD2-OD1 3.43Å; Y307-D361 WeakPolarHBondContact CE2-OD1 3.47Å; Y307-Y364 HydrophobicContact CD1-CD1 4.29Å; Y307-Y364 HydrophobicContact CD1-CD2 4.12Å; Y307-Y364 HydrophobicContact CD1-CE1 4.27Å; Y307-Y364 HydrophobicContact CD1-CE2 4.09Å; Y307-Y364 HydrophobicContact CD1-CG 4.22Å; Y307-Y364 HydrophobicContact CD2-CD1 4.18Å; Y307-Y364 HydrophobicContact CD2-CD2 4.34Å; Y307-Y364 AromaticContact CD2-CG 3.87Å; Y307-Y364 HydrophobicContact CD2-CG 3.87Å; Y307-Y364 HydrophobicContact CE1-CD1 4.28Å; Y307-Y364 HydrophobicContact CE1-CE1 4.16Å; Y307-Y364 HydrophobicContact CE2-CD1 4.17Å; Y307-Y364 HydrophobicContact CE2-CG 4.31Å; Y307-Y364 HydrophobicContact CG-CD1 4.23Å; Y307-Y364 AromaticContact CG-CD2 3.82Å; Y307-Y364 HydrophobicContact CG-CD2 3.82Å; Y307-Y364 HydrophobicContact CG-CE2 4.25Å; Y307-Y364 AromaticContact CG-CG 3.81Å; Y307-Y364 HydrophobicContact CG-CG 3.81Å; Y307-H365 AromaticContact CE2-NE2 3.97Å
308D78.1Confident72.9Confident114 Ų11444.1 Ų44.161%0.6125%0.247SC*.Hα-helixtrans-64.3-32.3-179.8-63.9-23.8000112.2S304 T305 S310S304-D308 VanDerWaalsContact O-CG 3.3Å; S304-D308 PolarHBondContact O-N 3.43Å; T305-D308 PolarHBondContact O-N 3.02Å; D308-S310 PolarHBondContact O-N 3.44Å; D308-S310 PolarHBondContact O-OG 3.45Å
309M74.3Confident73Confident47 Ų4745.3 Ų45.323%0.23225%0.249CC..THydrogen-bonded Turntrans-65.6-14.8174.6-70.7174.983.600113.8T305 Y307 V311 N318 V322T305-M309 HydrophobicContact CG2-SD 4.25Å; T305-M309 WeakPolarHBondContact O-CG 3.44Å; T305-M309 PolarHBondContact O-N 2.94Å; Y307-M309 VanDerWaalsContact C-N 3.27Å; Y307-M309 PolarHBondContact O-N 3.36Å; M309-V311 VanDerWaalsContact C-N 3.28Å; M309-V311 HydrophobicContact CB-CG2 3.72Å; M309-V311 WeakPolarHBondContact O-CG2 3.33Å; M309-V311 PolarHBondContact O-N 3.35Å; M309-V311 VanDerWaalsContact O-N 3.13Å; M309-N318 HydrophobicContact CE-CB 3.96Å; M309-V322 HydrophobicContact CE-CG2 4.33Å; M309-V322 HydrophobicContact SD-CG2 3.51Å; M309-V322 VanDerWaalsContact SD-CG2 3.51Å
310S60.3Low72.8Confident83 Ų8349.6 Ų49.658%0.5827%0.27SS*.THydrogen-bonded Turntrans45.247.5173-61.60000114.1Y307 D308Y307-S310 PolarHBondContact O-N 3.21Å; Y307-S310 PolarHBondContact O-OG 3.45Å; D308-S310 PolarHBondContact O-N 3.44Å; D308-S310 PolarHBondContact O-OG 3.45Å
311V64.9Low72.4Confident19 Ų1953.8 Ų53.812%0.11529%0.289CS..  trans-90.9126.5-173.8-166.50000111M309 D313 D316 I317M309-V311 VanDerWaalsContact C-N 3.28Å; M309-V311 HydrophobicContact CB-CG2 3.72Å; M309-V311 WeakPolarHBondContact O-CG2 3.33Å; M309-V311 PolarHBondContact O-N 3.35Å; M309-V311 VanDerWaalsContact O-N 3.13Å; V311-D313 WeakPolarHBondContact CG1-O 3.16Å; V311-D316 HydrophobicContact CG1-CB 3.34Å; V311-I317 HydrophobicContact CB-CG1 4.29Å; V311-I317 HydrophobicContact CG1-CG1 4.31Å; V311-I317 HydrophobicContact CG2-CG1 4.37Å
312D51Low72.2Confident117 Ų11751.6 Ų51.663%0.62627%0.274SS*.SBendtrans-70.8-33.1179.9-66.4-39.9000113.5A356D312-A356 PolarHBondContact O-N 3.05Å
313D59.2Low71.7Confident38 Ų3851.9 Ų51.920%0.20328%0.276CS..SBendtrans-124.1141.5-179-163.9-47000112.6S86 V311 A315 D316S86-D313 VanDerWaalsContact CB-OD2 3.26Å; S86-D313 WeakPolarHBondContact CB-OD2 3.42Å; V311-D313 WeakPolarHBondContact CG1-O 3.16Å; D313-A315 PolarHBondContact O-N 3.34Å; D313-A315 VanDerWaalsContact O-N 3.14Å; D313-A315 WeakPolarHBondContact OD1-CB 3.14Å; D313-A315 PolarHBondContact OD1-N 3.17Å; D313-D316 PolarHBondContact O-N 2.79Å
314I61.9Low71.3Confident61 Ų6155 Ų5531%0.31330%0.302SS..G310 helixtrans-60.6-27.6177.9-58.1178.7000110.6D316 I317 W319 A356I314-D316 VanDerWaalsContact C-N 3.27Å; I314-D316 PolarHBondContact O-N 2.92Å; I314-I317 HydrophobicContact CB-CD1 4.4Å; I314-I317 HydrophobicContact CG2-CD1 4.19Å; I314-I317 PolarHBondContact O-N 2.98Å; I314-W319 HydrophobicContact CG2-CZ2 4.37Å; I314-A356 HydrophobicContact CB-CB 4.43Å; I314-A356 HydrophobicContact CG1-CB 3.58Å
315A62Low71Confident35 Ų3556.3 Ų56.329%0.28931%0.314SS..G310 helixtrans-67.8-24.6176.900000113.5D313D313-A315 PolarHBondContact O-N 3.34Å; D313-A315 VanDerWaalsContact O-N 3.14Å; D313-A315 WeakPolarHBondContact OD1-CB 3.14Å; D313-A315 PolarHBondContact OD1-N 3.17Å
316D64.9Low70.5Confident68 Ų6855.8 Ų55.836%0.36431%0.311SS..G310 helixtrans-92.1-0.6-177.3-68.7-24.8000111.8R81 V311 D313 I314 N318R81-D316 IonicContact CZ-OD2 3.11Å; R81-D316 IonicContact NE-OD1 2.66Å; R81-D316 IonicContact NH2-OD2 3.15Å; R81-D316 PolarHBondContact NH2-OD2 2.93Å; R81-D316 VanDerWaalsContact NH2-OD2 3.15Å; V311-D316 HydrophobicContact CG1-CB 3.34Å; D313-D316 PolarHBondContact O-N 2.79Å; I314-D316 VanDerWaalsContact C-N 3.27Å; I314-D316 PolarHBondContact O-N 2.92Å; D316-N318 PolarHBondContact O-N 3.43Å
317I72.3Confident69.7Low9 Ų957.8 Ų57.85%0.04633%0.332CS..  trans-72118.7176.2-60.5170.6000110.5L306 V311 I314 W319 V322 I360L306-I317 HydrophobicContact CD2-CD1 4.07Å; L306-I317 HydrophobicContact CD2-CG1 4.39Å; L306-I317 HydrophobicContact CD2-CG2 3.56Å; V311-I317 HydrophobicContact CB-CG1 4.29Å; V311-I317 HydrophobicContact CG1-CG1 4.31Å; V311-I317 HydrophobicContact CG2-CG1 4.37Å; I314-I317 HydrophobicContact CB-CD1 4.4Å; I314-I317 HydrophobicContact CG2-CD1 4.19Å; I314-I317 PolarHBondContact O-N 2.98Å; I317-W319 HydrophobicContact CB-CD2 4.5Å; I317-W319 HydrophobicContact CB-CZ2 4.06Å; I317-W319 HydrophobicContact CD1-CH2 4.12Å; I317-W319 HydrophobicContact CD1-CZ2 3.77Å; I317-W319 HydrophobicContact CG2-CD2 3.75Å; I317-W319 HydrophobicContact CG2-CE3 4.09Å; I317-W319 HydrophobicContact CG2-CG 4.22Å; I317-W319 HydrophobicContact CG2-CH2 4.16Å; I317-W319 HydrophobicContact CG2-CZ2 3.83Å; I317-W319 HydrophobicContact CG2-CZ3 4.28Å; I317-W319 PolarHBondContact O-N 2.78Å; I317-W319 VanDerWaalsContact O-N 3.11Å; I317-W319 PolarHBondContact O-NE1 3Å; I317-V322 HydrophobicContact CG2-CG2 4.04Å; I317-I360 HydrophobicContact CD1-CD1 4.41Å
318N73.9Confident68.7Low75 Ų7560.4 Ų60.440%0.40135%0.351SS..  trans-77.191.3169.6-174.50.3000111.4M309 D316 E320 E321 V322M309-N318 HydrophobicContact CE-CB 3.96Å; D316-N318 PolarHBondContact O-N 3.43Å; N318-E320 PolarHBondContact O-N 2.89Å; N318-E320 PolarHBondContact OD1-N 3.15Å; N318-E321 HydrophobicContact CB-CB 4.25Å; N318-E321 PolarHBondContact ND2-OE2 2.97Å; N318-E321 PolarHBondContact O-N 3.3Å; N318-V322 WeakPolarHBondContact O-CG2 3.48Å; N318-V322 PolarHBondContact O-N 2.77Å
319W78.6Confident68Low37 Ų3755.5 Ų55.514%0.1433%0.325CS..Hα-helixtrans-67.6-13.3-177.9-62.396.3000115L306 I314 I317 V322 A323 P331 V334 Q335 F338L306-W319 HydrophobicContact CD2-CZ3 4.47Å; I314-W319 HydrophobicContact CG2-CZ2 4.37Å; I317-W319 HydrophobicContact CB-CD2 4.5Å; I317-W319 HydrophobicContact CB-CZ2 4.06Å; I317-W319 HydrophobicContact CD1-CH2 4.12Å; I317-W319 HydrophobicContact CD1-CZ2 3.77Å; I317-W319 HydrophobicContact CG2-CD2 3.75Å; I317-W319 HydrophobicContact CG2-CE3 4.09Å; I317-W319 HydrophobicContact CG2-CG 4.22Å; I317-W319 HydrophobicContact CG2-CH2 4.16Å; I317-W319 HydrophobicContact CG2-CZ2 3.83Å; I317-W319 HydrophobicContact CG2-CZ3 4.28Å; I317-W319 PolarHBondContact O-N 2.78Å; I317-W319 VanDerWaalsContact O-N 3.11Å; I317-W319 PolarHBondContact O-NE1 3Å; W319-V322 HydrophobicContact CE3-CG1 4.43Å; W319-A323 WeakPolarHBondContact O-CB 3.48Å; W319-A323 PolarHBondContact O-N 3.12Å; W319-A323 VanDerWaalsContact O-N 3.14Å; W319-P331 HydrophobicContact CB-CB 4.06Å; W319-V334 HydrophobicContact CE3-CG2 4.1Å; W319-Q335 HydrophobicContact CB-CG 4.33Å; W319-Q335 HydrophobicContact CD2-CG 3.28Å; W319-Q335 HydrophobicContact CE3-CB 4.41Å; W319-Q335 HydrophobicContact CE3-CG 3.44Å; W319-Q335 VanDerWaalsContact CE3-CG 3.44Å; W319-Q335 HydrophobicContact CG-CG 3.71Å; W319-Q335 HydrophobicContact CH2-CG 4.25Å; W319-Q335 HydrophobicContact CZ2-CG 4.13Å; W319-Q335 HydrophobicContact CZ3-CG 3.93Å; W319-F338 HydrophobicContact CH2-CB 4.08Å; W319-F338 AromaticContact CH2-CD1 3.65Å; W319-F338 HydrophobicContact CH2-CD1 3.65Å; W319-F338 HydrophobicContact CH2-CE1 4.26Å; W319-F338 AromaticContact CH2-CG 3.92Å; W319-F338 HydrophobicContact CH2-CG 3.92Å; W319-F338 HydrophobicContact CZ2-CD1 4.47Å; W319-F338 HydrophobicContact CZ3-CB 4.14Å; W319-F338 HydrophobicContact CZ3-CG 4.39Å
320E73.6Confident67.6Low147 Ų14754.5 Ų54.569%0.68732%0.322SS*.Hα-helixtrans-76.1-41.8174-64.7-168.717100111.3N318 A323 A324 P331N318-E320 PolarHBondContact O-N 2.89Å; N318-E320 PolarHBondContact OD1-N 3.15Å; E320-A323 WeakPolarHBondContact O-CB 3.26Å; E320-A323 PolarHBondContact O-N 3.44Å; E320-A324 PolarHBondContact O-N 3.32Å; E320-P331 HydrophobicContact CG-CG 4.02Å
321E74.1Confident68Low106 Ų10652.7 Ų52.750%0.49531%0.308SS..Hα-helixtrans-66.8-43.3175.3-175.3174.8-179.400111.6N318 A323 A324 A325N318-E321 HydrophobicContact CB-CB 4.25Å; N318-E321 PolarHBondContact ND2-OE2 2.97Å; N318-E321 PolarHBondContact O-N 3.3Å; E321-A323 VanDerWaalsContact C-N 3.27Å; E321-A323 PolarHBondContact O-N 2.77Å; E321-A324 PolarHBondContact O-N 2.84Å; E321-A325 PolarHBondContact O-N 3.27Å
322V77.5Confident68.1Low0 Ų057.8 Ų57.80%033%0.325CS..Hα-helixtrans-61.4-37.4174.2177.60000111.6L302 T305 L306 M309 I317 N318 W319 V326 V334L302-V322 HydrophobicContact CD1-CG1 3.26Å; T305-V322 HydrophobicContact CG2-CG2 4.45Å; L306-V322 HydrophobicContact CD2-CG1 4.3Å; L306-V322 HydrophobicContact CD2-CG2 3.71Å; L306-V322 HydrophobicContact CG-CG1 4.39Å; L306-V322 HydrophobicContact CG-CG2 4.45Å; M309-V322 HydrophobicContact CE-CG2 4.33Å; M309-V322 HydrophobicContact SD-CG2 3.51Å; M309-V322 VanDerWaalsContact SD-CG2 3.51Å; I317-V322 HydrophobicContact CG2-CG2 4.04Å; N318-V322 WeakPolarHBondContact O-CG2 3.48Å; N318-V322 PolarHBondContact O-N 2.77Å; W319-V322 HydrophobicContact CE3-CG1 4.43Å; V322-V326 WeakPolarHBondContact O-CG2 3.33Å; V322-V326 PolarHBondContact O-N 3.38Å; V322-V334 HydrophobicContact CG1-CB 4.37Å; V322-V334 HydrophobicContact CG1-CG2 4.36Å
323A73.8Confident68.8Low5 Ų552.8 Ų52.84%0.04130%0.299CS..Hα-helixtrans-66.4-40.6176.300000112.7W319 E320 E321 V329 P331 V334W319-A323 WeakPolarHBondContact O-CB 3.48Å; W319-A323 PolarHBondContact O-N 3.12Å; W319-A323 VanDerWaalsContact O-N 3.14Å; E320-A323 WeakPolarHBondContact O-CB 3.26Å; E320-A323 PolarHBondContact O-N 3.44Å; E321-A323 VanDerWaalsContact C-N 3.27Å; E321-A323 PolarHBondContact O-N 2.77Å; A323-V329 WeakPolarHBondContact CB-O 3.46Å; A323-V329 WeakPolarHBondContact O-CG2 3.08Å; A323-P331 HydrophobicContact CB-CG 4.03Å; A323-V334 HydrophobicContact CB-CG2 4.08Å
324A74.3Confident69.6Low68 Ų6851 Ų5156%0.56229%0.29SS*.Hα-helixtrans-65.4-44.2176.400000111.8E320 E321 V326 G327E320-A324 PolarHBondContact O-N 3.32Å; E321-A324 PolarHBondContact O-N 2.84Å; A324-V326 VanDerWaalsContact C-N 3.28Å; A324-V326 PolarHBondContact O-N 3.41Å; A324-G327 PolarHBondContact O-N 2.92Å
325A74.8Confident70.1Confident53 Ų5351.1 Ų51.144%0.43829%0.289SS..Hα-helixtrans-65.6-26.2-179.700000114.1T305 E321T305-A325 HydrophobicContact CG2-CB 3.75Å; E321-A325 PolarHBondContact O-N 3.27Å
326V71.9Confident70.6Confident17 Ų1752.3 Ų52.310%0.10329%0.286CS..Hα-helixtrans-86.5-14-178.8175.40000112.8A298 L302 V322 A324 V329 V334A298-V326 HydrophobicContact CB-CG1 3.87Å; L302-V326 HydrophobicContact CB-CG2 3.77Å; L302-V326 HydrophobicContact CD1-CG2 4.27Å; V322-V326 WeakPolarHBondContact O-CG2 3.33Å; V322-V326 PolarHBondContact O-N 3.38Å; A324-V326 VanDerWaalsContact C-N 3.28Å; A324-V326 PolarHBondContact O-N 3.41Å; V326-V329 HydrophobicContact CB-CG2 3.82Å; V326-V329 HydrophobicContact CG1-CG2 3.77Å; V326-V334 HydrophobicContact CB-CG1 4.13Å; V326-V334 HydrophobicContact CG1-CG1 4.18Å; V326-V334 HydrophobicContact CG2-CG1 4.25Å
327G63.3Low71Confident44 Ų4450.2 Ų50.245%0.45428%0.275SS..Hα-helixtrans107.98117400000114.3A324 V329A324-G327 PolarHBondContact O-N 2.92Å; G327-V329 PolarHBondContact O-N 2.85Å
328D57.4Low71.3Confident126 Ų12649.9 Ų49.967%0.67427%0.273SS*.SBendtrans44.638.4174-83.6-3.7000115.2R246R246-D328 VanDerWaalsContact CD-O 3.24Å; R246-D328 WeakPolarHBondContact CD-O 3.28Å; R246-D328 PolarHBondContact NE-O 2.88Å; R246-D328 PolarHBondContact NH1-O 2.82Å
329V63.3Low71.3Confident10 Ų1049.9 Ų49.96%0.06127%0.273CS..  trans-96.5152.4173.9-73.70000110.3V288 F289 A323 V326 G327 V334V288-V329 HydrophobicContact CG1-CG1 4.4Å; F289-V329 HydrophobicContact CE1-CG1 4.36Å; F289-V329 HydrophobicContact CZ-CG1 3.74Å; A323-V329 WeakPolarHBondContact CB-O 3.46Å; A323-V329 WeakPolarHBondContact O-CG2 3.08Å; V326-V329 HydrophobicContact CB-CG2 3.82Å; V326-V329 HydrophobicContact CG1-CG2 3.77Å; G327-V329 PolarHBondContact O-N 2.85Å; V329-V334 HydrophobicContact CB-CG1 4.39Å; V329-V334 HydrophobicContact CG2-CG1 3.41Å; V329-V334 VanDerWaalsContact CG2-CG1 3.41Å
330T65.9Low71.1Confident26 Ų2654.1 Ų54.116%0.1629%0.289CS..  trans-72.9148.6178.572.70000111.3W332 S333 V334T330-W332 PolarHBondContact O-N 3.21Å; T330-S333 WeakPolarHBondContact O-CA 3.45Å; T330-S333 WeakPolarHBondContact O-CB 3.4Å; T330-S333 PolarHBondContact O-N 2.97Å; T330-S333 PolarHBondContact OG1-N 2.97Å; T330-S333 PolarHBondContact OG1-OG 2.89Å; T330-V334 PolarHBondContact O-N 3.45Å
331P69.3Low71.2Confident46 Ų4647.8 Ų47.830%0.29926%0.26SS..Hα-helixtrans-51.3-32.8174.2-30.836.3000113.6W319 E320 A323 V334 Q335W319-P331 HydrophobicContact CB-CB 4.06Å; E320-P331 HydrophobicContact CG-CG 4.02Å; A323-P331 HydrophobicContact CB-CG 4.03Å; P331-V334 WeakPolarHBondContact O-CG2 3.29Å; P331-Q335 WeakPolarHBondContact O-CB 3.46Å; P331-Q335 WeakPolarHBondContact O-CG 3.4Å; P331-Q335 PolarHBondContact O-N 2.6Å
332W67.8Low71.2Confident125 Ų12544.4 Ų44.447%0.47324%0.243SC..Hα-helixtrans-69.1-39176.6-172.482.7000112.7T330 Q335 R336T330-W332 PolarHBondContact O-N 3.21Å; W332-Q335 PolarHBondContact O-N 2.67Å; W332-R336 WeakPolarHBondContact O-CB 3.38Å; W332-R336 PolarHBondContact O-N 3.05Å
333S65.4Low70.7Confident12 Ų1250 Ų508%0.08427%0.269CS..Hα-helixtrans-63.5-44.7177.3-58.90000111.4T330 R336 M337T330-S333 WeakPolarHBondContact O-CA 3.45Å; T330-S333 WeakPolarHBondContact O-CB 3.4Å; T330-S333 PolarHBondContact O-N 2.97Å; T330-S333 PolarHBondContact OG1-N 2.97Å; T330-S333 PolarHBondContact OG1-OG 2.89Å; S333-R336 PolarHBondContact O-N 3.16Å; S333-M337 WeakPolarHBondContact O-CB 3.15Å; S333-M337 PolarHBondContact O-N 2.91Å
334V75.5Confident70.3Confident0 Ų059.8 Ų59.80%031%0.305CS..Hα-helixtrans-68.5-40176.9-67.50000112.3L302 W319 V322 A323 V326 V329 T330 P331 R336 M337 F338L302-V334 HydrophobicContact CD1-CB 4.06Å; L302-V334 HydrophobicContact CD1-CG1 4.46Å; W319-V334 HydrophobicContact CE3-CG2 4.1Å; V322-V334 HydrophobicContact CG1-CB 4.37Å; V322-V334 HydrophobicContact CG1-CG2 4.36Å; A323-V334 HydrophobicContact CB-CG2 4.08Å; V326-V334 HydrophobicContact CB-CG1 4.13Å; V326-V334 HydrophobicContact CG1-CG1 4.18Å; V326-V334 HydrophobicContact CG2-CG1 4.25Å; V329-V334 HydrophobicContact CB-CG1 4.39Å; V329-V334 HydrophobicContact CG2-CG1 3.41Å; V329-V334 VanDerWaalsContact CG2-CG1 3.41Å; T330-V334 PolarHBondContact O-N 3.45Å; P331-V334 WeakPolarHBondContact O-CG2 3.29Å; V334-R336 VanDerWaalsContact C-N 3.32Å; V334-R336 PolarHBondContact O-N 3Å; V334-M337 WeakPolarHBondContact O-CB 3.42Å; V334-M337 PolarHBondContact O-N 3Å; V334-F338 WeakPolarHBondContact O-CB 3.28Å; V334-F338 PolarHBondContact O-N 3.32Å
335Q73.5Confident69.8Low65 Ų6559.6 Ų59.630%0.30430%0.295SS..Hα-helixtrans-59.8-42.7172.7-77.9174.78.500111.9W319 P331 W332 M337 N339W319-Q335 HydrophobicContact CB-CG 4.33Å; W319-Q335 HydrophobicContact CD2-CG 3.28Å; W319-Q335 HydrophobicContact CE3-CB 4.41Å; W319-Q335 HydrophobicContact CE3-CG 3.44Å; W319-Q335 VanDerWaalsContact CE3-CG 3.44Å; W319-Q335 HydrophobicContact CG-CG 3.71Å; W319-Q335 HydrophobicContact CH2-CG 4.25Å; W319-Q335 HydrophobicContact CZ2-CG 4.13Å; W319-Q335 HydrophobicContact CZ3-CG 3.93Å; P331-Q335 WeakPolarHBondContact O-CB 3.46Å; P331-Q335 WeakPolarHBondContact O-CG 3.4Å; P331-Q335 PolarHBondContact O-N 2.6Å; W332-Q335 PolarHBondContact O-N 2.67Å; Q335-M337 VanDerWaalsContact C-N 3.34Å; Q335-N339 WeakPolarHBondContact O-CB 3.35Å; Q335-N339 VanDerWaalsContact O-CG 3.31Å; Q335-N339 PolarHBondContact O-N 2.79Å; Q335-N339 PolarHBondContact O-ND2 2.83Å
336R72.3Confident69.4Low60 Ų6057.5 Ų57.523%0.22628%0.276CS..Hα-helixtrans-66.5-39.6177.9-163.117985.3171.32.7111.1D279 W332 S333 V334 R340D279-R336 IonicContact OD1-NH2 3.87Å; D279-R336 IonicContact OD2-CZ 3.67Å; D279-R336 IonicContact OD2-NH1 3.08Å; D279-R336 PolarHBondContact OD2-NH1 2.74Å; D279-R336 IonicContact OD2-NH2 2.71Å; D279-R336 PolarHBondContact OD2-NH2 3.48Å; W332-R336 WeakPolarHBondContact O-CB 3.38Å; W332-R336 PolarHBondContact O-N 3.05Å; S333-R336 PolarHBondContact O-N 3.16Å; V334-R336 VanDerWaalsContact C-N 3.32Å; V334-R336 PolarHBondContact O-N 3Å; R336-R340 WeakPolarHBondContact O-CG 3.26Å; R336-R340 PolarHBondContact O-N 2.84Å
337M72.3Confident68.7Low24 Ų2460.2 Ų60.212%0.11830%0.295CS..Hα-helixtrans-63.1-49.5176.3-170.3-175.4-56.500111.3F289 A298 K299 L302 S333 V334 Q335 N339 R340 L341F289-M337 HydrophobicContact CD1-CE 4.26Å; F289-M337 HydrophobicContact CE1-CE 3.75Å; A298-M337 HydrophobicContact CB-CE 4.42Å; K299-M337 HydrophobicContact CB-SD 4.49Å; K299-M337 HydrophobicContact CG-CG 4.33Å; K299-M337 HydrophobicContact CG-SD 3.71Å; L302-M337 HydrophobicContact CD2-CB 3.82Å; L302-M337 HydrophobicContact CD2-CG 3.72Å; L302-M337 HydrophobicContact CD2-SD 3.6Å; L302-M337 VanDerWaalsContact CD2-SD 3.6Å; S333-M337 WeakPolarHBondContact O-CB 3.15Å; S333-M337 PolarHBondContact O-N 2.91Å; V334-M337 WeakPolarHBondContact O-CB 3.42Å; V334-M337 PolarHBondContact O-N 3Å; Q335-M337 VanDerWaalsContact C-N 3.34Å; M337-N339 PolarHBondContact O-N 2.86Å; M337-R340 PolarHBondContact O-N 3.36Å; M337-L341 HydrophobicContact CG-CD1 4.16Å; M337-L341 WeakPolarHBondContact O-CG 2.86Å; M337-L341 PolarHBondContact O-N 3.15Å
338F78.8Confident68.3Low2 Ų264.6 Ų64.61%0.00930%0.303CS..Hα-helixtrans-58.3-47.5175.9178.4-106.7000111.8L302 L306 W319 V334 R340 L341 K342 I359 I360 L363L302-F338 HydrophobicContact CD2-CB 4.21Å; L306-F338 HydrophobicContact CD1-CD2 3.42Å; L306-F338 VanDerWaalsContact CD1-CD2 3.42Å; L306-F338 HydrophobicContact CD1-CE2 3.7Å; L306-F338 HydrophobicContact CD1-CG 4.14Å; W319-F338 HydrophobicContact CH2-CB 4.08Å; W319-F338 AromaticContact CH2-CD1 3.65Å; W319-F338 HydrophobicContact CH2-CD1 3.65Å; W319-F338 HydrophobicContact CH2-CE1 4.26Å; W319-F338 AromaticContact CH2-CG 3.92Å; W319-F338 HydrophobicContact CH2-CG 3.92Å; W319-F338 HydrophobicContact CZ2-CD1 4.47Å; W319-F338 HydrophobicContact CZ3-CB 4.14Å; W319-F338 HydrophobicContact CZ3-CG 4.39Å; V334-F338 WeakPolarHBondContact O-CB 3.28Å; V334-F338 PolarHBondContact O-N 3.32Å; F338-R340 VanDerWaalsContact C-N 3.31Å; F338-R340 PolarHBondContact O-N 2.84Å; F338-L341 PolarHBondContact O-N 3.27Å; F338-K342 WeakPolarHBondContact O-CB 3.4Å; F338-K342 PolarHBondContact O-N 2.77Å; F338-I359 HydrophobicContact CZ-CG2 4.24Å; F338-I360 HydrophobicContact CE2-CG1 4.12Å; F338-I360 HydrophobicContact CZ-CG1 4.21Å; F338-L363 HydrophobicContact CD2-CD1 4.27Å; F338-L363 HydrophobicContact CE2-CD1 3.79Å
339N73Confident68.1Low75 Ų7560.6 Ų60.640%0.40128%0.279SS..Hα-helixtrans-61.2-38.1178-77.5-52.7000112.6Q335 M337 Q343Q335-N339 WeakPolarHBondContact O-CB 3.35Å; Q335-N339 VanDerWaalsContact O-CG 3.31Å; Q335-N339 PolarHBondContact O-N 2.79Å; Q335-N339 PolarHBondContact O-ND2 2.83Å; M337-N339 PolarHBondContact O-N 2.86Å; N339-Q343 WeakPolarHBondContact O-CB 3.39Å; N339-Q343 WeakPolarHBondContact O-CG 3.38Å; N339-Q343 PolarHBondContact O-N 2.7Å
340R75.3Confident67.4Low125 Ų12567.4 Ų67.447%0.47231%0.31SS..Hα-helixtrans-68.3-40.1175.1-75175.5179.2174.2-1.5112.3R336 M337 F338 R344R336-R340 WeakPolarHBondContact O-CG 3.26Å; R336-R340 PolarHBondContact O-N 2.84Å; M337-R340 PolarHBondContact O-N 3.36Å; F338-R340 VanDerWaalsContact C-N 3.31Å; F338-R340 PolarHBondContact O-N 2.84Å; R340-R344 WeakPolarHBondContact O-CB 3.18Å; R340-R344 WeakPolarHBondContact O-CG 3.5Å; R340-R344 PolarHBondContact O-N 3.32Å
341L74.8Confident66.5Low15 Ų1572.7 Ų72.78%0.07934%0.337CS..Hα-helixtrans-63.7-46.1176.2-73.7166.3000110.8K299 L302 I303 M337 F338 R344 N345 L363K299-L341 HydrophobicContact CB-CD1 4.44Å; K299-L341 HydrophobicContact CD-CD2 4.36Å; K299-L341 HydrophobicContact CG-CD1 4.35Å; L302-L341 HydrophobicContact CD2-CD1 4.16Å; I303-L341 HydrophobicContact CD1-CD1 4.13Å; I303-L341 HydrophobicContact CG1-CD1 4.22Å; M337-L341 HydrophobicContact CG-CD1 4.16Å; M337-L341 WeakPolarHBondContact O-CG 2.86Å; M337-L341 PolarHBondContact O-N 3.15Å; F338-L341 PolarHBondContact O-N 3.27Å; L341-R344 PolarHBondContact O-N 3.35Å; L341-N345 WeakPolarHBondContact O-CB 3.37Å; L341-N345 PolarHBondContact O-N 3.24Å; L341-N345 PolarHBondContact O-ND2 3.07Å; L341-L363 HydrophobicContact CB-CD2 4.42Å
342K74.4Confident65.4Low35 Ų3573.7 Ų73.715%0.15234%0.339CS..Hα-helixtrans-55.5-53.9173.6176.7178.5170.4169.20111.4F338 R344 V346 F349 I359F338-K342 WeakPolarHBondContact O-CB 3.4Å; F338-K342 PolarHBondContact O-N 2.77Å; K342-R344 VanDerWaalsContact C-N 3.33Å; K342-R344 PolarHBondContact O-N 2.91Å; K342-V346 WeakPolarHBondContact O-CB 3.35Å; K342-V346 PolarHBondContact O-N 3.04Å; K342-V346 VanDerWaalsContact O-N 3.13Å; K342-F349 HydrophobicContact CG-CB 4.41Å; K342-I359 HydrophobicContact CD-CD1 4.36Å; K342-I359 HydrophobicContact CD-CG2 4.3Å; K342-I359 HydrophobicContact CG-CG2 4.21Å
343Q68.3Low64.4Low117 Ų11773.6 Ų73.655%0.54736%0.358SS..Hα-helixtrans-65.4-33.1-175.8-73.8174.2-2.200114N339 F349N339-Q343 WeakPolarHBondContact O-CB 3.39Å; N339-Q343 WeakPolarHBondContact O-CG 3.38Å; N339-Q343 PolarHBondContact O-N 2.7Å; Q343-F349 HydrophobicContact CB-CE1 4.26Å; Q343-F349 HydrophobicContact CB-CZ 4.13Å; Q343-F349 HydrophobicContact CG-CE1 4.25Å; Q343-F349 HydrophobicContact CG-CE2 4.01Å; Q343-F349 HydrophobicContact CG-CZ 3.65Å
344R65.4Low63.5Low211 Ų21178.4 Ų78.480%0.79638%0.377SS*.Hα-helixtrans-86.2-35.5-176.2-76.8-178.9141.3173.2-5113.8R340 L341 K342R340-R344 WeakPolarHBondContact O-CB 3.18Å; R340-R344 WeakPolarHBondContact O-CG 3.5Å; R340-R344 PolarHBondContact O-N 3.32Å; L341-R344 PolarHBondContact O-N 3.35Å; K342-R344 VanDerWaalsContact C-N 3.33Å; K342-R344 PolarHBondContact O-N 2.91Å
345N63.3Low62.4Low64 Ų6480.2 Ų80.234%0.34240%0.397SS..Hα-helixtrans-110-23.9-166.1-58.2-30.8000113.4L341 P347 F362 L363 V367L341-N345 WeakPolarHBondContact O-CB 3.37Å; L341-N345 PolarHBondContact O-N 3.24Å; L341-N345 PolarHBondContact O-ND2 3.07Å; N345-P347 VanDerWaalsContact O-CD 3.28Å; N345-P347 WeakPolarHBondContact O-CD 3.48Å; N345-F362 VanDerWaalsContact O-CE1 3.24Å; N345-F362 WeakPolarHBondContact O-CE1 3.26Å; N345-L363 HydrophobicContact CB-CD2 4.18Å; N345-V367 HydrophobicContact CB-CG2 3.7Å; N345-V367 WeakPolarHBondContact ND2-CG1 3.48Å
346V65.5Low61.6Low8 Ų877.2 Ų77.25%0.04838%0.383CS..SBendtrans-95.2108.1-176.5-173.10000109.1K342 F349 L352 I359 F362 L363K342-V346 WeakPolarHBondContact O-CB 3.35Å; K342-V346 PolarHBondContact O-N 3.04Å; K342-V346 VanDerWaalsContact O-N 3.13Å; V346-F349 HydrophobicContact CB-CB 4.38Å; V346-F349 HydrophobicContact CG1-CB 4.3Å; V346-F349 WeakPolarHBondContact O-CD1 3.4Å; V346-L352 HydrophobicContact CG1-CD1 4.16Å; V346-I359 HydrophobicContact CG2-CG2 4.35Å; V346-F362 HydrophobicContact CB-CD1 4.46Å; V346-F362 HydrophobicContact CG1-CD1 4.46Å; V346-F362 HydrophobicContact CG2-CD1 3.86Å; V346-F362 HydrophobicContact CG2-CE1 4.3Å; V346-L363 HydrophobicContact CG2-CD2 3.79Å; V346-L363 HydrophobicContact CG2-CG 4.05Å
347P58.2Low60.9Low75 Ų7577.3 Ų77.349%0.48739%0.388SS..THydrogen-bonded Turntrans-65.7145178.726.6-32.7000111.1N345 F349 F362N345-P347 VanDerWaalsContact O-CD 3.28Å; N345-P347 WeakPolarHBondContact O-CD 3.48Å; P347-F349 PolarHBondContact O-N 3.31Å; P347-F349 VanDerWaalsContact O-N 3.14Å; P347-F362 HydrophobicContact CG-CZ 4.48Å
348H55.5Low60.4Low136 Ų13680.9 Ų80.963%0.6340%0.404SS*.THydrogen-bonded Turntrans5625.8177.2-52.2100.8000116.1H350 L351 L352H348-H350 PolarHBondContact O-N 3.1Å; H348-L351 HydrophobicContact CB-CB 4.49Å; H348-L351 HydrophobicContact CB-CD1 4.38Å; H348-L351 PolarHBondContact O-N 2.99Å; H348-L352 PolarHBondContact O-N 3.34Å
349F51.7Low60Low41 Ų4181.1 Ų81.118%0.1841%0.405CS..THydrogen-bonded Turntrans-56.8-14.2-179.574-92.3000115.6K342 Q343 V346 P347K342-F349 HydrophobicContact CG-CB 4.41Å; Q343-F349 HydrophobicContact CB-CE1 4.26Å; Q343-F349 HydrophobicContact CB-CZ 4.13Å; Q343-F349 HydrophobicContact CG-CE1 4.25Å; Q343-F349 HydrophobicContact CG-CE2 4.01Å; Q343-F349 HydrophobicContact CG-CZ 3.65Å; V346-F349 HydrophobicContact CB-CB 4.38Å; V346-F349 HydrophobicContact CG1-CB 4.3Å; V346-F349 WeakPolarHBondContact O-CD1 3.4Å; P347-F349 PolarHBondContact O-N 3.31Å; P347-F349 VanDerWaalsContact O-N 3.14Å
350H48.8Very low60Low154 Ų15477.8 Ų77.871%0.71339%0.387SS*.THydrogen-bonded Turntrans-82.1-21.8174.5-59-73.1000114H348H348-H350 PolarHBondContact O-N 3.1Å
351L47.7Very low60Low136 Ų13674.2 Ų74.271%0.71238%0.378SS*.THydrogen-bonded Turntrans-104.9-12.7-176.3-66.9166.6000112.5H348 S353H348-L351 HydrophobicContact CB-CB 4.49Å; H348-L351 HydrophobicContact CB-CD1 4.38Å; H348-L351 PolarHBondContact O-N 2.99Å; L351-S353 PolarHBondContact O-N 3.31Å
352L47Very low60.1Low67 Ų6777 Ų7735%0.35139%0.389SS..  trans-74.4112.2178.7-64.3174.3000109.4V346 H348 F354V346-L352 HydrophobicContact CG1-CD1 4.16Å; H348-L352 PolarHBondContact O-N 3.34Å; L352-F354 HydrophobicContact CB-CB 4.42Å; L352-F354 HydrophobicContact CB-CD2 3.88Å; L352-F354 HydrophobicContact CD2-CD2 3.54Å; L352-F354 HydrophobicContact CD2-CE2 3.93Å; L352-F354 HydrophobicContact CG-CD2 4.29Å; L352-F354 PolarHBondContact O-N 3.11Å
353S45.3Very low60.2Low124 Ų12475.3 Ų75.387%0.86738%0.382SS*.  trans-76.912.4163.4-71.80000112.6L351L351-S353 PolarHBondContact O-N 3.31Å
354F46.8Very low60.8Low112 Ų11273.2 Ų73.249%0.49137%0.369SS..  trans-92.4140.5-167.2-62.5-83.5000111.5L352 E358L352-F354 HydrophobicContact CB-CB 4.42Å; L352-F354 HydrophobicContact CB-CD2 3.88Å; L352-F354 HydrophobicContact CD2-CD2 3.54Å; L352-F354 HydrophobicContact CD2-CE2 3.93Å; L352-F354 HydrophobicContact CG-CD2 4.29Å; L352-F354 PolarHBondContact O-N 3.11Å; F354-E358 HydrophobicContact CB-CB 4.29Å; F354-E358 HydrophobicContact CB-CG 4.39Å; F354-E358 WeakPolarHBondContact CB-OE2 3.47Å; F354-E358 VanDerWaalsContact CD1-OE1 3.25Å; F354-E358 WeakPolarHBondContact CD1-OE1 3.43Å; F354-E358 WeakPolarHBondContact CD1-OE2 3.38Å; F354-E358 WeakPolarHBondContact CG-OE2 3.31Å
355G53.5Low61.3Low39 Ų3968.1 Ų68.140%0.40235%0.354SS..  trans-57.6174.4-171.100000114.8L357 E358G355-L357 PolarHBondContact O-N 3.08Å; G355-E358 PolarHBondContact O-N 3.07Å
356A54.8Low61.8Low2 Ų273.7 Ų73.72%0.01737%0.371CS..Hα-helixtrans-56.6-33.8177.600000112.2D312 I314 E358 I359 I360D312-A356 PolarHBondContact O-N 3.05Å; I314-A356 HydrophobicContact CB-CB 4.43Å; I314-A356 HydrophobicContact CG1-CB 3.58Å; A356-E358 PolarHBondContact O-N 3.06Å; A356-I359 PolarHBondContact O-N 2.95Å; A356-I360 HydrophobicContact CB-CD1 4.2Å; A356-I360 WeakPolarHBondContact O-CB 3.24Å; A356-I360 WeakPolarHBondContact O-CD1 3.43Å; A356-I360 WeakPolarHBondContact O-CG1 3.47Å; A356-I360 PolarHBondContact O-N 3.05Å
357L57.6Low62.2Low62 Ų6274 Ų7433%0.32537%0.372SS..Hα-helixtrans-53.7-53.8-179.6-149.698.8000112.5G355 I359 I360 D361G355-L357 PolarHBondContact O-N 3.08Å; L357-I359 VanDerWaalsContact C-N 3.32Å; L357-I359 PolarHBondContact O-N 2.85Å; L357-I360 PolarHBondContact O-N 3.29Å; L357-I360 VanDerWaalsContact O-N 3.15Å; L357-D361 WeakPolarHBondContact O-CB 3.32Å; L357-D361 PolarHBondContact O-N 3.38Å
358E63Low63.2Low99 Ų9970.6 Ų70.646%0.46335%0.35SS..Hα-helixtrans-68.7-31-174.7-66.3-176.6-158.800113.4F354 G355 A356 F362F354-E358 HydrophobicContact CB-CB 4.29Å; F354-E358 HydrophobicContact CB-CG 4.39Å; F354-E358 WeakPolarHBondContact CB-OE2 3.47Å; F354-E358 VanDerWaalsContact CD1-OE1 3.25Å; F354-E358 WeakPolarHBondContact CD1-OE1 3.43Å; F354-E358 WeakPolarHBondContact CD1-OE2 3.38Å; F354-E358 WeakPolarHBondContact CG-OE2 3.31Å; G355-E358 PolarHBondContact O-N 3.07Å; A356-E358 PolarHBondContact O-N 3.06Å; E358-F362 VanDerWaalsContact O-CB 3.31Å; E358-F362 WeakPolarHBondContact O-CB 3.4Å; E358-F362 PolarHBondContact O-N 3.27Å
359I70.1Confident64.2Low6 Ų667 Ų673%0.03134%0.339CS..Hα-helixtrans-69.2-43.9174.4-67171.5000109.9F338 K342 V346 A356 L357 L363F338-I359 HydrophobicContact CZ-CG2 4.24Å; K342-I359 HydrophobicContact CD-CD1 4.36Å; K342-I359 HydrophobicContact CD-CG2 4.3Å; K342-I359 HydrophobicContact CG-CG2 4.21Å; V346-I359 HydrophobicContact CG2-CG2 4.35Å; A356-I359 PolarHBondContact O-N 2.95Å; L357-I359 VanDerWaalsContact C-N 3.32Å; L357-I359 PolarHBondContact O-N 2.85Å; I359-L363 HydrophobicContact CG2-CD1 4.24Å; I359-L363 WeakPolarHBondContact O-CB 3.47Å; I359-L363 VanDerWaalsContact O-CG 3.24Å; I359-L363 WeakPolarHBondContact O-CG 3.46Å; I359-L363 PolarHBondContact O-N 2.87Å
360I72.5Confident65.2Low5 Ų568.3 Ų68.33%0.02635%0.35CS..Hα-helixtrans-69-43179.9-67164.8000109.9L306 Y307 I317 F338 A356 L357 F362 L363 Y364L306-I360 HydrophobicContact CB-CD1 4.16Å; L306-I360 HydrophobicContact CB-CG1 4.35Å; L306-I360 HydrophobicContact CB-CG2 4.03Å; Y307-I360 HydrophobicContact CD2-CG2 4.36Å; I317-I360 HydrophobicContact CD1-CD1 4.41Å; F338-I360 HydrophobicContact CE2-CG1 4.12Å; F338-I360 HydrophobicContact CZ-CG1 4.21Å; A356-I360 HydrophobicContact CB-CD1 4.2Å; A356-I360 WeakPolarHBondContact O-CB 3.24Å; A356-I360 WeakPolarHBondContact O-CD1 3.43Å; A356-I360 WeakPolarHBondContact O-CG1 3.47Å; A356-I360 PolarHBondContact O-N 3.05Å; L357-I360 PolarHBondContact O-N 3.29Å; L357-I360 VanDerWaalsContact O-N 3.15Å; I360-F362 PolarHBondContact O-N 3.5Å; I360-L363 CarbonylContact O-C 3.53Å; I360-L363 PolarHBondContact O-N 3.27Å; I360-Y364 WeakPolarHBondContact O-CB 3.49Å; I360-Y364 PolarHBondContact O-N 3.4Å
361D74.8Confident66.3Low51 Ų5161.5 Ų61.527%0.27332%0.319SS..Hα-helixtrans-57.7-46.2173.8-80.314.6000111.8Y307 L357 L363 Y364 H365Y307-D361 WeakPolarHBondContact CD2-OD1 3.43Å; Y307-D361 WeakPolarHBondContact CE2-OD1 3.47Å; L357-D361 WeakPolarHBondContact O-CB 3.32Å; L357-D361 PolarHBondContact O-N 3.38Å; D361-L363 PolarHBondContact O-N 3.22Å; D361-Y364 PolarHBondContact O-N 2.96Å; D361-H365 WeakPolarHBondContact O-CB 3.28Å; D361-H365 PolarHBondContact O-CD2 3.33Å; D361-H365 VanDerWaalsContact O-CD2 3.22Å; D361-H365 PolarHBondContact O-N 3.21Å
362F77.5Confident67.6Low72 Ų7258.9 Ų58.932%0.31630%0.303SS..Hα-helixtrans-61.7-45.6176.4-178.4-83.7000111.2N345 V346 P347 E358 I360 Y364 R366 V367N345-F362 VanDerWaalsContact O-CE1 3.24Å; N345-F362 WeakPolarHBondContact O-CE1 3.26Å; V346-F362 HydrophobicContact CB-CD1 4.46Å; V346-F362 HydrophobicContact CG1-CD1 4.46Å; V346-F362 HydrophobicContact CG2-CD1 3.86Å; V346-F362 HydrophobicContact CG2-CE1 4.3Å; P347-F362 HydrophobicContact CG-CZ 4.48Å; E358-F362 VanDerWaalsContact O-CB 3.31Å; E358-F362 WeakPolarHBondContact O-CB 3.4Å; E358-F362 PolarHBondContact O-N 3.27Å; I360-F362 PolarHBondContact O-N 3.5Å; F362-Y364 VanDerWaalsContact C-N 3.33Å; F362-Y364 PolarHBondContact O-N 3.47Å; F362-R366 HydrophobicContact CD2-CG 4.1Å; F362-R366 HydrophobicContact CE1-CB 4.25Å; F362-R366 HydrophobicContact CE2-CB 4.44Å; F362-R366 HydrophobicContact CE2-CG 3.95Å; F362-R366 HydrophobicContact CZ-CB 4.22Å; F362-R366 HydrophobicContact CZ-CG 4.23Å; F362-R366 VanDerWaalsContact O-CB 3.25Å; F362-R366 WeakPolarHBondContact O-CB 3.49Å; F362-R366 PolarHBondContact O-N 3.46Å; F362-V367 HydrophobicContact CE1-CG2 4.48Å
363L77.6Confident68.8Low0 Ų063.2 Ų63.20%032%0.319CS..Iπ-helixtrans-63-40.8177.4-70.6175.2000111.1I303 F338 L341 N345 V346 I359 I360 D361 V367 V368I303-L363 HydrophobicContact CD1-CB 4.25Å; I303-L363 HydrophobicContact CG1-CB 4.32Å; I303-L363 HydrophobicContact CG2-CB 3.85Å; F338-L363 HydrophobicContact CD2-CD1 4.27Å; F338-L363 HydrophobicContact CE2-CD1 3.79Å; L341-L363 HydrophobicContact CB-CD2 4.42Å; N345-L363 HydrophobicContact CB-CD2 4.18Å; V346-L363 HydrophobicContact CG2-CD2 3.79Å; V346-L363 HydrophobicContact CG2-CG 4.05Å; I359-L363 HydrophobicContact CG2-CD1 4.24Å; I359-L363 WeakPolarHBondContact O-CB 3.47Å; I359-L363 VanDerWaalsContact O-CG 3.24Å; I359-L363 WeakPolarHBondContact O-CG 3.46Å; I359-L363 PolarHBondContact O-N 2.87Å; I360-L363 CarbonylContact O-C 3.53Å; I360-L363 PolarHBondContact O-N 3.27Å; D361-L363 PolarHBondContact O-N 3.22Å; L363-V367 HydrophobicContact CD2-CB 4.32Å; L363-V367 HydrophobicContact CD2-CG2 3.78Å; L363-V367 WeakPolarHBondContact O-CA 3.15Å; L363-V367 WeakPolarHBondContact O-CB 3.31Å; L363-V367 PolarHBondContact O-N 3.03Å; L363-V368 PolarHBondContact O-N 3.05Å
364Y81.1Confident69.7Low73 Ų7363.5 Ų63.529%0.28630%0.301SS..Iπ-helixtrans-67.4-55179.1-171.3-92.6000111.1I303 Y307 I360 D361 F362 V368 P369I303-Y364 HydrophobicContact CG2-CD2 4.26Å; Y307-Y364 HydrophobicContact CD1-CD1 4.29Å; Y307-Y364 HydrophobicContact CD1-CD2 4.12Å; Y307-Y364 HydrophobicContact CD1-CE1 4.27Å; Y307-Y364 HydrophobicContact CD1-CE2 4.09Å; Y307-Y364 HydrophobicContact CD1-CG 4.22Å; Y307-Y364 HydrophobicContact CD2-CD1 4.18Å; Y307-Y364 HydrophobicContact CD2-CD2 4.34Å; Y307-Y364 AromaticContact CD2-CG 3.87Å; Y307-Y364 HydrophobicContact CD2-CG 3.87Å; Y307-Y364 HydrophobicContact CE1-CD1 4.28Å; Y307-Y364 HydrophobicContact CE1-CE1 4.16Å; Y307-Y364 HydrophobicContact CE2-CD1 4.17Å; Y307-Y364 HydrophobicContact CE2-CG 4.31Å; Y307-Y364 HydrophobicContact CG-CD1 4.23Å; Y307-Y364 AromaticContact CG-CD2 3.82Å; Y307-Y364 HydrophobicContact CG-CD2 3.82Å; Y307-Y364 HydrophobicContact CG-CE2 4.25Å; Y307-Y364 AromaticContact CG-CG 3.81Å; Y307-Y364 HydrophobicContact CG-CG 3.81Å; I360-Y364 WeakPolarHBondContact O-CB 3.49Å; I360-Y364 PolarHBondContact O-N 3.4Å; D361-Y364 PolarHBondContact O-N 2.96Å; F362-Y364 VanDerWaalsContact C-N 3.33Å; F362-Y364 PolarHBondContact O-N 3.47Å; Y364-V368 HydrophobicContact CD2-CG2 4.34Å; Y364-V368 VanDerWaalsContact O-CB 3.3Å; Y364-V368 WeakPolarHBondContact O-CB 3.45Å; Y364-P369 VanDerWaalsContact O-CD 3.28Å; Y364-P369 WeakPolarHBondContact O-CD 3.35Å
365H75.4Confident70.8Confident105 Ų10559.2 Ų59.249%0.48628%0.283SS..Iπ-helixtrans-76.1-28.3-174.3-67.2-61.8000114.5Y307 D361 P369Y307-H365 AromaticContact CE2-NE2 3.97Å; D361-H365 WeakPolarHBondContact O-CB 3.28Å; D361-H365 PolarHBondContact O-CD2 3.33Å; D361-H365 VanDerWaalsContact O-CD2 3.22Å; D361-H365 PolarHBondContact O-N 3.21Å; H365-P369 WeakPolarHBondContact O-CG 3.11Å
366R73.1Confident71.5Confident180 Ų18064.5 Ų64.568%0.67929%0.291SS*.Iπ-helixtrans-105.9-34.1-175.8-59.4-64.8-172.3167.6-0.7113.9F362 V370F362-R366 HydrophobicContact CD2-CG 4.1Å; F362-R366 HydrophobicContact CE1-CB 4.25Å; F362-R366 HydrophobicContact CE2-CB 4.44Å; F362-R366 HydrophobicContact CE2-CG 3.95Å; F362-R366 HydrophobicContact CZ-CB 4.22Å; F362-R366 HydrophobicContact CZ-CG 4.23Å; F362-R366 VanDerWaalsContact O-CB 3.25Å; F362-R366 WeakPolarHBondContact O-CB 3.49Å; F362-R366 PolarHBondContact O-N 3.46Å; R366-V370 WeakPolarHBondContact O-CG2 3.34Å
367V74.9Confident71.6Confident14 Ų1467 Ų679%0.08531%0.309CS..Iπ-helixtrans-97.1-41.9-173.3-175.60000111.8I303 N345 F362 L363 V370 L371I303-V367 HydrophobicContact CD1-CG1 4.46Å; N345-V367 HydrophobicContact CB-CG2 3.7Å; N345-V367 WeakPolarHBondContact ND2-CG1 3.48Å; F362-V367 HydrophobicContact CE1-CG2 4.48Å; L363-V367 HydrophobicContact CD2-CB 4.32Å; L363-V367 HydrophobicContact CD2-CG2 3.78Å; L363-V367 WeakPolarHBondContact O-CA 3.15Å; L363-V367 WeakPolarHBondContact O-CB 3.31Å; L363-V367 PolarHBondContact O-N 3.03Å; V367-V370 PolarHBondContact O-N 3.33Å; V367-V370 VanDerWaalsContact O-N 3.17Å; V367-L371 HydrophobicContact CG1-CD1 3.85Å; V367-L371 HydrophobicContact CG1-CG 4.05Å; V367-L371 WeakPolarHBondContact O-CG 3.44Å; V367-L371 PolarHBondContact O-N 3.3Å
368V79.1Confident71.3Confident4 Ų467.6 Ų67.62%0.02431%0.309CS..Hα-helixtrans-57.3-45.5179.6172.20000112.8I300 I303 L363 Y364 V370 L371 Q372I300-V368 HydrophobicContact CG1-CG1 4.33Å; I300-V368 HydrophobicContact CG2-CG1 3.93Å; I303-V368 HydrophobicContact CB-CG2 3.73Å; I303-V368 HydrophobicContact CD1-CG2 3.89Å; I303-V368 HydrophobicContact CG1-CG2 4.43Å; I303-V368 HydrophobicContact CG2-CG2 3.53Å; L363-V368 PolarHBondContact O-N 3.05Å; Y364-V368 HydrophobicContact CD2-CG2 4.34Å; Y364-V368 VanDerWaalsContact O-CB 3.3Å; Y364-V368 WeakPolarHBondContact O-CB 3.45Å; V368-V370 VanDerWaalsContact C-N 3.27Å; V368-V370 PolarHBondContact O-N 2.91Å; V368-L371 PolarHBondContact O-N 3.03Å; V368-L371 VanDerWaalsContact O-N 3.1Å; V368-Q372 HydrophobicContact CG1-CG 4.1Å; V368-Q372 WeakPolarHBondContact O-CG 3.43Å; V368-Q372 PolarHBondContact O-N 2.97Å
369P76.6Confident70.8Confident60 Ų6066.8 Ų66.839%0.3931%0.308SS..Hα-helixtrans-61.2-34.9178.3-26.635.6000113.5Y364 H365 K373Y364-P369 VanDerWaalsContact O-CD 3.28Å; Y364-P369 WeakPolarHBondContact O-CD 3.35Å; H365-P369 WeakPolarHBondContact O-CG 3.11Å; P369-K373 WeakPolarHBondContact O-CB 3.09Å; P369-K373 PolarHBondContact O-N 2.74Å
370V72Confident69.5Low70 Ų7075.8 Ų75.842%0.42434%0.341SS..Hα-helixtrans-70.1-40.6176.4178.70000110.6R366 V367 V368 K373 R374R366-V370 WeakPolarHBondContact O-CG2 3.34Å; V367-V370 PolarHBondContact O-N 3.33Å; V367-V370 VanDerWaalsContact O-N 3.17Å; V368-V370 VanDerWaalsContact C-N 3.27Å; V368-V370 PolarHBondContact O-N 2.91Å; V370-K373 PolarHBondContact O-N 3Å; V370-R374 WeakPolarHBondContact O-CG 3.35Å; V370-R374 PolarHBondContact O-N 3.17Å
371L71.4Confident67.7Low11 Ų1185.9 Ų85.96%0.05838%0.379CS..Hα-helixtrans-65.3-42.3175-64172.9000111.4Y296 K299 I300 I303 V367 V368 K373 R374 L375Y296-L371 HydrophobicContact CD1-CB 4.33Å; Y296-L371 HydrophobicContact CD1-CD2 3.66Å; Y296-L371 HydrophobicContact CE1-CD2 3.9Å; K299-L371 HydrophobicContact CB-CD1 3.84Å; K299-L371 HydrophobicContact CD-CD2 4.35Å; I300-L371 HydrophobicContact CD1-CB 4Å; I300-L371 HydrophobicContact CG1-CB 3.77Å; I300-L371 HydrophobicContact CG1-CD1 4.31Å; I303-L371 HydrophobicContact CD1-CD1 4.1Å; V367-L371 HydrophobicContact CG1-CD1 3.85Å; V367-L371 HydrophobicContact CG1-CG 4.05Å; V367-L371 WeakPolarHBondContact O-CG 3.44Å; V367-L371 PolarHBondContact O-N 3.3Å; V368-L371 PolarHBondContact O-N 3.03Å; V368-L371 VanDerWaalsContact O-N 3.1Å; L371-K373 PolarHBondContact O-N 3.4Å; L371-R374 PolarHBondContact O-N 3.29Å; L371-L375 WeakPolarHBondContact O-CB 3.49Å; L371-L375 PolarHBondContact O-N 2.96Å
372Q76.4Confident66.2Low80 Ų8086.1 Ų86.137%0.37439%0.388SS..Hα-helixtrans-64.5-37.2175.1-73.4174.2-18.400112.4I300 V368 R374 L375 R376I300-Q372 HydrophobicContact CD1-CB 4.46Å; I300-Q372 HydrophobicContact CD1-CG 3.7Å; I300-Q372 HydrophobicContact CG1-CG 4.36Å; V368-Q372 HydrophobicContact CG1-CG 4.1Å; V368-Q372 WeakPolarHBondContact O-CG 3.43Å; V368-Q372 PolarHBondContact O-N 2.97Å; Q372-R374 VanDerWaalsContact C-N 3.34Å; Q372-L375 PolarHBondContact O-N 2.97Å; Q372-R376 WeakPolarHBondContact O-CG 3.25Å; Q372-R376 PolarHBondContact O-N 2.94Å; Q372-R376 VanDerWaalsContact O-N 3.08Å; Q372-R376 PolarHBondContact O-NE 3.45Å
373K70.6Confident64.5Low158 Ų15891.3 Ų91.369%0.68741%0.413SS*.Hα-helixtrans-66-38174.2-169.7175.9-178.4178.20111.7P369 V370 L371 S377P369-K373 WeakPolarHBondContact O-CB 3.09Å; P369-K373 PolarHBondContact O-N 2.74Å; V370-K373 PolarHBondContact O-N 3Å; L371-K373 PolarHBondContact O-N 3.4Å; K373-S377 PolarHBondContact O-N 3.13Å
374R65.4Low62.7Low131 Ų13199 Ų9949%0.49445%0.454SS..Hα-helixtrans-72-35.1175.9-72.1177.6-178.5-173.92.1112.8Y296 V370 L371 Q372 S377 F378Y296-R374 HydrophobicContact CD1-CB 4.33Å; Y296-R374 HydrophobicContact CE1-CB 3.91Å; V370-R374 WeakPolarHBondContact O-CG 3.35Å; V370-R374 PolarHBondContact O-N 3.17Å; L371-R374 PolarHBondContact O-N 3.29Å; Q372-R374 VanDerWaalsContact C-N 3.34Å; R374-S377 WeakPolarHBondContact CA-OG 3.45Å; R374-S377 PolarHBondContact O-N 3.02Å; R374-S377 PolarHBondContact O-OG 3.15Å; R374-F378 PolarHBondContact O-N 2.64Å
375L69.8Low60.6Low21 Ų21104.1 Ų104.111%0.1148%0.48CS..Hα-helixtrans-60.7-49.8172.1179.265.1000111A293 N297 I300 L371 Q372 S377 F378 D379A293-L375 HydrophobicContact CB-CD1 3.54Å; A293-L375 WeakPolarHBondContact O-CD1 3.45Å; N297-L375 WeakPolarHBondContact OD1-CD2 3.14Å; I300-L375 HydrophobicContact CD1-CD2 4.19Å; L371-L375 WeakPolarHBondContact O-CB 3.49Å; L371-L375 PolarHBondContact O-N 2.96Å; Q372-L375 PolarHBondContact O-N 2.97Å; L375-S377 PolarHBondContact O-N 3.01Å; L375-S377 VanDerWaalsContact O-N 3.17Å; L375-F378 WeakPolarHBondContact O-CA 3.07Å; L375-F378 WeakPolarHBondContact O-CB 3.16Å; L375-F378 PolarHBondContact O-N 2.78Å; L375-D379 PolarHBondContact O-N 3.22Å
376R66.9Low58.6Low150 Ų150108.3 Ų108.357%0.56650%0.5SS*.Hα-helixtrans-62.1-23.8175.9-72-178.3-75.7-155.1-1.4114.4Q372Q372-R376 WeakPolarHBondContact O-CG 3.25Å; Q372-R376 PolarHBondContact O-N 2.94Å; Q372-R376 VanDerWaalsContact O-N 3.08Å; Q372-R376 PolarHBondContact O-NE 3.45Å
377S57.2Low56.7Low55 Ų55111.1 Ų111.139%0.38551%0.511SS..Hα-helixtrans-79-22.1170.957.50000113.3K373 R374 L375K373-S377 PolarHBondContact O-N 3.13Å; R374-S377 WeakPolarHBondContact CA-OG 3.45Å; R374-S377 PolarHBondContact O-N 3.02Å; R374-S377 PolarHBondContact O-OG 3.15Å; L375-S377 PolarHBondContact O-N 3.01Å; L375-S377 VanDerWaalsContact O-N 3.17Å
378F52Low54.6Low75 Ų75115.9 Ų115.933%0.32954%0.543SS..Hα-helixtrans-83.4-33.8174.8-102.6-88.6000112.6R291 Y296 R374 L375 R380 W381 A382R291-F378 WeakPolarHBondContact O-CE2 3.39Å; R291-F378 WeakPolarHBondContact O-CZ 3.25Å; Y296-F378 HydrophobicContact CD2-CD2 4.47Å; Y296-F378 AromaticContact CE2-CD2 3.9Å; Y296-F378 HydrophobicContact CE2-CD2 3.9Å; Y296-F378 AromaticContact CE2-CE2 3.92Å; Y296-F378 HydrophobicContact CE2-CE2 3.92Å; R374-F378 PolarHBondContact O-N 2.64Å; L375-F378 WeakPolarHBondContact O-CA 3.07Å; L375-F378 WeakPolarHBondContact O-CB 3.16Å; L375-F378 PolarHBondContact O-N 2.78Å; F378-R380 PolarHBondContact O-N 3.21Å; F378-W381 CarbonylContact O-C 3.59Å; F378-W381 WeakPolarHBondContact O-CA 3.18Å; F378-W381 PolarHBondContact O-N 2.9Å; F378-A382 PolarHBondContact O-N 3.28Å
379D52.2Low52.6Low82 Ų82121.3 Ų121.344%0.43958%0.581SS.*Hα-helixtrans-58.7-33.1175.5-63.2-31.4000111.8L375 W381 A382L375-D379 PolarHBondContact O-N 3.22Å; D379-W381 PolarHBondContact O-N 2.83Å; D379-A382 PolarHBondContact O-N 3.16Å
380R43.5Very low50.8Low194 Ų194127.1 Ų127.173%0.73260%0.603SS**Hα-helixtrans-70.2-13.9172.7-79.1-174.4-75.9-173.2-2.1115F378F378-R380 PolarHBondContact O-N 3.21Å
381W34.8Very low49.5Very low218 Ų218130.5 Ų130.583%0.82662%0.619SS**Hα-helixtrans-104.5-16.4175.2-108.766.8000112.1F378 D379F378-W381 CarbonylContact O-C 3.59Å; F378-W381 WeakPolarHBondContact O-CA 3.18Å; F378-W381 PolarHBondContact O-N 2.9Å; D379-W381 PolarHBondContact O-N 2.83Å
382A42.7Very low48.1Very low56 Ų56139.9 Ų139.946%0.46365%0.653SS.*Hα-helixtrans-81.7-16.8-177.500000113.8F378 D379 L384 Q385F378-A382 PolarHBondContact O-N 3.28Å; D379-A382 PolarHBondContact O-N 3.16Å; A382-L384 PolarHBondContact O-N 3.37Å; A382-Q385 PolarHBondContact O-N 3Å
383E41Very low46.7Very low180 Ų180138.5 Ų138.584%0.84165%0.645SS**THydrogen-bonded Turntrans-64.4-1.8173.1-81.1178.2163.400114.2
384L39.8Very low45.6Very low163 Ų163136.5 Ų136.585%0.85364%0.638SS**THydrogen-bonded Turntrans-116.35.6179.7-83.8165.6000115.5A382A382-L384 PolarHBondContact O-N 3.37Å
385Q37.8Very low44.6Very low179 Ų179132.2 Ų132.284%0.83663%0.625SS**  trans-148.174.6179.4-146.8148.2-6.400113.6A382A382-Q385 PolarHBondContact O-N 3Å
386E33.7Very low43.4Very low194 Ų194133.5 Ų133.591%0.90764%0.635SS**  trans-95.499172.9-156.4172-143.400110
387R32.2Very low42.5Very low239 Ų239130.4 Ų130.490%0.90263%0.63SS**  trans-177.9102.8152.2-105.7168176.1-168-1.1110.6
388C31.3Very low42.1Very low113 Ų113129.2 Ų129.276%0.76462%0.619SS**  173.3117.9129-108.70000109.9
389S37.9Very low41.9Very low118 Ų118126.5 Ų126.583%0.82561%0.608SS**  trans-135104.9166.3-23.60000106.8
390Q37.4Very low41.5Very low183 Ų183128.6 Ų128.686%0.85562%0.619SS**  trans-169.4113.8150.5-108.7165.412.100111.1R392Q390-R392 VanDerWaalsContact C-N 3.31Å; Q390-R392 PolarHBondContact O-N 3.21Å
391D45.7Very low41.2Very low140 Ų140122 Ų12275%0.74960%0.602SS**  trans-74.872.5174.5-101.6-25.7000111.4
392R41.4Very low41.3Very low208 Ų208116.4 Ų116.479%0.78559%0.588SS**  trans-143120.7169.6-68.6-170.3175.3-175.8-1.5110.6Q390Q390-R392 VanDerWaalsContact C-N 3.31Å; Q390-R392 PolarHBondContact O-N 3.21Å
393Y47.9Very low40.9Very low52 Ų52121.3 Ų121.320%0.20461%0.606CS.*  trans-103.9124.2176.2-56.8-76.8000109.8G243 M282G243-Y393 WeakPolarHBondContact CA-O 3.44Å; M282-Y393 HydrophobicContact CE-CE2 4.32Å
394Q46.1Very low40.6Very low115 Ų115122 Ų12254%0.53761%0.609SS.*  trans-82.4152.2170.4-60.3-158.510.700110.5S396 D397Q394-S396 WeakPolarHBondContact CB-OG 3.41Å; Q394-S396 PolarHBondContact O-N 2.98Å; Q394-D397 WeakPolarHBondContact CB-OD2 3.5Å; Q394-D397 PolarHBondContact N-OD2 2.88Å; Q394-D397 WeakPolarHBondContact O-CB 3.43Å; Q394-D397 PolarHBondContact O-N 2.88Å; Q394-D397 VanDerWaalsContact O-N 3.1Å
395L45.3Very low40.3Very low42 Ų42122.2 Ų122.222%0.2261%0.611CS.*Hα-helixtrans-60.1-35176.3-72.5168.7000110.9E234 A237 L244 D397 I398 F399E234-L395 HydrophobicContact CG-CD1 4.01Å; A237-L395 HydrophobicContact CB-CD1 4.49Å; L244-L395 HydrophobicContact CD1-CD2 4.13Å; L395-D397 VanDerWaalsContact C-N 3.32Å; L395-D397 PolarHBondContact O-N 2.69Å; L395-I398 WeakPolarHBondContact O-CB 3.45Å; L395-I398 PolarHBondContact O-N 3.1Å; L395-I398 VanDerWaalsContact O-N 3.11Å; L395-F399 HydrophobicContact CB-CD2 4.22Å; L395-F399 HydrophobicContact CD2-CD2 4.34Å; L395-F399 HydrophobicContact CD2-CE2 3.85Å; L395-F399 VanDerWaalsContact O-CB 3.25Å; L395-F399 WeakPolarHBondContact O-CB 3.34Å; L395-F399 WeakPolarHBondContact O-CD2 3.5Å; L395-F399 PolarHBondContact O-N 3.29Å
396S44Very low40.1Very low47 Ų47117.7 Ų117.733%0.32961%0.612SS.*Hα-helixtrans-56.1-39.8172.740.60000113.2Q394 I398 F399 N400Q394-S396 WeakPolarHBondContact CB-OG 3.41Å; Q394-S396 PolarHBondContact O-N 2.98Å; S396-I398 PolarHBondContact O-N 3.39Å; S396-F399 PolarHBondContact O-N 3.28Å; S396-F399 VanDerWaalsContact O-N 3.16Å; S396-N400 WeakPolarHBondContact O-CB 3.49Å; S396-N400 PolarHBondContact O-N 2.87Å
397D48.1Very low39.8Very low86 Ų86111.1 Ų111.146%0.4660%0.597SS.*Hα-helixtrans-69-22.9178.9-53.9-37.3000112.7Q394 L395Q394-D397 WeakPolarHBondContact CB-OD2 3.5Å; Q394-D397 PolarHBondContact N-OD2 2.88Å; Q394-D397 WeakPolarHBondContact O-CB 3.43Å; Q394-D397 PolarHBondContact O-N 2.88Å; Q394-D397 VanDerWaalsContact O-N 3.1Å; L395-D397 VanDerWaalsContact C-N 3.32Å; L395-D397 PolarHBondContact O-N 2.69Å
398I49.5Very low39.7Very low30 Ų30108.8 Ų108.815%0.15460%0.596CS.*Hα-helixtrans-84.9-23178-60.4172.5000110.7L249 L395 S396L249-I398 HydrophobicContact CD1-CD1 4.24Å; L249-I398 HydrophobicContact CD2-CD1 4.29Å; L395-I398 WeakPolarHBondContact O-CB 3.45Å; L395-I398 PolarHBondContact O-N 3.1Å; L395-I398 VanDerWaalsContact O-N 3.11Å; S396-I398 PolarHBondContact O-N 3.39Å
399F48.6Very low39.7Very low18 Ų18110 Ų1108%0.07960%0.6CS.*Hα-helixtrans-131.4-18-157.1-76.1-47.1000116.5K226 R230 W274 L395 S396K226-F399 HydrophobicContact CB-CE1 4.19Å; R230-F399 HydrophobicContact CB-CE1 3.92Å; R230-F399 HydrophobicContact CB-CE2 3.81Å; R230-F399 HydrophobicContact CB-CZ 3.41Å; R230-F399 VanDerWaalsContact CB-CZ 3.41Å; R230-F399 HydrophobicContact CG-CD2 3.96Å; R230-F399 HydrophobicContact CG-CE1 4.31Å; R230-F399 HydrophobicContact CG-CE2 3.48Å; R230-F399 VanDerWaalsContact CG-CE2 3.48Å; R230-F399 HydrophobicContact CG-CZ 3.66Å; R230-F399 VanDerWaalsContact CZ-CB 3.49Å; R230-F399 VanDerWaalsContact CZ-CD1 3.47Å; W274-F399 HydrophobicContact CH2-CZ 4.4Å; L395-F399 HydrophobicContact CB-CD2 4.22Å; L395-F399 HydrophobicContact CD2-CD2 4.34Å; L395-F399 HydrophobicContact CD2-CE2 3.85Å; L395-F399 VanDerWaalsContact O-CB 3.25Å; L395-F399 WeakPolarHBondContact O-CB 3.34Å; L395-F399 WeakPolarHBondContact O-CD2 3.5Å; L395-F399 PolarHBondContact O-N 3.29Å; S396-F399 PolarHBondContact O-N 3.28Å; S396-F399 VanDerWaalsContact O-N 3.16Å
400N43.8Very low39.4Very low126 Ų126111.3 Ų111.367%0.67460%0.598SS**  trans-114.783.7179.1-72.6-9.2000110.3S396S396-N400 WeakPolarHBondContact O-CB 3.49Å; S396-N400 PolarHBondContact O-N 2.87Å
401S35.8Very low39.2Very low54 Ų54113.8 Ų113.838%0.37862%0.617SS.*  trans-154.739.9159.881.80000111R281 L403R281-S401 PolarHBondContact NH1-OG 3.27Å; R281-S401 VanDerWaalsContact NH1-OG 3.07Å; R281-S401 PolarHBondContact NH2-OG 2.86Å; S401-L403 VanDerWaalsContact C-N 3.3Å
402D37.9Very low38.8Very low101 Ų101112.5 Ų112.554%0.5461%0.61SS.*  trans-97.426.1172.4-72.2-4.4000110.6
403L33.5Very low38.7Very low160 Ų160107.5 Ų107.584%0.83860%0.601SS**  trans-132.883.9176.2-67173.4000108.8S401S401-L403 VanDerWaalsContact C-N 3.3Å
404E35.7Very low38.2Very low195 Ų195110.6 Ų110.691%0.91162%0.623SS**  trans171.567.3151.7-95.4172.1-150.500108.3
405D32.2Very low37.7Very low167 Ų167110.3 Ų110.389%0.89363%0.628SS**  trans-141.849152.5-160.419.4000108.4
406G33.9Very low37.2Very low83 Ų83114.6 Ų114.686%0.85665%0.654SS**  trans-115.267.3166.600000107.3
407G27.2Very low36.8Very low57 Ų57119.1 Ų119.159%0.58868%0.675SS**  trans-127.994.9172.900000108.4V409G407-V409 PolarHBondContact O-N 3.42Å
408E31Very low36Very low190 Ų190121.4 Ų121.489%0.88869%0.691SS**  trans-41.4131.4161.3-71.6167.7150.400110.1
409V31.1Very low34.9Very low139 Ų139128.5 Ų128.584%0.84273%0.732SS**  trans-122.890.4155-175.40000105.8G407 D411G407-V409 PolarHBondContact O-N 3.42Å; V409-D411 PolarHBondContact O-N 3.36Å
410D31.2Very low33.8Very low145 Ų145137.7 Ų137.778%0.77579%0.787SS**  trans-59.7109.5149-90.5-26.3000107.6
411D32.5Very low32.9Very low235 Ų235138.7 Ų138.7100%1.25780%0.797SS**  179.30117.6-105.6-18.9000110.5V409V409-D411 PolarHBondContact O-N 3.36Å

Retrieved 411 of 411 residues in 302.5 ms (Link to these results)